USER MOD reduce.3.24.130724 H: found=0, std=0, add=662, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 665 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 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= -0.0167 USER MOD Single : A 21 LYS NZ :NH3+ -153:sc= -0.203 (180deg=-1.1) USER MOD Single : A 24 ASN : amide:sc= -4.91! C(o=-4.9!,f=-4.5!) USER MOD Single : A 26 GLN : amide:sc= -0.217 K(o=-0.22,f=-3.7) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.613 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -0:sc= 0.801 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 156:sc= -1.21 (180deg=-2.36) USER MOD Single : A 55 ASN : amide:sc= -0.796 X(o=-0.8,f=-0.74) USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -3.15! C(o=-3.1!,f=-3.2!) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc=-0.000936 (180deg=-0.000936) USER MOD Single : A 86 SER OG : rot 72:sc= 0.0361 USER MOD Single : A 87 GLN : amide:sc= -3.19 K(o=-3.2,f=-4.7!) USER MOD Single : A 92 SER OG : rot 89:sc= 0.0113 USER MOD Single : A 96 SER OG : rot -91:sc= 1.19 USER MOD Single : A 97 THR OG1 : rot 78:sc= 0.978 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 70 N LYS A 21 -7.779 -5.061 -11.367 1.00 0.00 N ATOM 71 CA LYS A 21 -6.767 -4.417 -12.197 1.00 0.00 C ATOM 72 C LYS A 21 -5.805 -3.602 -11.342 1.00 0.00 C ATOM 73 O LYS A 21 -6.065 -3.349 -10.167 1.00 0.00 O ATOM 74 CB LYS A 21 -7.424 -3.516 -13.249 1.00 0.00 C ATOM 75 CG LYS A 21 -8.725 -2.876 -12.787 1.00 0.00 C ATOM 76 CD LYS A 21 -8.513 -2.000 -11.563 1.00 0.00 C ATOM 77 CE LYS A 21 -9.637 -0.990 -11.401 1.00 0.00 C ATOM 78 NZ LYS A 21 -9.769 -0.112 -12.597 1.00 0.00 N ATOM 0 HA LYS A 21 -6.204 -5.199 -12.707 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -6.723 -2.730 -13.529 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -7.618 -4.104 -14.146 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.144 -2.277 -13.596 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.453 -3.654 -12.557 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.453 -2.625 -10.672 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.561 -1.476 -11.649 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.576 -1.516 -11.231 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.451 -0.377 -10.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -10.179 0.801 -12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.831 0.045 -13.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.390 -0.568 -13.296 1.00 0.00 H new ATOM 92 N ARG A 22 -4.690 -3.193 -11.939 1.00 0.00 N ATOM 93 CA ARG A 22 -3.690 -2.408 -11.227 1.00 0.00 C ATOM 94 C ARG A 22 -3.677 -0.964 -11.714 1.00 0.00 C ATOM 95 O ARG A 22 -3.738 -0.702 -12.916 1.00 0.00 O ATOM 96 CB ARG A 22 -2.302 -3.031 -11.400 1.00 0.00 C ATOM 97 CG ARG A 22 -1.877 -3.181 -12.855 1.00 0.00 C ATOM 98 CD ARG A 22 -1.447 -4.606 -13.168 1.00 0.00 C ATOM 99 NE ARG A 22 -0.651 -4.680 -14.392 1.00 0.00 N ATOM 100 CZ ARG A 22 -0.340 -5.820 -15.005 1.00 0.00 C ATOM 101 NH1 ARG A 22 -0.757 -6.982 -14.515 1.00 0.00 N ATOM 102 NH2 ARG A 22 0.390 -5.800 -16.112 1.00 0.00 N ATOM 0 H ARG A 22 -4.457 -3.392 -12.912 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.953 -2.410 -10.169 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -1.569 -2.416 -10.878 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -2.291 -4.012 -10.924 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -2.703 -2.898 -13.507 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -1.055 -2.497 -13.067 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.867 -5.002 -12.334 