USER MOD reduce.3.24.130724 H: found=0, std=0, add=545, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 544 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 42 THR OG1 : rot 61:sc= 2.2 USER MOD Set 1.2: A 71 LYS NZ :NH3+ -174:sc= 2.28 (180deg=1.11) USER MOD Set 2.1: A 13 THR OG1 : rot -48:sc= 0.987 USER MOD Set 2.2: A 14 CYS SG : rot 180:sc= -1.11 USER MOD Set 2.3: A 17 CYS SG : rot -84:sc= 0.856 USER MOD Single : A 4 LYS NZ :NH3+ 163:sc=-0.00246 (180deg=-0.145) USER MOD Single : A 12 MET CE :methyl -176:sc= -3.8! (180deg=-3.87!) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 1.2 K(o=1.2,f=-0.13) USER MOD Single : A 37 ASN : amide:sc= -1.56! C(o=-1.6!,f=-18!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 65:sc= 1.28 USER MOD Single : A 48 ASN : amide:sc= -0.217 K(o=-0.22,f=-2!) USER MOD Single : A 50 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0471) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -152:sc= 1.18 (180deg=1.04) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 111:sc= 1.02 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -101:sc= 0.968 (180deg=-0.927!) USER MOD ----------------------------------------------------------------- ATOM 34 N GLU A 3 2.751 13.060 4.998 1.00 10.00 N ATOM 35 CA GLU A 3 2.680 13.096 3.561 1.00 10.00 C ATOM 36 C GLU A 3 1.399 12.370 3.166 1.00 10.00 C ATOM 37 O GLU A 3 0.654 11.848 4.001 1.00 10.00 O ATOM 38 CB GLU A 3 3.955 12.512 2.930 1.00 10.00 C ATOM 39 CG GLU A 3 3.940 10.988 2.767 1.00 10.00 C ATOM 40 CD GLU A 3 5.352 10.437 2.657 1.00 10.00 C ATOM 41 OE1 GLU A 3 5.938 10.178 3.727 1.00 10.00 O ATOM 42 OE2 GLU A 3 5.818 10.262 1.509 1.00 10.00 O ATOM 0 HA GLU A 3 2.636 14.116 3.180 1.00 10.00 H new ATOM 0 HB2 GLU A 3 4.103 12.968 1.951 1.00 10.00 H new ATOM 0 HB3 GLU A 3 4.811 12.791 3.545 1.00 10.00 H new ATOM 0 HG2 GLU A 3 3.434 10.533 3.618 1.00 10.00 H new ATOM 0 HG3 GLU A 3 3.371 10.720 1.877 1.00 10.00 H new ATOM 49 N LYS A 4 1.173 12.408 1.866 1.00 10.00 N ATOM 50 CA LYS A 4 0.204 11.657 1.104 1.00 10.00 C ATOM 51 C LYS A 4 0.985 11.178 -0.115 1.00 10.00 C ATOM 52 O LYS A 4 1.775 11.944 -0.670 1.00 10.00 O ATOM 53 CB LYS A 4 -0.937 12.567 0.667 1.00 10.00 C ATOM 54 CG LYS A 4 -1.898 12.960 1.799 1.00 10.00 C ATOM 55 CD LYS A 4 -2.581 14.309 1.503 1.00 10.00 C ATOM 56 CE LYS A 4 -2.129 15.402 2.481 1.00 10.00 C ATOM 57 NZ LYS A 4 -0.665 15.599 2.458 1.00 10.00 N ATOM 0 H LYS A 4 1.717 13.026 1.264 1.00 10.00 H new ATOM 0 HA LYS A 4 -0.238 10.839 1.672 1.00 10.00 H new ATOM 0 HB2 LYS A 4 -0.517 13.473 0.231 1.00 10.00 H new ATOM 0 HB3 LYS A 4 -1.504 12.068 -0.119 1.00 10.00 H new ATOM 0 HG2 LYS A 4 -2.655 12.185 1.923 1.00 10.00 H new ATOM 0 HG3 LYS A 4 -1.350 13.025 2.739 1.00 10.00 H new ATOM 0 HD2 LYS A 4 -2.352 14.617 0.483 1.00 10.00 H new ATOM 0 HD3 LYS A 4 -3.663 14.190 1.565 1.00 10.00 H new ATOM 0 HE2 LYS A 4 -2.624 16.340 2.230 1.00 10.00 H new ATOM 0 HE3 LYS A 4 -2.443 15.136 3.491 1.00 10.00 H new ATOM 0 HZ1 LYS A 4 -0.431 16.512 2.897 1.00 10.00 H new ATOM 0 HZ2 LYS A 4 -0.203 14.832 2.987 1.00 10.00 H new ATOM 0 HZ3 LYS A 4 -0.329 15.592 1.474 1.00 10.00 H new ATOM 71 N ALA A 5 0.818 9.914 -0.483 1.00 10.00 N ATOM 72 CA ALA A 5 1.480 9.287 -1.617 1.00 10.00 C ATOM 73 C ALA A 5 0.460 8.380 -2.297 1.00 10.00 C ATOM 74 O ALA A 5 -0.448 7.899 -1.619 1.00 10.00 O ATOM 75 CB ALA A 5 2.679 8.487 -1.110 1.00 10.00 C ATOM 0 H ALA A 5 0.197 9.277 0.017 1.00 10.00 H new ATOM 0 HA ALA A 5 1.844 10.025 -2.331 1.00 10.00 H new ATOM 0 HB1 ALA A 5 3.182 8.013 -1.952 1.00 10.00 H new ATOM 0 HB2 ALA A 5 3.374 9.156 -0.602 1.00 10.00 H new ATOM 0 HB3 ALA A 5 2.337 7.721 -0.414 1.00 10.00 H new ATOM 81 N GLU A 6 0.593 8.141 -3.607 1.00 10.00 N ATOM 82 CA GLU A 6 -0.355 7.338 -4.349 1.00 10.00 C ATOM 83 C GLU A 6 0.475 6.262 -5.010 1.00 10.00 C ATOM 84 O GLU A 6 1.499 6.587 -5.618 1.00 10.00 O ATOM 85 CB GLU A 6 -1.076 8.180 -5.409 1.00 10.00 C ATOM 86 CG GLU A 6 -2.581 8.316 -5.122 1.00 10.00 C ATOM 87 CD GLU A 6 -3.386 8.775 -6.337 1.00 10.00 C ATOM 88 OE1 GLU A 6 -3.067 8.308 -7.456 1.00 10.00 O ATOM 89 OE2 GLU A 6 -4.378 9.503 -6.138 1.00 10.00 O ATOM 0 H GLU A 6 1.362 8.503 -4.171 1.00 10.00 H new ATOM 0 HA GLU A 6 -1.128 6.925 -3.701 1.00 10.00 H new ATOM 0 HB2 GLU A 6 -0.625 9.172 -5.450 1.00 10.00 H new ATOM 0 HB3 GLU A 6 -0.935 7.725 -6.389 1.00 10.00 H new ATOM 0 HG2 GLU A 6 -2.967 7.356 -4.780 1.00 10.00 H new ATOM 0 HG3 GLU A 6 -2.726 9.026 -4.308 1.00 10.00 H new ATOM 96 N PHE A 7 0.050 5.008 -4.891 1.00 10.00 N ATOM 97 CA PHE A 7 0.663 3.878 -5.552 1.00 10.00 C ATOM 98 C PHE A 7 -0.409 3.140 -6.331 1.00 10.00 C ATOM 99 O PHE A 7 -1.584 3.222 -5.977 1.00 10.00 O ATOM 100 CB PHE A 7 1.285 2.952 -4.514 1.00 10.00 C ATOM 101 CG PHE A 7 2.083 3.632 -3.421 1.00 10.00 C ATOM 102 CD1 PHE A 7 2.945 4.694 -3.732 1.00 10.00 C ATOM 103 CD2 PHE A 7 1.969 3.205 -2.090 1.00 10.00 C ATOM 104 CE1 PHE A 7 3.587 5.415 -2.718 1.00 10.00 C ATOM 105 CE2 PHE A 7 2.669 3.887 -1.081 1.00 10.00 C ATOM 106 CZ PHE A 7 3.416 5.034 -1.380 1.00 10.00 C ATOM 0 H PHE A 7 -0.752 4.751 -4.315 1.00 10.00 H new ATOM 0 HA PHE A 7 1.447 4.217 -6.230 1.00 10.00 H new ATOM 0 HB2 PHE A 7 0.489 2.371 -4.049 1.00 10.00 H new ATOM 0 HB3 PHE A 7 1.937 2.246 -5.028 1.00 10.00 H new ATOM 0 HD1 PHE A 7 3.115 4.958 -4.765 1.00 10.00 H new ATOM 0 HD2 PHE A 7 1.347 2.357 -1.842 1.00 10.00 H new ATOM 0 HE1 PHE A 7 4.211 6.261 -2.966 1.00 10.00 H new ATOM 0 HE2 PHE A 7 2.631 3.524 -0.065 1.00 10.00 H new ATOM 0 HZ PHE A 7 3.856 5.620 -0.586 1.00 10.00 H new ATOM 116 N ASP A 8 0.018 2.423 -7.366 1.00 10.00 N ATOM 117 CA ASP A 8 -0.825 1.747 -8.334 1.00 10.00 C ATOM 118 C ASP A 8 -0.663 0.253 -8.061 1.00 10.00 C ATOM 119 O ASP A 8 0.469 -0.170 -7.817 1.00 10.00 O ATOM 120 CB ASP A 8 -0.310 2.152 -9.716 1.00 10.00 C ATOM 121 CG ASP A 8 -1.164 1.662 -10.868 1.00 10.00 C ATOM 122 OD1 ASP A 8 -0.848 0.555 -11.356 1.00 10.00 O ATOM 123 OD2 ASP A 8 -2.043 2.446 -11.282 1.00 10.00 O ATOM 0 H ASP A 8 1.012 2.294 -7.558 1.00 10.00 H new ATOM 0 HA ASP A 8 -1.883 2.003 -8.274 1.00 10.00 H new ATOM 0 HB2 ASP A 8 -0.246 3.239 -9.763 1.00 10.00 H new ATOM 0 HB3 ASP A 8 0.702 1.768 -9.841 1.00 10.00 H new ATOM 128 N ILE A 9 -1.754 -0.516 -7.985 1.00 10.00 N ATOM 129 CA ILE A 9 -1.709 -1.902 -7.515 1.00 10.00 C ATOM 130 C ILE A 9 -2.067 -2.867 -8.645 1.00 10.00 C ATOM 131 O ILE A 9 -3.122 -2.735 -9.261 1.00 10.00 O ATOM 132 CB ILE A 9 -2.634 -2.148 -6.308 1.00 10.00 C ATOM 133 CG1 ILE A 9 -2.532 -1.089 -5.205 1.00 10.00 C ATOM 134 CG2 ILE A 9 -2.253 -3.469 -5.641 1.00 10.00 C ATOM 135 CD1 ILE A 9 -3.556 0.009 -5.419 1.00 10.00 C ATOM 0 H ILE A 9 -2.687 -0.197 -8.246 1.00 10.00 H new ATOM 0 HA ILE A 9 -0.686 -2.086 -7.188 1.00 10.00 H new ATOM 0 HB ILE A 9 -3.644 -2.133 -6.719 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -2.689 -1.554 -4.232 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -1.529 -0.661 -5.196 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -2.906 -3.646 -4.786 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -2.363 -4.283 -6.357 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -1.218 -3.421 -5.303 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -3.466 0.750 -4.625 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -3.381 0.487 -6.383 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -4.558 -0.420 -5.403 1.00 10.00 H new ATOM 147 N GLU A 10 -1.214 -3.870 -8.867 1.00 10.00 N ATOM 148 CA GLU A 10 -1.387 -4.875 -9.901 1.00 10.00 C ATOM 149 C GLU A 10 -1.784 -6.196 -9.237 1.00 10.00 C ATOM 150 O GLU A 10 -0.963 -6.825 -8.565 1.00 10.00 O ATOM 151 CB GLU A 10 -0.069 -5.051 -10.669 1.00 10.00 C ATOM 152 CG GLU A 10 0.625 -3.751 -11.131 1.00 10.00 C ATOM 153 CD GLU