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -2.330 -5.237 -13.271 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.314 -3.808 -14.800 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -1.319 -7.004 -13.664 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -0.515 -7.852 -14.990 1.00 0.00 H new ATOM 0 HH21 ARG A 22 0.713 -4.911 -16.494 1.00 0.00 H new ATOM 0 HH22 ARG A 22 0.628 -6.674 -16.582 1.00 0.00 H new ATOM 116 N LEU A 23 -3.600 -0.029 -10.771 1.00 0.00 N ATOM 117 CA LEU A 23 -3.582 1.393 -11.105 1.00 0.00 C ATOM 118 C LEU A 23 -2.277 2.046 -10.660 1.00 0.00 C ATOM 119 O LEU A 23 -1.613 1.569 -9.739 1.00 0.00 O ATOM 120 CB LEU A 23 -4.767 2.118 -10.456 1.00 0.00 C ATOM 121 CG LEU A 23 -5.952 1.229 -10.086 1.00 0.00 C ATOM 122 CD1 LEU A 23 -6.831 1.913 -9.049 1.00 0.00 C ATOM 123 CD2 LEU A 23 -6.761 0.873 -11.324 1.00 0.00 C ATOM 0 H LEU A 23 -3.549 -0.229 -9.772 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.663 1.476 -12.189 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.415 2.620 -9.555 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -5.115 2.894 -11.138 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.566 0.306 -9.652 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.670 1.264 -8.798 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.246 2.113 -8.151 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -7.207 2.852 -9.454 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.601 0.239 -11.040 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.136 1.785 -11.789 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.127 0.339 -12.032 1.00 0.00 H new ATOM 135 N ASN A 24 -1.925 3.147 -11.313 1.00 0.00 N ATOM 136 CA ASN A 24 -0.709 3.881 -10.982 1.00 0.00 C ATOM 137 C ASN A 24 -1.062 5.202 -10.306 1.00 0.00 C ATOM 138 O ASN A 24 -1.643 6.090 -10.928 1.00 0.00 O ATOM 139 CB ASN A 24 0.120 4.142 -12.242 1.00 0.00 C ATOM 140 CG ASN A 24 0.691 2.866 -12.831 1.00 0.00 C ATOM 141 OD1 ASN A 24 1.901 2.643 -12.804 1.00 0.00 O ATOM 142 ND2 ASN A 24 -0.181 2.021 -13.369 1.00 0.00 N ATOM 0 H ASN A 24 -2.466 3.552 -12.077 1.00 0.00 H new ATOM 0 HA ASN A 24 -0.116 3.277 -10.295 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -0.502 4.637 -12.988 1.00 0.00 H new ATOM 0 HB3 ASN A 24 0.935 4.825 -12.003 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.144 1.147 -13.782 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.176 2.246 -13.370 1.00 0.00 H new ATOM 149 N ILE A 25 -0.722 5.320 -9.027 1.00 0.00 N ATOM 150 CA ILE A 25 -1.024 6.531 -8.271 1.00 0.00 C ATOM 151 C ILE A 25 0.245 7.257 -7.831 1.00 0.00 C ATOM 152 O ILE A 25 1.136 6.665 -7.225 1.00 0.00 O ATOM 153 CB ILE A 25 -1.881 6.208 -7.031 1.00 0.00 C ATOM 154 CG1 ILE A 25 -3.177 5.507 -7.449 1.00 0.00 C ATOM 155 CG2 ILE A 25 -2.189 7.475 -6.244 1.00 0.00 C ATOM 156 CD1 ILE A 25 -3.249 4.062 -7.010 1.00 0.00 C ATOM 0 H ILE A 25 -0.240 4.596 -8.494 1.00 0.00 H new ATOM 0 HA ILE A 25 -1.584 7.186 -8.938 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.314 5.536 -6.386 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.025 6.049 -7.030 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.273 5.554 -8.534 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -2.795 7.224 -5.373 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -1.257 7.936 -5.917 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.736 8.173 -6.878 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.193 3.628 -7.340 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.421 3.506 -7.450 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.185 4.008 -5.923 1.00 0.00 H new ATOM 168 N GLN A 26 0.302 8.551 -8.129 1.00 0.00 N ATOM 169 CA GLN A 26 1.442 9.379 -7.756 1.00 0.00 C ATOM 170 C GLN A 26 1.028 10.392 -6.696 1.00 0.00 C ATOM 171 O GLN A 26 0.150 11.222 -6.930 1.00 0.00 O ATOM 172 CB GLN A 26 2.004 10.105 -8.981 1.00 0.00 C ATOM 173 CG GLN A 26 2.115 9.224 -10.213 1.00 0.00 C ATOM 174 CD GLN A 26 0.997 9.470 -11.207 1.00 0.00 C ATOM 175 OE1 GLN A 26 -0.111 8.957 -11.054 1.00 0.00 O ATOM 176 NE2 GLN A 26 1.283 10.261 -12.235 1.00 0.00 N ATOM 0 H GLN A 26 -0.433 9.050 -8.630 1.00 0.00 H new ATOM 0 HA GLN A 26 2.219 8.733 -7.348 1.00 0.00 H new ATOM 0 HB2 GLN A 26 1.366 10.958 -9.211 1.00 0.00 H new ATOM 0 HB3 GLN A 26 2.990 10.501 -8.738 1.00 0.00 H new ATOM 0 HG2 GLN A 26 3.074 9.404 -10.699 1.00 0.00 H new ATOM 0 HG3 GLN A 26 2.103 8.177 -9.909 1.00 0.00 H new ATOM 0 HE21 GLN A 26 2.215 10.666 -12.323 1.00 0.00 H new ATOM 0 HE22 GLN A 26 0.570 10.464 -12.936 1.00 0.00 H new ATOM 185 N LEU A 27 1.649 10.311 -5.525 1.00 0.00 N ATOM 186 CA LEU A 27 1.323 11.216 -4.431 1.00 0.00 C ATOM 187 C LEU A 27 2.466 12.171 -4.133 1.00 0.00 C ATOM 188 O LEU A 27 3.620 11.762 -4.004 1.00 0.00 O ATOM 189 CB LEU A 27 0.969 10.423 -3.176 1.00 0.00 C ATOM 190 CG LEU A 27 0.146 9.164 -3.429 1.00 0.00 C ATOM 191 CD1 LEU A 27 0.179 8.246 -2.217 1.00 0.00 C ATOM 192 CD2 LEU A 27 -1.285 9.529 -3.791 1.00 0.00 C ATOM 0 H LEU A 27 2.378 9.631 -5.310 1.00 0.00 H new ATOM 0 HA LEU A 27 0.462 11.808 -4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.892 10.142 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.416 11.072 -2.497 1.00 0.00 H new ATOM 0 HG LEU A 27 0.587 8.628 -4.270 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.414 7.354 -2.420 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.209 7.957 -2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.234 8.768 -1.354 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.859 8.619 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.736 10.089 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.287 10.141 -4.693 1.00 0.00 H new ATOM 204 N LYS A 28 2.128 13.446 -4.020 1.00 0.00 N ATOM 205 CA LYS A 28 3.109 14.482 -3.729 1.00 0.00 C ATOM 206 C LYS A 28 3.425 14.522 -2.238 1.00 0.00 C ATOM 207 O LYS A 28 2.551 14.801 -1.417 1.00 0.00 O ATOM 208 CB LYS A 28 2.590 15.846 -4.188 1.00 0.00 C ATOM 209 CG LYS A 28 3.644 16.939 -4.146 1.00 0.00 C ATOM 210 CD LYS A 28 4.866 16.561 -4.965 1.00 0.00 C ATOM 211 CE LYS A 28 5.881 17.691 -5.007 1.00 0.00 C ATOM 212 NZ LYS A 28 7.064 17.344 -5.840 1.00 0.00 N ATOM 0 H LYS A 28 1.174 13.791 -4.126 1.00 0.00 H new ATOM 0 HA LYS A 28 4.024 14.248 -4.272 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.209 15.758 -5.206 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.750 16.137 -3.558 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.222 17.869 -4.527 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.939 17.123 -3.113 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.329 15.671 -4.540 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.560 16.307 -5.980 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.408 18.589 -5.404 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.207 17.924 -3.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 7.732 18.141 -5.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 7.531 16.502 -5.