A 10 0.279 -3.327 -12.554 1.00 10.00 C ATOM 154 OE1 GLU A 10 -0.678 -3.887 -13.125 1.00 10.00 O ATOM 155 OE2 GLU A 10 1.032 -2.467 -13.066 1.00 10.00 O ATOM 0 H GLU A 10 -0.366 -4.003 -8.316 1.00 10.00 H new ATOM 0 HA GLU A 10 -2.164 -4.566 -10.600 1.00 10.00 H new ATOM 0 HB2 GLU A 10 0.625 -5.605 -10.037 1.00 10.00 H new ATOM 0 HB3 GLU A 10 -0.263 -5.668 -11.547 1.00 10.00 H new ATOM 0 HG2 GLU A 10 0.354 -2.946 -10.448 1.00 10.00 H new ATOM 0 HG3 GLU A 10 1.704 -3.883 -11.056 1.00 10.00 H new ATOM 162 N GLY A 11 -3.029 -6.628 -9.443 1.00 10.00 N ATOM 163 CA GLY A 11 -3.503 -7.954 -9.061 1.00 10.00 C ATOM 164 C GLY A 11 -4.960 -7.948 -8.602 1.00 10.00 C ATOM 165 O GLY A 11 -5.829 -8.386 -9.348 1.00 10.00 O ATOM 0 H GLY A 11 -3.746 -6.055 -9.887 1.00 10.00 H new ATOM 0 HA2 GLY A 11 -3.396 -8.632 -9.908 1.00 10.00 H new ATOM 0 HA3 GLY A 11 -2.875 -8.343 -8.259 1.00 10.00 H new ATOM 169 N MET A 12 -5.206 -7.477 -7.371 1.00 10.00 N ATOM 170 CA MET A 12 -6.512 -7.365 -6.724 1.00 10.00 C ATOM 171 C MET A 12 -7.541 -8.414 -7.159 1.00 10.00 C ATOM 172 O MET A 12 -8.534 -8.096 -7.810 1.00 10.00 O ATOM 173 CB MET A 12 -7.046 -5.947 -6.912 1.00 10.00 C ATOM 174 CG MET A 12 -5.973 -4.911 -6.561 1.00 10.00 C ATOM 175 SD MET A 12 -6.608 -3.285 -6.097 1.00 10.00 S ATOM 176 CE MET A 12 -7.286 -3.768 -4.498 1.00 10.00 C ATOM 0 H MET A 12 -4.452 -7.146 -6.769 1.00 10.00 H new ATOM 0 HA MET A 12 -6.353 -7.574 -5.666 1.00 10.00 H new ATOM 0 HB2 MET A 12 -7.368 -5.809 -7.944 1.00 10.00 H new ATOM 0 HB3 MET A 12 -7.923 -5.797 -6.282 1.00 10.00 H new ATOM 0 HG2 MET A 12 -5.371 -5.298 -5.739 1.00 10.00 H new ATOM 0 HG3 MET A 12 -5.308 -4.794 -7.416 1.00 10.00 H new ATOM 0 HE1 MET A 12 -7.802 -2.919 -4.050 1.00 10.00 H new ATOM 0 HE2 MET A 12 -7.989 -4.590 -4.634 1.00 10.00 H new ATOM 0 HE3 MET A 12 -6.477 -4.088 -3.841 1.00 10.00 H new ATOM 186 N THR A 13 -7.331 -9.669 -6.763 1.00 10.00 N ATOM 187 CA THR A 13 -8.235 -10.741 -7.169 1.00 10.00 C ATOM 188 C THR A 13 -9.563 -10.659 -6.413 1.00 10.00 C ATOM 189 O THR A 13 -10.599 -11.031 -6.962 1.00 10.00 O ATOM 190 CB THR A 13 -7.586 -12.131 -7.084 1.00 10.00 C ATOM 191 OG1 THR A 13 -7.383 -12.562 -5.759 1.00 10.00 O ATOM 192 CG2 THR A 13 -6.247 -12.178 -7.827 1.00 10.00 C ATOM 0 H THR A 13 -6.555 -9.964 -6.171 1.00 10.00 H new ATOM 0 HA THR A 13 -8.457 -10.592 -8.226 1.00 10.00 H new ATOM 0 HB THR A 13 -8.295 -12.807 -7.561 1.00 10.00 H new ATOM 0 HG1 THR A 13 -6.961 -11.844 -5.243 1.00 10.00 H new ATOM 0 HG21 THR A 13 -5.820 -13.177 -7.744 1.00 10.00 H new ATOM 0 HG22 THR A 13 -6.406 -11.938 -8.878 1.00 10.00 H new ATOM 0 HG23 THR A 13 -5.562 -11.453 -7.388 1.00 10.00 H new ATOM 200 N CYS A 14 -9.549 -10.162 -5.170 1.00 10.00 N ATOM 201 CA CYS A 14 -10.749 -9.983 -4.371 1.00 10.00 C ATOM 202 C CYS A 14 -10.544 -8.839 -3.382 1.00 10.00 C ATOM 203 O CYS A 14 -9.416 -8.412 -3.147 1.00 10.00 O ATOM 204 CB CYS A 14 -11.065 -11.294 -3.646 1.00 10.00 C ATOM 205 SG CYS A 14 -9.828 -11.775 -2.414 1.00 10.00 S ATOM 0 H CYS A 14 -8.694 -9.873 -4.695 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.593 -9.726 -5.011 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -12.034 -11.201 -3.155 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -11.157 -12.091 -4.383 1.00 10.00 H new ATOM 0 HG CYS A 14 -10.185 -12.893 -1.855 1.00 10.00 H new ATOM 210 N ALA A 15 -11.623 -8.353 -2.765 1.00 10.00 N ATOM 211 CA ALA A 15 -11.539 -7.305 -1.753 1.00 10.00 C ATOM 212 C ALA A 15 -10.569 -7.689 -0.629 1.00 10.00 C ATOM 213 O ALA A 15 -9.887 -6.832 -0.066 1.00 10.00 O ATOM 214 CB ALA A 15 -12.934 -7.010 -1.196 1.00 10.00 C ATOM 0 H ALA A 15 -12.573 -8.674 -2.953 1.00 10.00 H new ATOM 0 HA ALA A 15 -11.148 -6.402 -2.222 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -12.866 -6.227 -0.441 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -13.586 -6.679 -2.004 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -13.345 -7.914 -0.746 1.00 10.00 H new ATOM 220 N ALA A 16 -10.487 -8.982 -0.300 1.00 10.00 N ATOM 221 CA ALA A 16 -9.563 -9.448 0.720 1.00 10.00 C ATOM 222 C ALA A 16 -8.105 -9.221 0.311 1.00 10.00 C ATOM 223 O ALA A 16 -7.276 -9.032 1.196 1.00 10.00 O ATOM 224 CB ALA A 16 -9.832 -10.908 1.089 1.00 10.00 C ATOM 0 H ALA A 16 -11.050 -9.717 -0.728 1.00 10.00 H new ATOM 0 HA ALA A 16 -9.736 -8.851 1.615 1.00 10.00 H new ATOM 0 HB1 ALA A 16 -9.124 -11.226 1.854 1.00 10.00 H new ATOM 0 HB2 ALA A 16 -10.848 -11.005 1.472 1.00 10.00 H new ATOM 0 HB3 ALA A 16 -9.716 -11.534 0.204 1.00 10.00 H new ATOM 230 N CYS A 17 -7.772 -9.208 -0.988 1.00 10.00 N ATOM 231 CA CYS A 17 -6.432 -8.823 -1.424 1.00 10.00 C ATOM 232 C CYS A 17 -6.137 -7.410 -0.948 1.00 10.00 C ATOM 233 O CYS A 17 -5.174 -7.189 -0.212 1.00 10.00 O ATOM 234 CB CYS A 17 -6.283 -8.891 -2.948 1.00 10.00 C ATOM 235 SG CYS A 17 -6.060 -10.568 -3.577 1.00 10.00 S ATOM 0 H CYS A 17 -8.409 -9.458 -1.745 1.00 10.00 H new ATOM 0 HA CYS A 17 -5.722 -9.528 -0.990 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -7.167 -8.453 -3.411 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -5.430 -8.282 -3.249 1.00 10.00 H new ATOM 0 HG CYS A 17 -4.806 -10.901 -3.489 1.00 10.00 H new ATOM 240 N ALA A 18 -6.983 -6.473 -1.377 1.00 10.00 N ATOM 241 CA ALA A 18 -6.931 -5.085 -0.951 1.00 10.00 C ATOM 242 C ALA A 18 -6.753 -5.008 0.571 1.00 10.00 C ATOM 243 O ALA A 18 -5.788 -4.434 1.073 1.00 10.00 O ATOM 244 CB ALA A 18 -8.195 -4.378 -1.439 1.00 10.00 C ATOM 0 H ALA A 18 -7.733 -6.666 -2.041 1.00 10.00 H new ATOM 0 HA ALA A 18 -6.072 -4.576 -1.388 1.00 10.00 H new ATOM 0 HB1 ALA A 18 -8.171 -3.334 -1.127 1.00 10.00 H new ATOM 0 HB2 ALA A 18 -8.244 -4.431 -2.527 1.00 10.00 H new ATOM 0 HB3 ALA A 18 -9.072 -4.865 -1.012 1.00 10.00 H new ATOM 250 N ASN A 19 -7.654 -5.656 1.313 1.00 10.00 N ATOM 251 CA ASN A 19 -7.617 -5.632 2.769 1.00 10.00 C ATOM 252 C ASN A 19 -6.319 -6.221 3.337 1.00 10.00 C ATOM 253 O ASN A 19 -5.777 -5.698 4.308 1.00 10.00 O ATOM 254 CB ASN A 19 -8.842 -6.352 3.336 1.00 10.00 C ATOM 255 CG ASN A 19 -9.036 -5.994 4.804 1.00 10.00 C ATOM 256 OD1 ASN A 19 -8.654 -6.750 5.692 1.00 10.00 O ATOM 257 ND2 ASN A 19 -9.641 -4.839 5.069 1.00 10.00 N ATOM 0 H ASN A 19 -8.420 -6.205 0.923 1.00 10.00 H new ATOM 0 HA ASN A 19 -7.641 -4.587 3.079 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -9.730 -6.076 2.767 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -8.719 -7.430 3.231 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -9.801 -4.557 6.036 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -9.945 -4.236 4.305 1.00 10.00 H new ATOM 264 N ARG A 20 -5.793 -7.298 2.740 1.00 10.00 N ATOM 265 CA ARG A 20 -4.539 -7.906 3.125 1.00 10.00 C ATOM 266 C ARG A 20 -3.406 -6.884 2.995 1.00 10.00 C ATOM 267 O ARG A 20 -2.519 -6.847 3.853 1.00 10.00 O ATOM 268 CB ARG A 20 -4.300 -9.128 2.236 1.00 10.00 C ATOM 269 CG ARG A 20 -4.799 -10.445 2.837 1.00 10.00 C ATOM 270 CD ARG A 20 -4.947 -11.514 1.743 1.00 10.00 C ATOM 271 NE ARG A 20 -3.724 -11.682 0.928 1.00 10.00 N ATOM 272 CZ ARG A 20 -3.648 -12.461 -0.167 1.00 10.00 C ATOM 273 NH1 ARG A 20 -4.736 -13.133 -0.563 1.00 10.00 N ATOM 274 NH2 ARG A 20 -2.506 -12.582 -0.861 1.00 10.00 N ATOM 0 H ARG A 20 -6.247 -7.772 1.960 1.00 10.00 H new ATOM 0 HA ARG A 20 -4.571 -8.229 4.166 1.00 10.00 H new ATOM 0 HB2 ARG A 20 -4.793 -8.969 1.277 1.00 10.00 H new ATOM 0 HB3 ARG A 20 -3.232 -9.214 2.035 1.00 10.00 H new ATOM 0 HG2 ARG A 20 -4.101 -10.791 3.600 1.00 10.00 H new ATOM 0 HG3 ARG A 20 -5.758 -10.286 3.331 1.00 10.00 H new ATOM 0 HD2 ARG A 20 -5.202 -12.467 2.207 1.00 10.00 H new ATOM 0 HD3 ARG A 20 -5.778 -11.245 1.090 1.00 10.00 H new ATOM 0 HE ARG A 20 -2.886 -11.176 1.214 1.00 10.00 H new ATOM 0 HH11 ARG A 20 -5.606 -13.050 -0.037 1.00 10.00 H new ATOM 0 HH12 ARG A 20 -4.695 -13.728 -1.391 1.00 10.00 H new ATOM 0 HH21 ARG A 20 -1.671 -12.078 -0.562 1.00 10.00 H new ATOM 0 HH22 ARG A 20 -2.472 -13.178 -1.688 1.00 10.00 H new ATOM 288 N ILE A 21 -3.437 -6.047 1.948 1.00 10.00 N ATOM 289 CA ILE A 21 -2.465 -4.965 1.835 1.00 10.00 C ATOM 290 C ILE A 21 -2.537 -4.121 3.107 1.00 10.00 C ATOM 291 O ILE A 21 -1.533 -3.956 3.797 1.00 10.00 O ATOM 292 CB ILE A 21 -2.659 -4.068 0.593 1.00 10.00 C ATOM 293 CG1 ILE A 21 -3.063 -4.847 -0.661 1.00 10.00 C ATOM 294 CG2 ILE A 21 -1.344 -3.342 0.315 1.00 10.00 C ATOM 295 CD1 ILE A 21 -2.865 -4.122 -1.995 1.00 10.00 C ATOM 0 H ILE A 21 -4.112 -6.100 1.185 1.00 10.00 H new ATOM 0 HA ILE A 21 -1.484 -5.423 1.712 1.00 10.00 H new ATOM 0 HB ILE A 21 -3.472 -3.377 0.815 1.00 10.00 H new ATOM 0 HG12 ILE A 21 -2.493 -5.776 -0.687 1.00 10.00 H new ATOM 0 HG13 ILE A 21 -4.114 -5.121 -0.572 1.00 10.00 H new ATOM 0 HG21 ILE A 21 -1.460 -2.702 -0.560 1.00 10.00 H new ATOM 0 HG22 ILE A 21 -1.076 -2.732 1.178 1.00 10.00 H new ATOM 0 HG23 ILE A 21 -0.557 -4.073 0.128 1.00 10.00 H new ATOM 0 HD11 ILE A 21 -3.185 -4.769 -2.812 1.00 10.00 H new ATOM 0 HD12 ILE A 21 -3.458 -3.207 -2.004 1.00 10.00 H new ATOM 0 HD13 ILE A 21 -1.811 -3.873 -2.121 1.00 10.00 H new ATOM 307 N GLU A 22 -3.732 -3.611 3.416 1.00 10.00 N ATOM 308 CA GLU A 22 -3.969 -2.728 4.555 1.00 10.00 C ATOM 309 C GLU A 22 -3.472 -3.376 5.843 1.00 10.00 C ATOM 310 O GLU A 22 -2.832 -2.725 6.670 1.00 10.00 O ATOM 311 CB GLU A 22 -5.446 -2.325 4.643 1.00 10.00 C ATOM 312 CG GLU A 22 -5.900 -1.753 3.296 1.00 10.00 C ATOM 313 CD GLU A 22 -7.250 -1.056 3.318 1.00 10.00 C ATOM 314 OE1 GLU A 22 -7.807 -0.899 4.425 1.00 10.00 O ATOM 315 OE2 GLU A 22 -7.691 -0.683 2.208 1.00 10.00 O ATOM 0 H GLU A 22 -4.573 -3.804 2.872 1.00 10.00 H new ATOM 0 HA GLU A 22 -3.400 -1.810 4.409 1.00 10.00 H new ATOM 0 HB2 GLU A 22 -6.055 -3.190 4.907 1.00 10.00 H new ATOM 0 HB3 GLU A 22 -5.586 -1.584 5.430 1.00 10.00 H new ATOM 0 HG2 GLU A 22 -5.148 -1.046 2.946 1.00 10.00 H new ATOM 0 HG3 GLU A 22 -5.938 -2.563 2.568 1.00 10.00 H new ATOM 322 N LYS A 23 -3.738 -4.674 5.986 1.00 10.00 N ATOM 323 CA LYS A 23 -3.227 -5.497 7.072 1.00 10.00 C ATOM 324 C LYS A 23 -1.702 -5.365 7.204 1.00 10.00 C ATOM 325 O LYS A 23 -1.210 -5.056 8.289 1.00 10.00 O ATOM 326 CB LYS A 23 -3.657 -6.959 6.865 1.00 10.00 C ATOM 327 CG LYS A 23 -4.559 -7.495 7.977 1.00 10.00 C ATOM 328 CD LYS A 23 -3.823 -7.547 9.325 1.00 10.00 C ATOM 329 CE LYS A 23 -4.205 -8.836 10.063 1.00 10.00 C ATOM 330 NZ LYS A 23 -3.644 -8.890 11.430 1.00 10.00 N ATOM 0 H LYS A 23 -4.328 -5.190 5.334 1.00 10.00 H new ATOM 0 HA LYS A 23 -3.654 -5.144 8.011 1.00 10.00 H new ATOM 0 HB2 LYS A 23 -4.180 -7.044 5.912 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -2.767 -7.585 6.797 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -5.442 -6.862 8.068 1.00 10.00 H new ATOM 0 HG3 LYS A 23 -4.909 -8.493 7.714 1.00 10.00 H new ATOM 0 HD2 LYS A 23 -2.745 -7.512 9.165 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -4.084 -6.678 9.929 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -5.291 -8.913 10.116 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -3.851 -9.696 9.494 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.930 -9.779 11.888 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.606 -8.844 11.381 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -4.001 -8.085 11.984 1.00 10.00 H new ATOM 344 N ARG A 24 -0.941 -5.613 6.128 1.00 10.00 N ATOM 345 CA ARG A 24 0.512 -5.451 6.191 1.00 10.00 C ATOM 346 C ARG A 24 0.880 -3.999 6.476 1.00 10.00 C ATOM 347 O ARG A 24 1.691 -3.743 7.359 1.00 10.00 O ATOM 348 CB ARG A 24 1.229 -5.937 4.916 1.00 10.00 C ATOM 349 CG ARG A 24 1.769 -7.369 5.065 1.00 10.00 C ATOM 350 CD ARG A 24 3.026 -7.437 5.956 1.00 10.00 C ATOM 351 NE ARG A 24 4.276 -7.223 5.194 1.00 10.00 N ATOM 352 CZ ARG A 24 5.473 -6.888 5.721 1.00 10.00 C ATOM 353 NH1 ARG A 24 5.567 -6.490 6.996 1.00 10.00 N ATOM 354 NH2 ARG A 24 6.584 -6.956 4.977 1.00 10.00 N ATOM 0 H ARG A 24 -1.301 -5.920 5.224 1.00 10.00 H new ATOM 0 HA ARG A 24 0.856 -6.082 7.011 1.00 10.00 H new ATOM 0 HB2 ARG A 24 0.538 -5.897 4.074 1.00 10.00 H new ATOM 0 HB3 ARG A 24 2.053 -5.262 4.684 1.00 10.00 H new ATOM 0 HG2 ARG A 24 0.992 -8.004 5.490 1.00 10.00 H new ATOM 0 HG3 ARG A 24 2.005 -7.769 4.079 1.00 10.00 H new ATOM 0 HD2 ARG A 24 2.951 -6.685 6.742 1.00 10.00 H new ATOM 0 HD3 ARG A 24 3.066 -8.409 6.447 1.00 10.00 H new ATOM 0 HE ARG A 24 4.229 -7.339 4.182 1.00 10.00 H new ATOM 0 HH11 ARG A 24 4.730 -6.438 7.577 1.00 10.00 H new ATOM 0 HH12 ARG A 24 6.475 -6.239 7.386 1.00 10.00 H new ATOM 0 HH21 ARG A 24 6.529 -7.262 4.006 1.00 10.00 H new ATOM 0 HH22 ARG A 24 7.485 -6.701 5.382 1.00 10.00 H new ATOM 368 N LEU A 25 0.297 -3.064 5.724 1.00 10.00 N ATOM 369 CA LEU A 25 0.592 -1.640 5.815 1.00 10.00 C ATOM 370 C LEU A 25 0.493 -1.166 7.264 1.00 10.00 C ATOM 371 O LEU A 25 1.448 -0.611 7.799 1.00 10.00 O ATOM 372 CB LEU A 25 -0.354 -0.857 4.892 1.00 10.00 C ATOM 373 CG LEU A 25 -0.054 -1.088 3.401 1.00 10.00 C ATOM 374 CD1 LEU A 25 -1.294 -0.779 2.557 1.00 10.00 C ATOM 375 CD2 LEU A 25 1.106 -0.198 2.942 1.00 10.00 C ATOM 0 H LEU A 25 -0.408 -3.284 5.021 1.00 10.00 H new ATOM 0 HA LEU A 25 1.615 -1.458 5.485 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -1.383 -1.149 5.101 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -0.273 0.207 5.114 1.00 10.00 H new ATOM 0 HG LEU A 25 0.224 -2.134 3.268 1.00 10.00 H new ATOM 0 HD11 LEU A 25 -1.068 -0.946 1.504 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -2.113 -1.431 2.861 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -1.585 0.261 2.705 1.00 10.00 H new ATOM 0 HD21 LEU A 25 1.304 -0.375 1.885 1.00 10.00 H new ATOM 0 HD22 LEU A 25 0.842 0.849 3.092 1.00 10.00 H new ATOM 0 HD23 LEU A 25 1.998 -0.434 3.523 1.00 10.00 H new ATOM 387 N ASN A 26 -0.637 -1.447 7.918 1.00 10.00 N ATOM 388 CA ASN A 26 -0.854 -1.152 9.329 1.00 10.00 C ATOM 389 C ASN A 26 0.276 -1.705 10.196 1.00 10.00 C ATOM 390 O ASN A 26 0.665 -1.086 11.183 1.00 10.00 O ATOM 391 CB ASN A 26 -2.182 -1.761 9.794 1.00 10.00 C ATOM 392 CG ASN A 26 -3.355 -0.810 9.584 1.00 10.00 C ATOM 393 OD1 ASN A 26 -3.792 -0.140 10.514 1.00 10.00 O ATOM 394 ND2 ASN A 26 -3.888 -0.751 8.369 1.00 10.00 N ATOM 0 H ASN A 26 -1.438 -1.893 7.471 1.00 10.00 H new ATOM 0 HA ASN A 26 -0.879 -0.068 9.439 1.00 10.00 H new ATOM 0 HB2 ASN A 26 -2.365 -2.688 9.250 1.00 10.00 H new ATOM 0 HB3 ASN A 26 -2.111 -2.020 10.850 1.00 10.00 H new ATOM 0 HD21 ASN A 26 -4.682 -0.137 8.190 1.00 10.00 H new ATOM 0 HD22 ASN A 26 -3.503 -1.320 7.615 1.00 10.00 H new ATOM 401 N LYS A 27 0.774 -2.895 9.856 1.00 10.00 N ATOM 402 CA LYS A 27 1.833 -3.541 10.609 1.00 10.00 C ATOM 403 C LYS A 27 3.195 -2.856 10.416 1.00 10.00 C ATOM 404 O LYS A 27 4.088 -3.097 11.225 1.00 10.00 O ATOM 405 CB LYS A 27 1.893 -5.043 10.277 1.00 10.00 C ATOM 406 CG LYS A 27 2.320 -5.837 11.521 1.00 10.00 C ATOM 407 CD LYS A 27 2.569 -7.318 11.212 1.00 10.00 C ATOM 408 CE LYS A 27 2.916 -8.051 12.519 1.00 10.00 C ATOM 409 NZ LYS A 27 3.289 -9.465 12.302 1.00 10.00 N ATOM 0 H LYS A 27 0.450 -3.432 9.051 1.00 10.00 H new ATOM 0 HA LYS A 27 1.593 -3.437 11.667 1.00 10.00 H new ATOM 0 HB2 LYS A 27 0.918 -5.387 9.932 1.00 10.00 H new ATOM 0 HB3 LYS A 27 2.598 -5.217 9.464 1.00 10.00 H new ATOM 0 HG2 LYS A 27 3.227 -5.398 11.935 1.00 10.00 H new ATOM 0 HG3 LYS A 27 1.547 -5.753 12.285 1.00 10.00 H new ATOM 0 HD2 LYS A 27 1.684 -7.761 10.755 1.00 10.00 H new ATOM 0 HD3 LYS A 27 3.383 -7.421 10.495 1.00 10.00 H new ATOM 0 HE2 LYS A 27 3.740 -7.534 13.012 1.00 10.00 H new ATOM 0 HE3 LYS A 27 2.061 -8.005 13.194 