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 6.757 17.146 -6.814 1.00 0.00 H new ATOM 226 N LYS A 29 4.675 14.240 -1.894 1.00 0.00 N ATOM 227 CA LYS A 29 5.104 14.241 -0.501 1.00 0.00 C ATOM 228 C LYS A 29 4.852 15.600 0.148 1.00 0.00 C ATOM 229 O LYS A 29 5.113 16.643 -0.451 1.00 0.00 O ATOM 230 CB LYS A 29 6.588 13.881 -0.404 1.00 0.00 C ATOM 231 CG LYS A 29 6.837 12.443 0.015 1.00 0.00 C ATOM 232 CD LYS A 29 7.227 12.348 1.481 1.00 0.00 C ATOM 233 CE LYS A 29 6.115 12.852 2.387 1.00 0.00 C ATOM 234 NZ LYS A 29 6.443 12.658 3.827 1.00 0.00 N ATOM 0 H LYS A 29 5.411 14.007 -2.561 1.00 0.00 H new ATOM 0 HA LYS A 29 4.520 13.492 0.034 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.060 14.056 -1.371 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.069 14.548 0.311 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.939 11.851 -0.163 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.628 12.015 -0.601 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.460 11.313 1.730 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.132 12.929 1.656 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.940 13.910 2.194 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.189 12.328 2.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.661 13.014 4.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.585 11.645 4.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.313 13.179 4.058 1.00 0.00 H new ATOM 284 N GLY A 33 2.653 13.108 6.071 1.00 0.00 N ATOM 285 CA GLY A 33 2.936 11.816 5.472 1.00 0.00 C ATOM 286 C GLY A 33 2.431 11.714 4.046 1.00 0.00 C ATOM 287 O GLY A 33 2.678 12.603 3.230 1.00 0.00 O ATOM 0 HA2 GLY A 33 4.012 11.640 5.487 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.477 11.032 6.074 1.00 0.00 H new ATOM 291 N LEU A 34 1.722 10.632 3.745 1.00 0.00 N ATOM 292 CA LEU A 34 1.180 10.421 2.408 1.00 0.00 C ATOM 293 C LEU A 34 -0.344 10.439 2.434 1.00 0.00 C ATOM 294 O LEU A 34 -0.984 10.889 1.484 1.00 0.00 O ATOM 295 CB LEU A 34 1.682 9.095 1.837 1.00 0.00 C ATOM 296 CG LEU A 34 2.981 9.191 1.034 1.00 0.00 C ATOM 297 CD1 LEU A 34 3.509 7.804 0.704 1.00 0.00 C ATOM 298 CD2 LEU A 34 2.760 10.000 -0.237 1.00 0.00 C ATOM 0 H LEU A 34 1.509 9.887 4.409 1.00 0.00 H new ATOM 0 HA LEU A 34 1.522 11.234 1.767 1.00 0.00 H new ATOM 0 HB2 LEU A 34 1.831 8.395 2.659 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.906 8.675 1.197 1.00 0.00 H new ATOM 0 HG LEU A 34 3.727 9.703 1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 34 4.433 7.893 0.133 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.704 7.260 1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.769 7.264 0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.693 10.059 -0.797 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.999 9.515 -0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 34 2.429 11.005 0.024 1.00 0.00 H new ATOM 310 N GLY A 35 -0.918 9.952 3.530 1.00 0.00 N ATOM 311 CA GLY A 35 -2.362 9.928 3.657 1.00 0.00 C ATOM 312 C GLY A 35 -2.934 8.526 3.630 1.00 0.00 C ATOM 313 O GLY A 35 -4.140 8.350 3.450 1.00 0.00 O ATOM 0 H GLY A 35 -0.410 9.575 4.330 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.647 10.413 4.590 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.802 10.510 2.847 1.00 0.00 H new ATOM 317 N PHE A 36 -2.081 7.523 3.805 1.00 0.00 N ATOM 318 CA PHE A 36 -2.537 6.139 3.790 1.00 0.00 C ATOM 319 C PHE A 36 -1.554 5.212 4.498 1.00 0.00 C ATOM 320 O PHE A 36 -0.342 5.309 4.307 1.00 0.00 O ATOM 321 CB PHE A 36 -2.752 5.668 2.349 1.00 0.00 C ATOM 322 CG PHE A 36 -1.476 5.460 1.580 1.00 0.00 C ATOM 323 CD1 PHE A 36 -0.797 6.536 1.034 1.00 0.00 C ATOM 324 CD2 PHE A 36 -0.957 4.186 1.408 1.00 0.00 C ATOM 325 CE1 PHE A 36 0.376 6.347 0.328 1.00 0.00 C ATOM 326 CE2 PHE A 36 0.215 3.991 0.702 1.00 0.00 C ATOM 327 CZ PHE A 36 0.883 