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 3.512 -9.909 13.215 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 2.496 -9.969 11.857 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 4.122 -9.513 11.681 1.00 10.00 H new ATOM 423 N ILE A 28 3.397 -2.055 9.362 1.00 10.00 N ATOM 424 CA ILE A 28 4.673 -1.369 9.169 1.00 10.00 C ATOM 425 C ILE A 28 4.768 -0.205 10.151 1.00 10.00 C ATOM 426 O ILE A 28 3.882 0.646 10.242 1.00 10.00 O ATOM 427 CB ILE A 28 4.844 -0.830 7.744 1.00 10.00 C ATOM 428 CG1 ILE A 28 4.743 -1.945 6.690 1.00 10.00 C ATOM 429 CG2 ILE A 28 6.167 -0.065 7.566 1.00 10.00 C ATOM 430 CD1 ILE A 28 4.513 -1.376 5.300 1.00 10.00 C ATOM 0 H ILE A 28 2.701 -1.870 8.640 1.00 10.00 H new ATOM 0 HA ILE A 28 5.464 -2.099 9.343 1.00 10.00 H new ATOM 0 HB ILE A 28 4.021 -0.132 7.589 1.00 10.00 H new ATOM 0 HG12 ILE A 28 5.658 -2.537 6.695 1.00 10.00 H new ATOM 0 HG13 ILE A 28 3.926 -2.619 6.948 1.00 10.00 H new ATOM 0 HG21 ILE A 28 6.243 0.297 6.541 1.00 10.00 H new ATOM 0 HG22 ILE A 28 6.193 0.781 8.253 1.00 10.00 H new ATOM 0 HG23 ILE A 28 7.004 -0.731 7.778 1.00 10.00 H new ATOM 0 HD11 ILE A 28 4.447 -2.191 4.580 1.00 10.00 H new ATOM 0 HD12 ILE A 28 3.584 -0.806 5.289 1.00 10.00 H new ATOM 0 HD13 ILE A 28 5.343 -0.722 5.033 1.00 10.00 H new ATOM 442 N GLU A 29 5.903 -0.144 10.829 1.00 10.00 N ATOM 443 CA GLU A 29 6.233 0.916 11.757 1.00 10.00 C ATOM 444 C GLU A 29 6.386 2.238 10.997 1.00 10.00 C ATOM 445 O GLU A 29 7.330 2.405 10.227 1.00 10.00 O ATOM 446 CB GLU A 29 7.511 0.524 12.506 1.00 10.00 C ATOM 447 CG GLU A 29 7.317 -0.805 13.260 1.00 10.00 C ATOM 448 CD GLU A 29 8.199 -1.901 12.685 1.00 10.00 C ATOM 449 OE1 GLU A 29 7.961 -2.231 11.501 1.00 10.00 O ATOM 450 OE2 GLU A 29 9.084 -2.373 13.431 1.00 10.00 O ATOM 0 H GLU A 29 6.635 -0.849 10.744 1.00 10.00 H new ATOM 0 HA GLU A 29 5.437 1.058 12.488 1.00 10.00 H new ATOM 0 HB2 GLU A 29 8.337 0.430 11.801 1.00 10.00 H new ATOM 0 HB3 GLU A 29 7.781 1.311 13.210 1.00 10.00 H new ATOM 0 HG2 GLU A 29 7.550 -0.664 14.315 1.00 10.00 H new ATOM 0 HG3 GLU A 29 6.272 -1.109 13.202 1.00 10.00 H new ATOM 457 N GLY A 30 5.454 3.173 11.207 1.00 10.00 N ATOM 458 CA GLY A 30 5.529 4.529 10.669 1.00 10.00 C ATOM 459 C GLY A 30 4.419 4.857 9.671 1.00 10.00 C ATOM 460 O GLY A 30 4.287 6.015 9.273 1.00 10.00 O ATOM 0 H GLY A 30 4.616 3.004 11.763 1.00 10.00 H new ATOM 0 HA2 GLY A 30 5.486 5.240 11.494 1.00 10.00 H new ATOM 0 HA3 GLY A 30 6.495 4.664 10.182 1.00 10.00 H new ATOM 464 N VAL A 31 3.617 3.867 9.259 1.00 10.00 N ATOM 465 CA VAL A 31 2.474 4.115 8.387 1.00 10.00 C ATOM 466 C VAL A 31 1.317 4.666 9.223 1.00 10.00 C ATOM 467 O VAL A 31 1.094 4.200 10.339 1.00 10.00 O ATOM 468 CB VAL A 31 2.103 2.827 7.630 1.00 10.00 C ATOM 469 CG1 VAL A 31 0.782 2.973 6.861 1.00 10.00 C ATOM 470 CG2 VAL A 31 3.216 2.479 6.632 1.00 10.00 C ATOM 0 H VAL A 31 3.743 2.889 9.518 1.00 10.00 H new ATOM 0 HA VAL A 31 2.721 4.862 7.633 1.00 10.00 H new ATOM 0 HB VAL A 31 1.984 2.036 8.370 1.00 10.00 H new ATOM 0 HG11 VAL A 31 0.559 2.041 6.341 1.00 10.00 H new ATOM 0 HG12 VAL A 31 -0.023 3.201 7.560 1.00 10.00 H new ATOM 0 HG13 VAL A 31 0.871 3.781 6.135 1.00 10.00 H new ATOM 0 HG21 VAL A 31 2.952 1.567 6.097 1.00 10.00 H new ATOM 0 HG22 VAL A 31 3.335 3.296 5.920 1.00 10.00 H new ATOM 0 HG23 VAL A 31 4.152 2.327 7.169 1.00 10.00 H new ATOM 480 N ALA A 32 0.592 5.661 8.693 1.00 10.00 N ATOM 481 CA ALA A 32 -0.567 6.247 9.353 1.00 10.00 C ATOM 482 C ALA A 32 -1.851 5.658 8.773 1.00 10.00 C ATOM 483 O ALA A 32 -2.645 5.081 9.510 1.00 10.00 O ATOM 484 CB ALA A 32 -0.542 7.774 9.227 1.00 10.00 C ATOM 0 H ALA A 32 0.801 6.080 7.787 1.00 10.00 H new ATOM 0 HA ALA A 32 -0.533 6.005 10.415 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -1.415 8.195 9.726 1.00 10.00 H new ATOM 0 HB2 ALA A 32 0.364 8.163 9.692 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -0.557 8.052 8.173 1.00 10.00 H new ATOM 490 N ASN A 33 -2.055 5.791 7.457 1.00 10.00 N ATOM 491 CA ASN A 33 -3.212 5.230 6.761 1.00 10.00 C ATOM 492 C ASN A 33 -2.759 4.745 5.393 1.00 10.00 C ATOM 493 O ASN A 33 -1.686 5.121 4.930 1.00 10.00 O ATOM 494 CB ASN A 33 -4.333 6.260 6.549 1.00 10.00 C ATOM 495 CG ASN A 33 -4.888 6.860 7.831 1.00 10.00 C ATOM 496 OD1 ASN A 33 -5.409 6.148 8.683 1.00 10.00 O ATOM 497 ND2 ASN A 33 -4.838 8.179 7.960 1.00 10.00 N ATOM 0 H ASN A 33 -1.415 6.295 6.843 1.00 10.00 H new ATOM 0 HA ASN A 33 -3.607 4.423 7.378 1.00 10.00 H new ATOM 0 HB2 ASN A 33 -3.955 7.066 5.920 1.00 10.00 H new ATOM 0 HB3 ASN A 33 -5.148 5.784 6.003 1.00 10.00 H new ATOM 0 HD21 ASN A 33 -5.239 8.626 8.784 1.00 10.00 H new ATOM 0 HD22 ASN A 33 -4.398 8.746 7.235 1.00 10.00 H new ATOM 504 N ALA A 34 -3.601 3.945 4.738 1.00 10.00 N ATOM 505 CA ALA A 34 -3.384 3.439 3.390 1.00 10.00 C ATOM 506 C ALA A 34 -4.589 2.642 2.871 1.00 10.00 C ATOM 507 O ALA A 34 -4.435 1.468 2.542 1.00 10.00 O ATOM 508 CB ALA A 34 -2.116 2.583 3.381 1.00 10.00 C ATOM 0 H ALA A 34 -4.479 3.624 5.147 1.00 10.00 H new ATOM 0 HA ALA A 34 -3.262 4.287 2.716 1.00 10.00 H new ATOM 0 HB1 ALA A 34 -1.944 2.199 2.376 1.00 10.00 H new ATOM 0 HB2 ALA A 34 -1.265 3.191 3.688 1.00 10.00 H new ATOM 0 HB3 ALA A 34 -2.235 1.749 4.073 1.00 10.00 H new ATOM 514 N PRO A 35 -5.785 3.247 2.780 1.00 10.00 N ATOM 515 CA PRO A 35 -6.950 2.573 2.225 1.00 10.00 C ATOM 516 C PRO A 35 -6.775 2.337 0.715 1.00 10.00 C ATOM 517 O PRO A 35 -6.495 3.279 -0.030 1.00 10.00 O ATOM 518 CB PRO A 35 -8.133 3.491 2.538 1.00 10.00 C ATOM 519 CG PRO A 35 -7.498 4.881 2.587 1.00 10.00 C ATOM 520 CD PRO A 35 -6.112 4.610 3.174 1.00 10.00 C ATOM 0 HA PRO A 35 -7.103 1.583 2.656 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -8.905 3.428 1.771 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -8.604 3.231 3.486 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -7.435 5.330 1.596 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -8.073 5.565 3.211 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -5.377 5.317 2.789 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -6.117 4.715 4.259 1.00 10.00 H new ATOM 528 N VAL A 36 -6.923 1.089 0.261 1.00 10.00 N ATOM 529 CA VAL A 36 -6.758 0.694 -1.137 1.00 10.00 C ATOM 530 C VAL A 36 -8.113 0.794 -1.850 1.00 10.00 C ATOM 531 O VAL A 36 -9.109 0.317 -1.308 1.00 10.00 O ATOM 532 CB VAL A 36 -6.224 -0.750 -1.180 1.00 10.00 C ATOM 533 CG1 VAL A 36 -5.906 -1.189 -2.611 1.00 10.00 C ATOM 534 CG2 VAL A 36 -4.956 -0.956 -0.342 1.00 10.00 C ATOM 0 H VAL A 36 -7.167 0.309 0.871 1.00 10.00 H new ATOM 0 HA VAL A 36 -6.050 1.351 -1.643 1.00 10.00 H new ATOM 0 HB VAL A 36 -7.028 -1.353 -0.758 1.00 10.00 H new ATOM 0 HG11 VAL A 36 -5.532 -2.213 -2.603 1.00 10.00 H new ATOM 0 HG12 VAL A 36 -6.811 -1.138 -3.217 1.00 10.00 H new ATOM 0 HG13 VAL A 36 -5.149 -0.529 -3.034 1.00 10.00 H new ATOM 0 HG21 VAL A 36 -4.635 -1.995 -0.417 1.00 10.00 H new ATOM 0 HG22 VAL A 36 -4.165 -0.304 -0.712 1.00 10.00 H new ATOM 0 HG23 VAL A 36 -5.166 -0.716 0.700 1.00 10.00 H new ATOM 544 N ASN A 37 -8.195 1.387 -3.055 1.00 10.00 N ATOM 545 CA ASN A 37 -9.457 1.420 -3.780 1.00 10.00 C ATOM 546 C ASN A 37 -9.656 0.126 -4.565 1.00 10.00 C ATOM 547 O ASN A 37 -8.748 -0.693 -4.664 1.00 10.00 O ATOM 548 CB ASN A 37 -9.553 2.683 -4.647 1.00 10.00 C ATOM 549 CG ASN A 37 -8.935 2.608 -6.045 1.00 10.00 C ATOM 550 OD1 ASN A 37 -8.991 1.615 -6.757 1.00 10.00 O ATOM 551 ND2 ASN A 37 -8.404 3.718 -6.523 1.00 10.00 N ATOM 0 H ASN A 37 -7.414 1.838 -3.531 1.00 10.00 H new ATOM 0 HA ASN A 37 -10.281 1.478 -3.069 1.00 10.00 H new ATOM 0 HB2 ASN A 37 -10.606 2.942 -4.754 1.00 10.00 H new ATOM 0 HB3 ASN A 37 -9.077 3.502 -4.108 1.00 10.00 H new ATOM 0 HD21 ASN A 37 -8.045 3.742 -7.478 1.00 10.00 H new ATOM 0 HD22 ASN A 37 -8.352 4.552 -5.938 1.00 10.00 H new ATOM 558 N PHE A 38 -10.842 -0.041 -5.153 1.00 10.00 N ATOM 559 CA PHE A 38 -11.129 -1.136 -6.069 1.00 10.00 C ATOM 560 C PHE A 38 -11.884 -0.550 -7.265 1.00 10.00 C ATOM 561 O PHE A 38 -13.004 -0.960 -7.569 1.00 10.00 O ATOM 562 CB PHE A 38 -11.908 -2.227 -5.311 1.00 10.00 C ATOM 563 CG PHE A 38 -11.623 -3.648 -5.761 1.00 10.00 C ATOM 564 CD1 PHE A 38 -12.070 -4.102 -7.016 1.00 10.00 C ATOM 565 CD2 PHE A 38 -10.891 -4.517 -4.927 1.00 10.00 C ATOM 566 CE1 PHE A 38 -11.782 -5.412 -7.437 1.00 10.00 C ATOM 567 CE2 PHE A 38 -10.604 -5.825 -5.350 1.00 10.00 C ATOM 568 CZ PHE A 38 -11.053 -6.276 -6.602 1.00 10.00 C ATOM 0 H PHE A 38 -11.632 0.586 -5.003 1.00 10.00 H new ATOM 0 HA PHE A 38 -10.228 -1.615 -6.451 1.00 10.00 H new ATOM 0 HB2 PHE A 38 -11.678 -2.145 -4.249 1.00 10.00 H new ATOM 0 HB3 PHE A 38 -12.975 -2.034 -5.422 1.00 10.00 H new ATOM 0 HD1 PHE A 38 -12.636 -3.442 -7.657 1.00 10.00 H new ATOM 0 HD2 PHE A 38 -10.550 -4.176 -3.961 1.00 10.00 H new ATOM 0 HE1 PHE A 38 -12.121 -5.755 -8.403 1.00 10.00 H new ATOM 0 HE2 PHE A 38 -10.037 -6.486 -4.711 1.00 10.00 H new ATOM 0 HZ PHE A 38 -10.838 -7.285 -6.922 1.00 10.00 H new ATOM 578 N ALA A 39 -11.302 0.481 -7.883 1.00 10.00 N ATOM 579 CA ALA A 39 -11.906 1.178 -9.014 1.00 10.00 C ATOM 580 C ALA A 39 -10.871 1.787 -9.964 1.00 10.00 C ATOM 581 O ALA A 39 -11.097 1.809 -11.171 1.00 10.00 O ATOM 582 CB ALA A 39 -12.855 2.263 -8.496 1.00 10.00 C ATOM 0 H ALA A 39 -10.394 0.855 -7.609 1.00 10.00 H new ATOM 0 HA ALA A 39 -12.459 0.439 -9.594 1.00 10.00 H new ATOM 0 HB1 ALA A 39 -13.307 2.784 -9.340 1.00 10.00 H new ATOM 0 HB2 ALA A 39 -13.638 1.804 -7.892 1.00 10.00 H new ATOM 0 HB3 ALA A 39 -12.297 2.974 -7.887 1.00 10.00 H new ATOM 588 N LEU A 40 -9.795 2.373 -9.420 1.00 10.00 N ATOM 589 CA LEU A 40 -8.711 2.977 -10.191 1.00 10.00 C ATOM 590 C LEU A 40 -7.384 2.317 -9.827 1.00 10.00 C ATOM 591 O LEU A 40 -6.318 2.839 -10.148 1.00 10.00 O ATOM 592 CB LEU A 40 -8.611 4.488 -9.921 1.00 10.00 C ATOM 593 CG LEU A 40 -9.925 5.244 -9.836 1.00 10.00 C ATOM 594 CD1 LEU A 40 -9.940 6.229 -8.662 1.00 10.00 C ATOM 595 CD2 LEU A 40 -10.266 5.963 -11.145 1.00 10.00 C ATOM 0 H LEU A 40 -9.656 2.439 -8.412 1.00 10.00 H new ATOM 0 HA LEU A 40 -8.927 2.824 -11.248 1.00 10.00 H new ATOM 0 HB2 LEU A 40 -8.071 4.633 -8.985 1.00 10.00 H new ATOM 0 HB3 LEU A 40 -8.008 4.937 -10.710 1.00 10.00 H new ATOM 0 HG LEU A 40 -10.697 4.495 -9.660 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -10.897 6.750 -8.636 1.00 10.00 H new ATOM 0 HD12 LEU A 40 -9.798 5.685 -7.728 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -9.136 6.954 -8.785 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -11.214 6.489 -11.035 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -9.479 6.679 -11.383 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -10.348 5.233 -11.950 1.00 10.00 H new ATOM 607 N GLU A 41 -7.465 1.230 -9.060 1.00 10.00 N ATOM 608 CA GLU A 41 -6.374 0.329 -8.729 1.00 10.00 C ATOM 609 C GLU A 41 -5.232 1.144 -8.144 1.00 10.00 C ATOM 610 O GLU A 41 -4.074 0.999 -8.524 1.00 10.00 O ATOM 611 CB GLU A 41 -5.975 -0.498 -9.959 1.00 10.00 C ATOM 612 CG GLU A 41 -7.062 -1.515 -10.338 1.00 10.00 C ATOM 613 CD GLU A 41 -8.386 -0.865 -10.728 1.00 10.00 C ATOM 614 OE1 GLU A 41 -8.484 -0.443 -11.899 1.00 10.00 O ATOM 615 OE2 GLU A 41 -9.250 -0.746 -9.829 1.00 10.00 O ATOM 0 H GLU A 41 -8.345 0.943 -8.632 1.00 10.00 H new ATOM 0 HA GLU A 41 -6.679 -0.395 -7.974 1.00 10.00 H new ATOM 0 HB2 GLU A 41 -5.791 0.169 -10.801 1.00 10.00 H new ATOM 0 HB3 GLU A 41 -5.041 -1.022 -9.757 1.00 10.00 H new ATOM 0 HG2 GLU A 41 -6.706 -2.125 -11.168 1.00 10.00 H new ATOM 0 HG3 GLU A 41 -7.229 -2.188 -9.497 1.00 10.00 H new ATOM 622 N THR A 42 -5.604 2.026 -7.217 1.00 10.00 N ATOM 623 CA THR A 42 -4.739 2.982 -6.562 1.00 10.00 C ATOM 624 C THR A 42 -4.957 2.867 -5.051 1.00 10.00 C ATOM 625 O THR A 42 -6.081 2.624 -4.601 1.00 10.00 O ATOM 626 CB THR A 42 -5.042 4.396 -7.074 1.00 10.00 C ATOM 627 OG1 THR A 42 -4.847 4.507 -8.477 1.00 10.00 O ATOM 628 CG2 THR A 42 -4.160 5.435 -6.383 1.00 10.00 C ATOM 0 H THR A 42 -6.569 2.089 -6.892 1.00 10.00 H new ATOM 0 HA THR A 42 -3.692 2.775 -6.785 1.00 10.00 H new ATOM 0 HB THR A 42 -6.090 4.584 -6.842 1.00 10.00 H new ATOM 0 HG1 THR A 42 -5.447 3.886 -8.941 1.00 10.00 H new ATOM 0 HG21 THR A 42 -4.398 6.427 -6.767 1.00 10.00 H new ATOM 0 HG22 THR A 42 -4.340 5.409 -5.308 1.00 10.00 H new ATOM 0 HG23 THR A 42 -3.112 5.211 -6.580 1.00 10.00 H new ATOM 636 N VAL A 43 -3.883 3.047 -4.279 1.00 10.00 N ATOM 637 CA VAL A 43 -3.915 3.212 -2.832 1.00 10.00 C ATOM 638 C VAL A 43 -3.291 4.562 -2.494 1.00 10.00 C ATOM 639 O VAL A 43 -2.218 4.879 -3.009 1.00 10.00 O ATOM 640 CB VAL A 43 -3.194 2.044 -2.132 1.00 10.00 C ATOM 641 CG1 VAL A 43 -1.757 1.822 -2.614 1.00 10.00 C ATOM 642 CG2 VAL A 43 -3.185 2.216 -0.608 1.00 10.00 C ATOM 0 H VAL A 43 -2.938 3.082 -4.661 1.00 10.00 H new ATOM 0 HA VAL A 43 -4.943 3.196 -2.469 1.00 10.00 H new ATOM 0 HB VAL A 43 -3.773 1.162 -2.405 1.00 10.00 H new ATOM 0 HG11 VAL A 43 -1.318 0.983 -2.074 1.00 10.00 H new ATOM 0 HG12 VAL A 43 -1.761 1.604 -3.682 1.00 10.00 H new ATOM 0 HG13 VAL A 43 -1.168 2.721 -2.429 1.00 10.00 H new ATOM 0 HG21 VAL A 43 -2.668 1.373 -0.150 1.00 10.00 H new ATOM 0 HG22 VAL A 43 -2.670 3.141 -0.349 1.00 10.00 H new ATOM 0 HG23 VAL A 43 -4.210 2.256 -0.240 1.00 10.00 H new ATOM 652 N THR A 44 -3.964 5.328 -1.630 1.00 10.00 N ATOM 653 CA THR A 44 -3.500 6.611 -1.126 1.00 10.00 C ATOM 654 C THR A 44 -2.880 6.375 0.251 1.00 10.00 C ATOM 655 O THR A 44 -3.608 6.226 1.230 1.00 10.00 O ATOM 656 CB THR A 44 -4.681 7.592 -1.055 1.00 10.00 C ATOM 657 OG1 THR A 44 -5.373 7.573 -2.288 1.00 10.00 O ATOM 658 CG2 THR A 44 -4.198 9.018 -0.763 1.00 10.00 C ATOM 0 H THR A 44 -4.873 5.058 -1.255 1.00 10.00 H new ATOM 0 HA THR A 44 -2.751 7.049 -1.786 1.00 10.00 H new ATOM 0 HB THR A 44 -5.342 7.283 -0.245 1.00 10.00 H new ATOM 0 HG1 THR A 44 -6.129 8.196 -2.249 1.00 10.00 H new ATOM 0 HG21 THR A 44 -5.055 9.690 -0.718 1.00 10.00 H new ATOM 0 HG22 THR A 44 -3.673 9.036 0.192 1.00 10.00 H new ATOM 0 HG23 THR A 44 -3.523 9.343 -1.555 1.00 10.00 H new ATOM 666 N VAL A 45 -1.553 6.295 0.334 1.00 10.00 N ATOM 667 CA VAL A 45 -0.842 6.003 1.569 1.00 10.00 C ATOM 668 C VAL A 45 -0.484 7.312 2.269 1.00 10.00 C ATOM 669 O VAL A 45 0.091 8.208 1.651 1.00 10.00 O ATOM 670 CB VAL A 45 0.388 5.136 1.256 1.00 10.00 C ATOM 671 CG1 VAL A 45 1.182 4.733 2.508 1.00 10.00 C ATOM 672 CG2 VAL A 45 -0.083 3.861 0.542 1.00 10.00 C ATOM 0 H VAL A 45 -0.937 6.434 -0.467 1.00 10.00 H new ATOM 0 HA VAL A 45 -1.471 5.434 2.254 1.00 10.00 H new ATOM 0 HB VAL A 45 1.054 5.732 0.632 1.00 10.00 H new ATOM 0 HG11 VAL A 45 2.037 4.123 2.216 1.00 10.00 H new ATOM 0 HG12 VAL A 45 1.534 5.629 3.020 1.00 10.00 H new ATOM 0 HG13 VAL A 45 0.540 4.161 3.178 1.00 10.00 H new ATOM 0 HG21 VAL A 45 0.778 3.233 0.312 1.00 10.00 H new ATOM 0 HG22 VAL A 45 -0.768 3.314 1.189 1.00 10.00 H new ATOM 0 HG23 VAL A 45 -0.593 4.129 -0.383 1.00 10.00 H new ATOM 682 N GLU A 46 -0.810 7.397 3.562 1.00 10.00 N ATOM 683 CA GLU A 46 -0.360 8.434 4.467 1.00 10.00 C ATOM 684 C GLU A 46 0.643 7.833 5.450 1.00 10.00 C ATOM 685 O GLU A 46 0.343 6.857 6.144 1.00 10.00 O ATOM 686 CB GLU A 46 -1.547 9.000 5.242 1.00 10.00 C ATOM 687 CG GLU A 46 -2.450 9.881 4.375 1.00 10.00 C ATOM 688 CD GLU A 46 -3.444 10.631 5.249 1.00 10.00 C ATOM 689 OE1 GLU A 46 -4.082 9.946 6.079 1.00 10.00 O ATOM 690 OE2 GLU A 46 -3.518 11.871 5.101 1.00 10.00 O ATOM 0 H GLU A 46 -1.418 6.715 4.015 1.00 10.00 H new ATOM 0 HA GLU A 46 0.109 9.236 3.896 1.00 10.00 H new ATOM 0 HB2 GLU A 46 -2.133 8.178 5.652 1.00 