5.072 0.162 1.00 0.00 C ATOM 0 H PHE A 36 -1.079 7.641 3.958 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.483 6.099 4.330 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -3.313 4.734 2.362 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -3.365 6.401 1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -1.188 7.534 1.161 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.474 3.337 1.830 1.00 0.00 H new ATOM 0 HE1 PHE A 36 0.896 7.195 -0.093 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.608 2.993 0.573 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.800 4.922 -0.389 1.00 0.00 H new ATOM 337 N SER A 37 -2.094 4.298 5.295 1.00 0.00 N ATOM 338 CA SER A 37 -1.281 3.328 6.015 1.00 0.00 C ATOM 339 C SER A 37 -1.434 1.962 5.363 1.00 0.00 C ATOM 340 O SER A 37 -2.544 1.555 5.020 1.00 0.00 O ATOM 341 CB SER A 37 -1.697 3.263 7.486 1.00 0.00 C ATOM 342 OG SER A 37 -0.998 4.226 8.256 1.00 0.00 O ATOM 0 H SER A 37 -3.097 4.209 5.459 1.00 0.00 H new ATOM 0 HA SER A 37 -0.236 3.636 5.972 1.00 0.00 H new ATOM 0 HB2 SER A 37 -2.770 3.433 7.572 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.500 2.266 7.879 1.00 0.00 H new ATOM 0 HG SER A 37 -1.283 4.166 9.192 1.00 0.00 H new ATOM 348 N ILE A 38 -0.324 1.264 5.164 1.00 0.00 N ATOM 349 CA ILE A 38 -0.365 -0.042 4.520 1.00 0.00 C ATOM 350 C ILE A 38 -0.229 -1.191 5.506 1.00 0.00 C ATOM 351 O ILE A 38 0.537 -1.126 6.467 1.00 0.00 O ATOM 352 CB ILE A 38 0.740 -0.186 3.463 1.00 0.00 C ATOM 353 CG1 ILE A 38 2.106 0.070 4.093 1.00 0.00 C ATOM 354 CG2 ILE A 38 0.486 0.766 2.306 1.00 0.00 C ATOM 355 CD1 ILE A 38 3.256 -0.541 3.323 1.00 0.00 C ATOM 0 H ILE A 38 0.608 1.576 5.436 1.00 0.00 H new ATOM 0 HA ILE A 38 -1.346 -0.097 4.048 1.00 0.00 H new ATOM 0 HB ILE A 38 0.730 -1.204 3.074 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.264 1.146 4.172 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.108 -0.327 5.108 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.276 0.655 1.563 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.477 0.535 1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.476 1.792 2.674 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.194 -0.317 3.831 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.123 -1.621 3.266 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.281 -0.125 2.316 1.00 0.00 H new ATOM 367 N THR A 39 -0.967 -2.252 5.224 1.00 0.00 N ATOM 368 CA THR A 39 -0.942 -3.461 6.042 1.00 0.00 C ATOM 369 C THR A 39 -0.204 -4.573 5.300 1.00 0.00 C ATOM 370 O THR A 39 0.115 -4.431 4.120 1.00 0.00 O ATOM 371 CB THR A 39 -2.364 -3.916 6.384 1.00 0.00 C ATOM 372 OG1 THR A 39 -2.373 -5.276 6.783 1.00 0.00 O ATOM 373 CG2 THR A 39 -3.335 -3.772 5.232 1.00 0.00 C ATOM 0 H THR A 39 -1.599 -2.303 4.425 1.00 0.00 H new ATOM 0 HA THR A 39 -0.419 -3.238 6.972 1.00 0.00 H new ATOM 0 HB THR A 39 -2.687 -3.262 7.194 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.290 -5.548 6.999 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.322 -4.112 5.544 1.00 0.00 H new ATOM 0 HG22 THR A 39 -3.390 -2.726 4.931 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.993 -4.374 4.390 1.00 0.00 H new ATOM 381 N SER A 40 0.063 -5.676 5.986 1.00 0.00 N ATOM 382 CA SER A 40 0.764 -6.800 5.369 1.00 0.00 C ATOM 383 C SER A 40 0.004 -8.105 5.583 1.00 0.00 C ATOM 384 O SER A 40 -0.362 -8.444 6.709 1.00 0.00 O ATOM 385 CB SER A 40 2.180 -6.921 5.934 1.00 0.00 C ATOM 386 OG SER A 40 2.772 -8.155 5.568 1.00 0.00 O ATOM 0 H SER A 40 -0.192 -5.819 6.963 1.00 0.00 H new ATOM 0 HA SER A 40 0.824 -6.610 4.297 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.793 -6.097 5.567 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.150 -6.837 7.020 1.00 0.00 H new ATOM 0 HG SER A 40 3.677 -8.207 5.940 1.00 0.00 H new ATOM 392 N ARG A 41 -0.231 -8.834 4.496 1.00 0.00 N ATOM 393 CA ARG A 41 -0.948 -10.103 4.569 1.00 0.00 C ATOM 394 C ARG A 41 -0.126 -11.154 5.312 1.00 0.00 C ATOM 395 O ARG A 41 -0.679 -12.069 5.920 1.00 0.00 O ATOM 396 CB ARG A 41 -1.291 -10.603 3.165 1.00 0.00 C ATOM 397 CG ARG A 41 -2.457 -11.580 3.137 1.00 0.00 C ATOM 398 CD ARG A 41 -2.542 -12.310 1.805 1.00 0.00 C ATOM 399 NE ARG A 41 -2.794 -13.739 1.981 1.00 0.00 N ATOM 400 CZ ARG A 41 -3.913 -14.237 2.502 1.00 0.00 C ATOM 401 NH1 ARG A 41 -4.886 -13.425 2.902 1.00 0.00 N ATOM 402 NH2 ARG A 41 -4.061 -15.549 2.626 1.00 0.00 N ATOM 0 H ARG A 41 0.064 -8.569 3.556 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.872 -9.936 5.122 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -1.528 -9.748 2.531 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -0.413 -11.085 2.735 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.345 -12.305 3.944 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -3.388 -11.042 3.318 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.338 -11.873 1.202 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.611 -12.171 1.255 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.069 -14.394 1.687 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.777 -12.415 2.810 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.742 -13.812 3.301 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.317 -16.177 2.322 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.919 -15.930 3.025 1.00 0.00 H new ATOM 491 N SER A 48 8.494 -12.295 1.808 1.00 0.00 N ATOM 492 CA SER A 48 7.594 -12.429 0.667 1.00 0.00 C ATOM 493 C SER A 48 6.137 -12.388 1.116 1.00 0.00 C ATOM 494 O SER A 48 5.613 -13.362 1.657 1.00 0.00 O ATOM 495 CB SER A 48 7.873 -13.733 -0.088 1.00 0.00 C ATOM 496 OG SER A 48 8.968 -14.431 0.480 1.00 0.00 O ATOM 0 HA SER A 48 7.774 -11.588 -0.003 1.00 0.00 H new ATOM 0 HB2 SER A 48 6.985 -14.365 -0.067 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.083 -13.512 -1.135 1.00 0.00 H new ATOM 0 HG SER A 48 9.323 -13.922 1.238 1.00 0.00 H new ATOM 502 N ALA A 49 5.490 -11.251 0.886 1.00 0.00 N ATOM 503 CA ALA A 49 4.094 -11.073 1.261 1.00 0.00 C ATOM 504 C ALA A 49 3.507 -9.830 0.592 1.00 0.00 C ATOM 505 O ALA A 49 4.180 -8.805 0.476 1.00 0.00 O ATOM 506 CB ALA A 49 3.961 -10.980 2.773 1.00 0.00 C ATOM 0 H ALA A 49 5.913 -10.437 0.440 1.00 0.00 H new ATOM 0 HA ALA A 49 3.532 -11.941 0.916 1.00 0.00 H new ATOM 0 HB1 ALA A 49 2.912 -10.847 3.039 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.337 -11.896 3.228 1.00 0.00 H new ATOM 0 HB3 ALA A 49 4.538 -10.130 3.137 1.00 0.00 H new ATOM 512 N PRO A 50 2.245 -9.906 0.136 1.00 0.00 N ATOM 513 CA PRO A 50 1.579 -8.783 -0.531 1.00 0.00 C ATOM 514 C PRO A 50 1.122 -7.704 0.446 1.00 0.00 C ATOM 515 O PRO A 50 0.505 -7.997 1.474 1.00 0.00 O ATOM 516 CB PRO A 50 0.374 -9.443 -1.199 1.00 0.00 C ATOM 517 CG PRO A 50 0.057 -10.610 -0.329 1.00 0.00 C ATOM 518 CD PRO A 50 1.372 -11.092 0.224 1.00 0.00 C ATOM 0 HA PRO A 50 2.245 -8.267 -1.223 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.470 -8.756 -1.264 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.607 -9.758 -2.216 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.621 -10.323 0.475 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.438 -11.397 -0.898 1.00 0.00 H new ATOM 0 HD2 PRO A 50 1.271 -11.439 1.252 1.00 0.00 H new ATOM 0 HD3 PRO A 50 