10.00 H new ATOM 0 HB3 GLU A 46 -1.180 9.583 6.087 1.00 10.00 H new ATOM 0 HG2 GLU A 46 -1.845 10.589 3.809 1.00 10.00 H new ATOM 0 HG3 GLU A 46 -2.983 9.266 3.650 1.00 10.00 H new ATOM 697 N TYR A 47 1.826 8.438 5.528 1.00 10.00 N ATOM 698 CA TYR A 47 2.884 8.075 6.450 1.00 10.00 C ATOM 699 C TYR A 47 3.758 9.308 6.655 1.00 10.00 C ATOM 700 O TYR A 47 3.533 10.340 6.020 1.00 10.00 O ATOM 701 CB TYR A 47 3.672 6.862 5.928 1.00 10.00 C ATOM 702 CG TYR A 47 4.438 7.056 4.633 1.00 10.00 C ATOM 703 CD1 TYR A 47 3.748 7.149 3.409 1.00 10.00 C ATOM 704 CD2 TYR A 47 5.846 7.058 4.639 1.00 10.00 C ATOM 705 CE1 TYR A 47 4.459 7.288 2.209 1.00 10.00 C ATOM 706 CE2 TYR A 47 6.557 7.160 3.431 1.00 10.00 C ATOM 707 CZ TYR A 47 5.861 7.338 2.225 1.00 10.00 C ATOM 708 OH TYR A 47 6.527 7.782 1.125 1.00 10.00 O ATOM 0 H TYR A 47 2.077 9.222 4.926 1.00 10.00 H new ATOM 0 HA TYR A 47 2.477 7.766 7.413 1.00 10.00 H new ATOM 0 HB2 TYR A 47 4.379 6.557 6.700 1.00 10.00 H new ATOM 0 HB3 TYR A 47 2.974 6.036 5.791 1.00 10.00 H new ATOM 0 HD1 TYR A 47 2.669 7.113 3.395 1.00 10.00 H new ATOM 0 HD2 TYR A 47 6.381 6.981 5.574 1.00 10.00 H new ATOM 0 HE1 TYR A 47 3.927 7.357 1.272 1.00 10.00 H new ATOM 0 HE2 TYR A 47 7.635 7.102 3.431 1.00 10.00 H new ATOM 0 HH TYR A 47 6.318 8.728 0.976 1.00 10.00 H new ATOM 718 N ASN A 48 4.721 9.216 7.572 1.00 10.00 N ATOM 719 CA ASN A 48 5.681 10.281 7.815 1.00 10.00 C ATOM 720 C ASN A 48 6.967 9.939 7.067 1.00 10.00 C ATOM 721 O ASN A 48 7.495 8.843 7.276 1.00 10.00 O ATOM 722 CB ASN A 48 5.966 10.431 9.321 1.00 10.00 C ATOM 723 CG ASN A 48 5.065 11.452 10.016 1.00 10.00 C ATOM 724 OD1 ASN A 48 4.466 12.316 9.384 1.00 10.00 O ATOM 725 ND2 ASN A 48 4.980 11.385 11.341 1.00 10.00 N ATOM 0 H ASN A 48 4.854 8.397 8.166 1.00 10.00 H new ATOM 0 HA ASN A 48 5.276 11.229 7.461 1.00 10.00 H new ATOM 0 HB2 ASN A 48 5.842 9.462 9.804 1.00 10.00 H new ATOM 0 HB3 ASN A 48 7.007 10.725 9.458 1.00 10.00 H new ATOM 0 HD21 ASN A 48 4.409 12.060 11.850 1.00 10.00 H new ATOM 0 HD22 ASN A 48 5.486 10.659 11.848 1.00 10.00 H new ATOM 732 N PRO A 49 7.529 10.868 6.274 1.00 10.00 N ATOM 733 CA PRO A 49 8.732 10.646 5.482 1.00 10.00 C ATOM 734 C PRO A 49 9.987 10.721 6.365 1.00 10.00 C ATOM 735 O PRO A 49 10.963 11.386 6.025 1.00 10.00 O ATOM 736 CB PRO A 49 8.704 11.746 4.411 1.00 10.00 C ATOM 737 CG PRO A 49 7.994 12.900 5.117 1.00 10.00 C ATOM 738 CD PRO A 49 6.973 12.183 6.001 1.00 10.00 C ATOM 0 HA PRO A 49 8.761 9.656 5.028 1.00 10.00 H new ATOM 0 HB2 PRO A 49 9.709 12.025 4.093 1.00 10.00 H new ATOM 0 HB3 PRO A 49 8.165 11.426 3.519 1.00 10.00 H new ATOM 0 HG2 PRO A 49 8.687 13.501 5.706 1.00 10.00 H new ATOM 0 HG3 PRO A 49 7.512 13.573 4.407 1.00 10.00 H new ATOM 0 HD2 PRO A 49 6.803 12.734 6.926 1.00 10.00 H new ATOM 0 HD3 PRO A 49 6.010 12.102 5.497 1.00 10.00 H new ATOM 746 N LYS A 50 9.961 10.051 7.519 1.00 10.00 N ATOM 747 CA LYS A 50 11.055 10.023 8.470 1.00 10.00 C ATOM 748 C LYS A 50 11.005 8.771 9.360 1.00 10.00 C ATOM 749 O LYS A 50 11.798 8.688 10.297 1.00 10.00 O ATOM 750 CB LYS A 50 10.992 11.307 9.316 1.00 10.00 C ATOM 751 CG LYS A 50 12.364 11.693 9.889 1.00 10.00 C ATOM 752 CD LYS A 50 12.287 11.909 11.407 1.00 10.00 C ATOM 753 CE LYS A 50 13.608 12.440 11.980 1.00 10.00 C ATOM 754 NZ LYS A 50 14.741 11.530 11.709 1.00 10.00 N ATOM 0 H LYS A 50 9.155 9.502 7.818 1.00 10.00 H new ATOM 0 HA LYS A 50 12.001 9.978 7.930 1.00 10.00 H new ATOM 0 HB2 LYS A 50 10.613 12.125 8.704 1.00 10.00 H new ATOM 0 HB3 LYS A 50 10.285 11.167 10.134 1.00 10.00 H new ATOM 0 HG2 LYS A 50 13.088 10.910 9.666 1.00 10.00 H new ATOM 0 HG3 LYS A 50 12.720 12.603 9.406 1.00 10.00 H new ATOM 0 HD2 LYS A 50 11.485 12.612 11.633 1.00 10.00 H new ATOM 0 HD3 LYS A 50 12.033 10.968 11.895 1.00 10.00 H new ATOM 0 HE2 LYS A 50 13.820 13.419 11.551 1.00 10.00 H new ATOM 0 HE3 LYS A 50 13.505 12.579 13.056 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 15.594 11.886 12.186 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 14.516 10.579 12.066 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 14.911 11.483 10.684 1.00 10.00 H new ATOM 768 N GLU A 51 10.086 7.831 9.086 1.00 10.00 N ATOM 769 CA GLU A 51 9.896 6.607 9.854 1.00 10.00 C ATOM 770 C GLU A 51 9.804 5.443 8.864 1.00 10.00 C ATOM 771 O GLU A 51 10.753 4.680 8.701 1.00 10.00 O ATOM 772 CB GLU A 51 8.620 6.721 10.709 1.00 10.00 C ATOM 773 CG GLU A 51 8.765 7.662 11.916 1.00 10.00 C ATOM 774 CD GLU A 51 9.360 6.973 13.141 1.00 10.00 C ATOM 775 OE1 GLU A 51 10.175 6.048 12.950 1.00 10.00 O ATOM 776 OE2 GLU A 51 8.975 7.390 14.255 1.00 10.00 O ATOM 0 H GLU A 51 9.441 7.911 8.300 1.00 10.00 H new ATOM 0 HA GLU A 51 10.730 6.438 10.535 1.00 10.00 H new ATOM 0 HB2 GLU A 51 7.803 7.075 10.080 1.00 10.00 H new ATOM 0 HB3 GLU A 51 8.342 5.729 11.065 1.00 10.00 H new ATOM 0 HG2 GLU A 51 9.396 8.506 11.638 1.00 10.00 H new ATOM 0 HG3 GLU A 51 7.786 8.067 12.173 1.00 10.00 H new ATOM 783 N ALA A 52 8.669 5.337 8.167 1.00 10.00 N ATOM 784 CA ALA A 52 8.461 4.371 7.110 1.00 10.00 C ATOM 785 C ALA A 52 9.051 4.926 5.815 1.00 10.00 C ATOM 786 O ALA A 52 9.516 6.064 5.759 1.00 10.00 O ATOM 787 CB ALA A 52 6.959 4.110 6.974 1.00 10.00 C ATOM 0 H ALA A 52 7.860 5.936 8.333 1.00 10.00 H new ATOM 0 HA ALA A 52 8.956 3.427 7.336 1.00 10.00 H new ATOM 0 HB1 ALA A 52 6.786 3.383 6.180 1.00 10.00 H new ATOM 0 HB2 ALA A 52 6.571 3.719 7.915 1.00 10.00 H new ATOM 0 HB3 ALA A 52 6.448 5.042 6.730 1.00 10.00 H new ATOM 793 N SER A 53 9.029 4.109 4.765 1.00 10.00 N ATOM 794 CA SER A 53 9.550 4.447 3.459 1.00 10.00 C ATOM 795 C SER A 53 8.747 3.727 2.378 1.00 10.00 C ATOM 796 O SER A 53 8.344 2.576 2.551 1.00 10.00 O ATOM 797 CB SER A 53 11.034 4.086 3.391 1.00 10.00 C ATOM 798 OG SER A 53 11.320 2.886 4.081 1.00 10.00 O ATOM 0 H SER A 53 8.635 3.169 4.809 1.00 10.00 H new ATOM 0 HA SER A 53 9.454 5.519 3.287 1.00 10.00 H new ATOM 0 HB2 SER A 53 11.335 3.985 2.348 1.00 10.00 H new ATOM 0 HB3 SER A 53 11.624 4.898 3.816 1.00 10.00 H new ATOM 0 HG SER A 53 12.278 2.689 4.012 1.00 10.00 H new ATOM 804 N VAL A 54 8.539 4.416 1.252 1.00 10.00 N ATOM 805 CA VAL A 54 7.784 3.898 0.122 1.00 10.00 C ATOM 806 C VAL A 54 8.339 2.543 -0.332 1.00 10.00 C ATOM 807 O VAL A 54 7.583 1.593 -0.491 1.00 10.00 O ATOM 808 CB VAL A 54 7.680 4.965 -0.986 1.00 10.00 C ATOM 809 CG1 VAL A 54 9.028 5.366 -1.597 1.00 10.00 C ATOM 810 CG2 VAL A 54 6.714 4.539 -2.097 1.00 10.00 C ATOM 0 H VAL A 54 8.897 5.360 1.104 1.00 10.00 H new ATOM 0 HA VAL A 54 6.757 3.691 0.422 1.00 10.00 H new ATOM 0 HB VAL A 54 7.286 5.848 -0.482 1.00 10.00 H new ATOM 0 HG11 VAL A 54 8.868 6.120 -2.368 1.00 10.00 H new ATOM 0 HG12 VAL A 54 9.673 5.774 -0.819 1.00 10.00 H new ATOM 0 HG13 VAL A 54 9.502 4.490 -2.039 1.00 10.00 H new ATOM 0 HG21 VAL A 54 6.669 5.318 -2.858 1.00 10.00 H new ATOM 0 HG22 VAL A 54 7.065 3.611 -2.548 1.00 10.00 H new ATOM 0 HG23 VAL A 54 5.720 4.385 -1.676 1.00 10.00 H new ATOM 820 N SER A 55 9.659 2.413 -0.498 1.00 10.00 N ATOM 821 CA SER A 55 10.281 1.154 -0.889 1.00 10.00 C ATOM 822 C SER A 55 9.956 -0.002 0.065 1.00 10.00 C ATOM 823 O SER A 55 9.722 -1.123 -0.392 1.00 10.00 O ATOM 824 CB SER A 55 11.794 1.352 -0.993 1.00 10.00 C ATOM 825 OG SER A 55 12.065 2.349 -1.960 1.00 10.00 O ATOM 0 H SER A 55 10.321 3.178 -0.364 1.00 10.00 H new ATOM 0 HA SER A 55 9.868 0.872 -1.858 1.00 10.00 H new ATOM 0 HB2 SER A 55 12.202 1.645 -0.026 1.00 10.00 H new ATOM 0 HB3 SER A 55 12.277 0.416 -1.272 1.00 10.00 H new ATOM 0 HG SER A 55 13.033 2.482 -2.030 1.00 10.00 H new ATOM 831 N ASP A 56 9.962 0.247 1.378 1.00 10.00 N ATOM 832 CA ASP A 56 9.753 -0.815 2.352 1.00 10.00 C ATOM 833 C ASP A 56 8.329 -1.341 2.223 1.00 10.00 C ATOM 834 O ASP A 56 8.104 -2.525 1.968 