1.769 -11.925 -0.356 1.00 0.00 H new ATOM 526 N ILE A 51 1.430 -6.452 0.117 1.00 0.00 N ATOM 527 CA ILE A 51 1.057 -5.320 0.954 1.00 0.00 C ATOM 528 C ILE A 51 -0.258 -4.699 0.485 1.00 0.00 C ATOM 529 O ILE A 51 -0.529 -4.629 -0.714 1.00 0.00 O ATOM 530 CB ILE A 51 2.162 -4.247 0.942 1.00 0.00 C ATOM 531 CG1 ILE A 51 3.497 -4.869 1.366 1.00 0.00 C ATOM 532 CG2 ILE A 51 1.789 -3.069 1.837 1.00 0.00 C ATOM 533 CD1 ILE A 51 3.661 -5.021 2.865 1.00 0.00 C ATOM 0 H ILE A 51 1.940 -6.197 -0.729 1.00 0.00 H new ATOM 0 HA ILE A 51 0.928 -5.692 1.970 1.00 0.00 H new ATOM 0 HB ILE A 51 2.268 -3.862 -0.072 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.593 -5.850 0.900 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.310 -4.253 0.983 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.586 -2.326 1.811 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.862 -2.620 1.480 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.652 -3.419 2.860 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.631 -5.468 3.081 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.599 -4.041 3.339 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.871 -5.663 3.254 1.00 0.00 H new ATOM 545 N TYR A 52 -1.069 -4.251 1.437 1.00 0.00 N ATOM 546 CA TYR A 52 -2.355 -3.637 1.127 1.00 0.00 C ATOM 547 C TYR A 52 -2.519 -2.318 1.876 1.00 0.00 C ATOM 548 O TYR A 52 -1.676 -1.952 2.693 1.00 0.00 O ATOM 549 CB TYR A 52 -3.502 -4.583 1.488 1.00 0.00 C ATOM 550 CG TYR A 52 -3.473 -5.891 0.731 1.00 0.00 C ATOM 551 CD1 TYR A 52 -2.648 -6.933 1.136 1.00 0.00 C ATOM 552 CD2 TYR A 52 -4.272 -6.085 -0.388 1.00 0.00 C ATOM 553 CE1 TYR A 52 -2.621 -8.131 0.448 1.00 0.00 C ATOM 554 CE2 TYR A 52 -4.251 -7.280 -1.083 1.00 0.00 C ATOM 555 CZ TYR A 52 -3.424 -8.299 -0.661 1.00 0.00 C ATOM 556 OH TYR A 52 -3.399 -9.491 -1.349 1.00 0.00 O ATOM 0 H TYR A 52 -0.857 -4.302 2.434 1.00 0.00 H new ATOM 0 HA TYR A 52 -2.383 -3.438 0.056 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -3.466 -4.792 2.557 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.450 -4.081 1.293 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -2.017 -6.804 2.003 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.921 -5.289 -0.721 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.975 -8.931 0.777 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.879 -7.414 -1.951 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.023 -9.447 -2.103 1.00 0.00 H new ATOM 566 N VAL A 53 -3.607 -1.608 1.594 1.00 0.00 N ATOM 567 CA VAL A 53 -3.873 -0.332 2.249 1.00 0.00 C ATOM 568 C VAL A 53 -4.695 -0.532 3.518 1.00 0.00 C ATOM 569 O VAL A 53 -5.910 -0.725 3.463 1.00 0.00 O ATOM 570 CB VAL A 53 -4.619 0.641 1.315 1.00 0.00 C ATOM 571 CG1 VAL A 53 -4.784 2.002 1.979 1.00 0.00 C ATOM 572 CG2 VAL A 53 -3.888 0.772 -0.013 1.00 0.00 C ATOM 0 H VAL A 53 -4.316 -1.893 0.919 1.00 0.00 H new ATOM 0 HA VAL A 53 -2.905 0.099 2.506 1.00 0.00 H new ATOM 0 HB VAL A 53 -5.612 0.237 1.119 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.313 2.675 1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -5.355 1.890 2.901 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -3.802 2.416 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.429 1.463 -0.660 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.881 1.152 0.162 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.829 -0.204 -0.494 1.00 0.00 H new ATOM 582 N LYS A 54 -4.022 -0.480 4.663 1.00 0.00 N ATOM 583 CA LYS A 54 -4.682 -0.652 5.951 1.00 0.00 C ATOM 584 C LYS A 54 -5.738 0.423 6.168 1.00 0.00 C ATOM 585 O LYS A 54 -6.743 0.190 6.840 1.00 0.00 