1.00 10.00 O ATOM 835 CB ASP A 56 10.026 -0.302 3.766 1.00 10.00 C ATOM 836 CG ASP A 56 9.742 -1.404 4.777 1.00 10.00 C ATOM 837 OD1 ASP A 56 8.567 -1.498 5.193 1.00 10.00 O ATOM 838 OD2 ASP A 56 10.696 -2.147 5.087 1.00 10.00 O ATOM 0 H ASP A 56 10.109 1.171 1.784 1.00 10.00 H new ATOM 0 HA ASP A 56 10.448 -1.632 2.158 1.00 10.00 H new ATOM 0 HB2 ASP A 56 11.063 0.024 3.851 1.00 10.00 H new ATOM 0 HB3 ASP A 56 9.401 0.566 3.975 1.00 10.00 H new ATOM 843 N LEU A 57 7.356 -0.434 2.335 1.00 10.00 N ATOM 844 CA LEU A 57 5.962 -0.805 2.228 1.00 10.00 C ATOM 845 C LEU A 57 5.689 -1.423 0.863 1.00 10.00 C ATOM 846 O LEU A 57 4.962 -2.406 0.766 1.00 10.00 O ATOM 847 CB LEU A 57 5.039 0.361 2.620 1.00 10.00 C ATOM 848 CG LEU A 57 5.014 1.547 1.655 1.00 10.00 C ATOM 849 CD1 LEU A 57 4.057 1.321 0.482 1.00 10.00 C ATOM 850 CD2 LEU A 57 4.583 2.820 2.394 1.00 10.00 C ATOM 0 H LEU A 57 7.518 0.560 2.500 1.00 10.00 H new ATOM 0 HA LEU A 57 5.726 -1.584 2.953 1.00 10.00 H new ATOM 0 HB2 LEU A 57 4.024 -0.023 2.720 1.00 10.00 H new ATOM 0 HB3 LEU A 57 5.341 0.723 3.603 1.00 10.00 H new ATOM 0 HG LEU A 57 6.025 1.653 1.261 1.00 10.00 H new ATOM 0 HD11 LEU A 57 4.075 2.191 -0.175 1.00 10.00 H new ATOM 0 HD12 LEU A 57 4.368 0.438 -0.076 1.00 10.00 H new ATOM 0 HD13 LEU A 57 3.046 1.173 0.861 1.00 10.00 H new ATOM 0 HD21 LEU A 57 4.569 3.658 1.697 1.00 10.00 H new ATOM 0 HD22 LEU A 57 3.586 2.678 2.812 1.00 10.00 H new ATOM 0 HD23 LEU A 57 5.287 3.029 3.199 1.00 10.00 H new ATOM 862 N LYS A 58 6.297 -0.882 -0.194 1.00 10.00 N ATOM 863 CA LYS A 58 6.196 -1.454 -1.522 1.00 10.00 C ATOM 864 C LYS A 58 6.558 -2.933 -1.448 1.00 10.00 C ATOM 865 O LYS A 58 5.758 -3.784 -1.831 1.00 10.00 O ATOM 866 CB LYS A 58 7.098 -0.648 -2.466 1.00 10.00 C ATOM 867 CG LYS A 58 7.023 -0.957 -3.960 1.00 10.00 C ATOM 868 CD LYS A 58 7.397 -2.414 -4.212 1.00 10.00 C ATOM 869 CE LYS A 58 8.043 -2.717 -5.563 1.00 10.00 C ATOM 870 NZ LYS A 58 8.488 -4.127 -5.597 1.00 10.00 N ATOM 0 H LYS A 58 6.869 -0.039 -0.146 1.00 10.00 H new ATOM 0 HA LYS A 58 5.182 -1.397 -1.918 1.00 10.00 H new ATOM 0 HB2 LYS A 58 6.865 0.408 -2.330 1.00 10.00 H new ATOM 0 HB3 LYS A 58 8.130 -0.791 -2.146 1.00 10.00 H new ATOM 0 HG2 LYS A 58 6.016 -0.762 -4.330 1.00 10.00 H new ATOM 0 HG3 LYS A 58 7.697 -0.300 -4.510 1.00 10.00 H new ATOM 0 HD2 LYS A 58 8.080 -2.734 -3.425 1.00 10.00 H new ATOM 0 HD3 LYS A 58 6.496 -3.021 -4.118 1.00 10.00 H new ATOM 0 HE2 LYS A 58 7.331 -2.531 -6.367 1.00 10.00 H new ATOM 0 HE3 LYS A 58 8.892 -2.053 -5.728 1.00 10.00 H new ATOM 0 HZ1 LYS A 58 9.298 -4.220 -6.243 1.00 10.00 H new ATOM 0 HZ2 LYS A 58 8.771 -4.425 -4.642 1.00 10.00 H new ATOM 0 HZ3 LYS A 58 7.708 -4.729 -5.931 1.00 10.00 H new ATOM 884 N GLU A 59 7.768 -3.231 -0.971 1.00 10.00 N ATOM 885 CA GLU A 59 8.238 -4.605 -0.840 1.00 10.00 C ATOM 886 C GLU A 59 7.234 -5.426 -0.028 1.00 10.00 C ATOM 887 O GLU A 59 6.854 -6.519 -0.425 1.00 10.00 O ATOM 888 CB GLU A 59 9.647 -4.614 -0.232 1.00 10.00 C ATOM 889 CG GLU A 59 10.362 -5.965 -0.404 1.00 10.00 C ATOM 890 CD GLU A 59 9.990 -7.040 0.623 1.00 10.00 C ATOM 891 OE1 GLU A 59 9.245 -6.726 1.578 1.00 10.00 O ATOM 892 OE2 GLU A 59 10.477 -8.175 0.438 1.00 10.00 O ATOM 0 H GLU A 59 8.443 -2.529 -0.667 1.00 10.00 H new ATOM 0 HA GLU A 59 8.309 -5.074 -1.821 1.00 10.00 H new ATOM 0 HB2 GLU A 59 10.244 -3.830 -0.698 1.00 10.00 H new ATOM 0 HB3 GLU A 59 9.581 -4.376 0.830 1.00 10.00 H new ATOM 0 HG2 GLU A 59 10.144 -6.348 -1.401 1.00 10.00 H new ATOM 0 HG3 GLU A 59 11.438 -5.797 -0.355 1.00 10.00 H new ATOM 899 N ALA A 60 6.748 -4.861 1.073 1.00 10.00 N ATOM 900 CA ALA A 60 5.810 -5.484 1.983 1.00 10.00 C ATOM 901 C ALA A 60 4.500 -5.853 1.295 1.00 10.00 C ATOM 902 O ALA A 60 3.917 -6.888 1.622 1.00 10.00 O ATOM 903 CB ALA A 60 5.557 -4.548 3.167 1.00 10.00 C ATOM 0 H ALA A 60 7.011 -3.919 1.362 1.00 10.00 H new ATOM 0 HA ALA A 60 6.249 -6.416 2.340 1.00 10.00 H new ATOM 0 HB1 ALA A 60 4.851 -5.014 3.855 1.00 10.00 H new ATOM 0 HB2 ALA A 60 6.496 -4.356 3.686 1.00 10.00 H new ATOM 0 HB3 ALA A 60 5.143 -3.607 2.805 1.00 10.00 H new ATOM 909 N VAL A 61 4.030 -5.009 0.373 1.00 10.00 N ATOM 910 CA VAL A 61 2.888 -5.316 -0.470 1.00 10.00 C ATOM 911 C VAL A 61 3.265 -6.419 -1.457 1.00 10.00 C ATOM 912 O VAL A 61 2.561 -7.423 -1.543 1.00 10.00 O ATOM 913 CB VAL A 61 2.367 -4.048 -1.168 1.00 10.00 C ATOM 914 CG1 VAL A 61 1.267 -4.419 -2.172 1.00 10.00 C ATOM 915 CG2 VAL A 61 1.835 -3.067 -0.110 1.00 10.00 C ATOM 0 H VAL A 61 4.438 -4.091 0.195 1.00 10.00 H new ATOM 0 HA VAL A 61 2.067 -5.687 0.144 1.00 10.00 H new ATOM 0 HB VAL A 61 3.179 -3.568 -1.715 1.00 10.00 H new ATOM 0 HG11 VAL A 61 0.903 -3.516 -2.663 1.00 10.00 H new ATOM 0 HG12 VAL A 61 1.672 -5.100 -2.920 1.00 10.00 H new ATOM 0 HG13 VAL A 61 0.444 -4.904 -1.647 1.00 10.00 H new ATOM 0 HG21 VAL A 61 1.465 -2.167 -0.602 1.00 10.00 H new ATOM 0 HG22 VAL A 61 1.024 -3.536 0.446 1.00 10.00 H new ATOM 0 HG23 VAL A 61 2.639 -2.801 0.576 1.00 10.00 H new ATOM 925 N ASP A 62 4.384 -6.249 -2.168 1.00 10.00 N ATOM 926 CA ASP A 62 4.907 -7.237 -3.110 1.00 10.00 C ATOM 927 C ASP A 62 4.914 -8.627 -2.455 1.00 10.00 C ATOM 928 O ASP A 62 4.439 -9.611 -3.022 1.00 10.00 O ATOM 929 CB ASP A 62 6.301 -6.801 -3.604 1.00 10.00 C ATOM 930 CG ASP A 62 6.485 -7.010 -5.101 1.00 10.00 C ATOM 931 OD1 ASP A 62 6.505 -8.175 -5.538 1.00 10.00 O ATOM 932 OD2 ASP A 62 6.658 -5.979 -5.798 1.00 10.00 O ATOM 0 H ASP A 62 4.958 -5.409 -2.103 1.00 10.00 H new ATOM 0 HA ASP A 62 4.263 -7.300 -3.987 1.00 10.00 H new ATOM 0 HB2 ASP A 62 6.453 -5.748 -3.367 1.00 10.00 H new ATOM 0 HB3 ASP A 62 7.065 -7.363 -3.066 1.00 10.00 H new ATOM 937 N LYS A 63 5.366 -8.682 -1.195 1.00 10.00 N ATOM 938 CA LYS A 63 5.464 -9.899 -0.399 1.00 10.00 C ATOM 939 C LYS A 63 4.128 -10.655 -0.285 1.00 10.00 C ATOM 940 O LYS A 63 4.132 -11.867 -0.079 1.00 10.00 O ATOM 941 CB LYS A 63 6.061 -9.532 0.973 1.00 10.00 C ATOM 942 CG LYS A 63 6.652 -10.710 1.764 1.00 10.00 C ATOM 943 CD LYS A 63 5.670 -11.258 2.811 1.00 10.00 C ATOM 944 CE LYS A 63 6.246 -12.460 3.575 1.00 10.00 C ATOM 945 NZ LYS A 63 7.380 -12.094 4.453 1.00 10.00 N ATOM 0 H LYS A 63 5.681 -7.852 -0.692 1.00 10.00 H new ATOM 0 HA LYS A 63 6.126 -10.602 -0.905 1.00 10.00 H new ATOM 0 HB2 LYS A 63 6.842 -8.786 0.824 1.00 10.00 H new ATOM 0 HB3 LYS A 63 5.284 -9.063 1.576 1.00 10.00 H new ATOM 0 HG2 LYS A 63 6.927 -11.508 1.074 1.00 10.00 H new ATOM 0 HG3 LYS A 63 7.568 -10.389 2.260 1.00 10.00 H new ATOM 0 HD2 LYS A 63 5.417 -10.468 3.518 1.00 10.00 H new ATOM 0 HD3 LYS A 63 4.744 -11.553 2.318 1.00 10.00 H new ATOM 0 HE2 LYS A 63 5.458 -12.913 4.177 1.00 10.00 H new ATOM 0 HE3 LYS A 63 6.575 -13.215 2.861 1.00 10.00 H new ATOM 0 HZ1 LYS A 63 7.728 -12.943 4.943 1.00 10.00 H new ATOM 0 HZ2 LYS A 63 8.146 -11.687 3.879 1.00 10.00 H new ATOM 0 HZ3 LYS A 63 7.064 -11.395 5.155 1.00 10.00 H new ATOM 959 N LEU A 64 2.986 -9.966 -0.394 1.00 10.00 N ATOM 960 CA LEU A 64 1.660 -10.580 -0.321 1.00 10.00 C ATOM 961 C LEU A 64 1.213 -11.210 -1.645 1.00 10.00 C ATOM 962 O LEU A 64 0.193 -11.909 -1.646 1.00 10.00 O ATOM 963 CB LEU A 64 0.621 -9.553 0.142 1.00 10.00 C ATOM 964 CG LEU A 64 0.713 -9.220 1.635 1.00 10.00 C ATOM 965 CD1 LEU A 64 0.012 -7.885 1.893 1.00 10.00 C ATOM 966 CD2 LEU A 64 0.035 -10.304 2.483 1.00 10.00 C ATOM 0 H LEU A 64 2.959 -8.956 -0.537 1.00 10.00 H new ATOM 0 HA LEU A 64 1.735 -11.388 0.407 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.746 -8.637 -0.435 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.377 -9.934 -0.076 1.00 10.00 H new ATOM 0 HG LEU A 64 1.766 -9.164 1.912 1.00 10.00 H new ATOM 0 HD11 LEU A 64 0.073 -7.641 2.954 1.00 10.00 H new ATOM 0 HD12 LEU A 64 0.497 -7.101 1.312 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.035 -7.961 1.598 1.00 10.00 H new ATOM 0 HD21 LEU A 64 0.115 -10.043 3.538 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.017 -10.378 2.206 1.00 10.00 H new ATOM 0 HD23 LEU A 64 0.525 -11.262 2.308 1.00 10.00 H new ATOM 978 N GLY A 65 1.930 -10.965 -2.752 1.00 10.00 N ATOM 979 CA GLY A 65 1.753 -11.665 -4.020 1.00 10.00 C ATOM 980 C GLY A 65 1.507 -10.688 -5.166 1.00 10.00 C ATOM 981 O GLY A 65 2.202 -10.716 -6.179 1.00 10.00 O ATOM 0 H GLY A 65 2.664 -10.257 -2.785 1.00 10.00 H new ATOM 0 HA2 GLY A 65 2.639 -12.263 -4.234 1.00 10.00 H new ATOM 0 HA3 GLY A 65 0.913 -12.355 -3.942 1.00 10.00 H new ATOM 985 N TYR A 66 0.490 -9.840 -5.013 1.00 10.00 N ATOM 986 CA TYR A 66 0.199 -8.771 -5.963 1.00 10.00 C ATOM 987 C TYR A 66 1.312 -7.726 -5.941 1.00 10.00 C ATOM 988 O TYR A 66 2.045 -7.615 -4.960 1.00 10.00 O ATOM 989 CB TYR A 66 -1.165 -8.135 -5.669 1.00 10.00 C ATOM 990 CG TYR A 66 -1.592 -8.165 -4.220 1.00 10.00 C ATOM 991 CD1 TYR A 66 -0.849 -7.466 -3.250 1.00 10.00 C ATOM 992 CD2 TYR A 66 -2.622 -9.037 -3.823 1.00 10.00 C ATOM 993 CE1 TYR A 66 -1.186 -7.590 -1.896 1.00 10.00 C ATOM 994 CE2 TYR A 66 -2.944 -9.165 -2.465 1.00 10.00 C ATOM 995 CZ TYR A 66 -2.275 -8.388 -1.514 1.00 10.00 C ATOM 996 OH TYR A 66 -2.703 -8.392 -0.227 1.00 10.00 O ATOM 0 H TYR A 66 -0.156 -9.877 -4.224 1.00 10.00 H new ATOM 0 HA TYR A 66 0.154 -9.199 -6.964 1.00 10.00 H new ATOM 0 HB2 TYR A 66 -1.143 -7.098 -6.003 1.00 10.00 H new ATOM 0 HB3 TYR A 66 -1.922 -8.646 -6.264 1.00 10.00 H new ATOM 0 HD1 TYR A 66 -0.023 -6.837 -3.548 1.00 10.00 H new ATOM 0 HD2 TYR A 66 -3.164 -9.607 -4.563 1.00 10.00 H new ATOM 0 HE1 TYR A 66 -0.607 -7.071 -1.146 1.00 10.00 H new ATOM 0 HE2 TYR A 66 -3.707 -9.862 -2.154 1.00 10.00 H new ATOM 0 HH TYR A 66 -3.578 -7.955 -0.172 1.00 10.00 H new ATOM 1006 N LYS A 67 1.427 -6.959 -7.024 1.00 10.00 N ATOM 1007 CA LYS A 67 2.512 -6.012 -7.234 1.00 10.00 C ATOM 1008 C LYS A 67 2.021 -4.594 -6.956 1.00 10.00 C ATOM 1009 O LYS A 67 0.818 -4.331 -6.946 1.00 10.00 O ATOM 1010 CB LYS A 67 3.050 -6.170 -8.668 1.00 10.00 C ATOM 1011 CG LYS A 67 4.559 -6.456 -8.734 1.00 10.00 C ATOM 1012 CD LYS A 67 5.339 -5.240 -9.246 1.00 10.00 C ATOM 1013 CE LYS A 67 6.826 -5.600 -9.355 1.00 10.00 C ATOM 1014 NZ LYS A 67 7.592 -4.552 -10.058 1.00 10.00 N ATOM 0 H LYS A 67 0.755 -6.981 -7.791 1.00 10.00 H new ATOM 0 HA LYS A 67 3.331 -6.213 -6.544 1.00 10.00 H new ATOM 0 HB2 LYS A 67 2.514 -6.981 -9.160 1.00 10.00 H new ATOM 0 HB3 LYS A 67 2.837 -5.260 -9.229 1.00 10.00 H new ATOM 0 HG2 LYS A 67 4.922 -6.732 -7.744 1.00 10.00 H new ATOM 0 HG3 LYS A 67 4.741 -7.308 -9.389 1.00 10.00 H new ATOM 0 HD2 LYS A 67 4.956 -4.931 -10.218 1.00 10.00 H new ATOM 0 HD3 LYS A 67 5.206 -4.397 -8.568 1.00 10.00 H new ATOM 0 HE2 LYS A 67 7.239 -5.745 -8.357 1.00 10.00 H new ATOM 0 HE3 LYS A 67 6.933 -6.546 -9.885 1.00 10.00 H new ATOM 0 HZ1 LYS A 67 8.593 -4.831 -10.112 1.00 10.00 H new ATOM 0 HZ2 LYS A 67 7.214 -4.431 -11.019 1.00 10.00 H new ATOM 0 HZ3 LYS A 67 7.510 -3.655 -9.539 1.00 10.00 H new ATOM 1028 N LEU A 68 2.964 -3.674 -6.740 1.00 10.00 N ATOM 1029 CA LEU A 68 2.697 -2.280 -6.457 1.00 10.00 C ATOM 1030 C LEU A 68 3.878 -1.478 -6.990 1.00 10.00 C ATOM 1031 O LEU A 68 4.972 -2.019 -7.175 1.00 10.00 O ATOM 1032 CB LEU A 68 2.469 -2.097 -4.950 1.00 10.00 C ATOM 1033 CG LEU A 68 2.048 -0.683 -4.513 1.00 10.00 C ATOM 1034 CD1 LEU A 68 1.030 -0.780 -3.374 1.00 10.00 C ATOM 1035 CD2 LEU A 68 3.257 0.102 -3.987 1.00 10.00 C ATOM 0 H LEU A 68 3.960 -3.894 -6.760 1.00 10.00 H new ATOM 0 HA LEU A 68 1.790 -1.925 -6.945 1.00 10.00 H new ATOM 0 HB2 LEU A 68 1.703 -2.802 -4.628 1.00 10.00 H new ATOM 0 HB3 LEU A 68 3.387 -2.363 -4.426 1.00 10.00 H new ATOM 0 HG LEU A 68 1.621 -0.176 -5.378 1.00 10.00 H new ATOM 0 HD11 LEU A 68 0.733 0.222 -3.065 1.00 10.00 H new ATOM 0 HD12 LEU A 68 0.153 -1.330 -3.716 1.00 10.00 H new ATOM 0 HD13 LEU A 68 1.478 -1.302 -2.529 1.00 10.00 H new ATOM 0 HD21 LEU A 68 2.939 1.099 -3.683 1.00 10.00 H new ATOM 0 HD22 LEU A 68 3.685 -0.419 -3.131 1.00 10.00 H new ATOM 0 HD23 LEU A 68 4.007 0.184 -4.773 1.00 10.00 H new ATOM 1047 N LYS A 69 3.630 -0.207 -7.282 1.00 10.00 N ATOM 1048 CA LYS A 69 4.525 0.715 -7.958 1.00 10.00 C ATOM 1049 C LYS A 69 4.067 2.136 -7.625 1.00 10.00 C ATOM 1050 O LYS A 69 2.892 2.340 -7.315 1.00 10.00 O ATOM 1051 CB LYS A 69 4.475 0.440 -9.471 1.00 10.00 C ATOM 1052 CG LYS A 69 3.055 0.655 -10.020 1.00 10.00 C ATOM 1053 CD LYS A 69 2.662 -0.241 -11.201 1.00 10.00 C ATOM 1054 CE LYS A 69 2.780 0.482 -12.546 1.00 10.00 C ATOM 1055 NZ LYS A 69 2.258 -0.366 -13.635 1.00 10.00 N ATOM 0 H LYS A 69 2.742 0.231 -7.036 1.00 10.00 H new ATOM 0 HA LYS A 69 5.557 0.590 -7.631 1.00 10.00 H new ATOM 0 HB2 LYS A 69 5.173 1.099 -9.988 1.00 10.00 H new ATOM 0 HB3 LYS A 69 4.795 -0.583 -9.670 1.00 10.00 H new ATOM 0 HG2 LYS A 69 2.343 0.493 -9.211 1.00 10.00 H new ATOM 0 HG3 LYS A 69 2.957 1.696 -10.328 1.00 10.00 H new ATOM 0 HD2 LYS A 69 3.299 -1.126 -11.210 1.00 10.00 H new ATOM 0 HD3 LYS A 69 1.637 -0.587 -11.066 1.00 10.00 H new ATOM 0 HE2 LYS A 69 2.227 1.421 -12.511 1.00 10.00 H new ATOM 0 HE3 LYS A 69 3.823 0.733 -12.740 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 3.051 -0.809 -14.141 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 1.646 -1.106 -13.236 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 1.708 0.218 -14.297 1.00 10.00 H new ATOM 1069 N LEU A 70 4.983 3.107 -7.678 1.00 10.00 N ATOM 1070 CA LEU A 70 4.669 4.497 -7.379 1.00 10.00 C ATOM 1071 C LEU A 70 3.747 5.090 -8.435 1.00 10.00 C ATOM 1072 O LEU A 70 3.791 4.692 -9.599 1.00 10.00 O ATOM 1073 CB LEU A 70 5.958 5.311 -7.176 1.00 10.00 C ATOM 1074 CG LEU A 70 5.847 6.851 -7.200 1.00 10.00 C ATOM 1075 CD1 LEU A 70 7.046 7.442 -6.450 1.00 10.00 C ATOM 1076 CD2 LEU A 70 5.863 7.433 -8.624 1.00 10.00 C ATOM 0 H LEU A 70 5.959 2.947 -7.929 1.00 10.00 H new ATOM 0 HA LEU A 70 4.120 4.541 -6.439 1.00 10.00 H new ATOM 0 HB2 LEU A 70 6.390 5.021 -6.218 1.00 10.00 H new ATOM 0 HB3 LEU A 70 6.667 5.014 -7.949 1.00 10.00 H new ATOM 0 HG LEU A 70 4.895 7.108 -6.736 1.00 10.00 H new ATOM 0 HD11 LEU A 70 6.981 8.530 -6.459 1.00 10.00 H new ATOM 0 HD12 LEU A 70 7.042 7.087 -5.420 1.00 10.00 H new ATOM 0 HD13 LEU A 70 7.970 7.130 -6.937 1.00 10.00 H new ATOM 0 HD21 LEU A 70 5.782 8.519 -8.574 1.00 10.00 H new ATOM 0 HD22 LEU A 70 6.796 7.161 -9.118 1.00 10.00 H new ATOM 0 HD23 LEU A 70 5.022 7.032 -9.190 1.00 10.00 H new ATOM 1088 N LYS A 71 2.934 6.057 -8.004 1.00 10.00 N ATOM 1089 CA LYS A 71 2.057 6.833 -8.867 1.00 10.00 C ATOM 1090 C LYS A 71 2.180 8.335 -8.580 1.00 10.00 C ATOM 1091 O LYS A 71 2.454 9.109 -9.493 1.00 10.00 O ATOM 1092 CB LYS A 71 0.641 6.265 -8.760 1.00 10.00 C ATOM 1093 CG LYS A 71 -0.354 6.892 -9.739 1.00 10.00 C ATOM 1094 CD LYS A 71 -1.712 6.227 -9.492 1.00 10.00 C ATOM 1095 CE LYS A 71 -2.843 6.935 -10.245 1.00 10.00 C ATOM 1096 NZ LYS A 71 -4.079 6.920 -9.441 1.00 10.00 N ATOM 0 H LYS A 71 2.870 6.324 -7.022 1.00 10.00 H new ATOM 0 HA LYS A 71 2.355 6.742 -9.911 1.00 10.00 H new ATOM 0 HB2 LYS A 71 0.677 5.189 -8.933 1.00 10.00 H new ATOM 0 HB3 LYS A 71 0.277 6.412 -7.743 1.00 10.00 H new ATOM 0 HG2 LYS A 71 -0.419 7.969 -9.584 1.00 10.00 H new ATOM 0 HG3 LYS A 71 -0.031 6.737 -10.768 1.00 10.00 H new ATOM 0 HD2 LYS A 71 -1.667 5.183 -9.804 1.00 10.00 H new ATOM 0 HD3 LYS A 71 -1.929 6.232 -8.424 1.00 10.00 H new ATOM 0 HE2 LYS A 71 -2.556 7.963 -10.464 1.00 10.00 H new ATOM 0 HE3 LYS A 71 -3.017 6.442 -11.202 1.00 10.00 H new ATOM 0 HZ1 LYS A 71 -4.863 7.311 -10.002 1.00 10.00 H new ATOM 0 HZ2 LYS A 71 -4.303 5.942 -9.168 1.00 10.00 H new ATOM 0 HZ3 LYS A 71 -3.944 7.496 -8.586 1.00 10.00 H new