O ATOM 586 CB LYS A 54 -3.651 -0.604 7.083 1.00 0.00 C ATOM 587 CG LYS A 54 -4.266 -0.647 8.475 1.00 0.00 C ATOM 588 CD LYS A 54 -3.794 -1.861 9.261 1.00 0.00 C ATOM 589 CE LYS A 54 -4.841 -2.962 9.273 1.00 0.00 C ATOM 590 NZ LYS A 54 -5.473 -3.149 7.937 1.00 0.00 N ATOM 0 H LYS A 54 -3.017 -0.320 4.724 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.174 -1.625 5.954 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -2.965 -1.444 6.973 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -3.059 0.306 6.985 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -4.004 0.262 9.017 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.353 -0.667 8.392 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -2.871 -2.241 8.824 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.564 -1.565 10.285 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -4.379 -3.897 9.589 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.610 -2.722 10.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.852 -4.115 7.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.247 -2.464 7.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -4.762 -2.999 7.193 1.00 0.00 H new ATOM 604 N ASN A 55 -5.504 1.603 5.604 1.00 0.00 N ATOM 605 CA ASN A 55 -6.447 2.709 5.757 1.00 0.00 C ATOM 606 C ASN A 55 -6.033 3.934 4.945 1.00 0.00 C ATOM 607 O ASN A 55 -4.848 4.173 4.714 1.00 0.00 O ATOM 608 CB ASN A 55 -6.574 3.088 7.233 1.00 0.00 C ATOM 609 CG ASN A 55 -7.583 4.197 7.466 1.00 0.00 C ATOM 610 OD1 ASN A 55 -7.291 5.186 8.140 1.00 0.00 O ATOM 611 ND2 ASN A 55 -8.776 4.038 6.909 1.00 0.00 N ATOM 0 H ASN A 55 -4.680 1.819 5.043 1.00 0.00 H new ATOM 0 HA ASN A 55 -7.411 2.370 5.377 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -6.867 2.209 7.806 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.600 3.403 7.609 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -9.495 4.751 7.031 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -8.975 3.203 6.358 1.00 0.00 H new ATOM 618 N ILE A 56 -7.030 4.713 4.531 1.00 0.00 N ATOM 619 CA ILE A 56 -6.796 5.930 3.764 1.00 0.00 C ATOM 620 C ILE A 56 -7.168 7.155 4.595 1.00 0.00 C ATOM 621 O ILE A 56 -8.339 7.526 4.684 1.00 0.00 O ATOM 622 CB ILE A 56 -7.612 5.937 2.452 1.00 0.00 C ATOM 623 CG1 ILE A 56 -7.303 4.684 1.628 1.00 0.00 C ATOM 624 CG2 ILE A 56 -7.321 7.196 1.645 1.00 0.00 C ATOM 625 CD1 ILE A 56 -5.886 4.640 1.098 1.00 0.00 C ATOM 0 H ILE A 56 -8.014 4.519 4.717 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.736 5.962 3.512 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.672 5.933 2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -7.479 3.802 2.244 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -7.997 4.631 0.789 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -7.905 7.182 0.725 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.590 8.074 2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -6.260 7.234 1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -5.740 3.725 0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -5.711 5.503 0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.185 4.661 1.932 1.00 0.00 H new ATOM 637 N LEU A 57 -6.166 7.768 5.213 1.00 0.00 N ATOM 638 CA LEU A 57 -6.382 8.941 6.056 1.00 0.00 C ATOM 639 C LEU A 57 -7.135 10.040 5.307 1.00 0.00 C ATOM 640 O LEU A 57 -6.922 10.247 4.112 1.00 0.00 O ATOM 641 CB LEU A 57 -5.045 9.469 6.575 1.00 0.00 C ATOM 642 CG LEU A 57 -4.123 8.396 7.158 1.00 0.00 C ATOM 643 CD1 LEU A 57 -2.887 9.031 7.774 1.00 0.00 C ATOM 644 CD2 LEU A 57 -4.863 7.557 8.188 1.00 0.00 C ATOM 0 H LEU A 57 -5.192 7.472 5.147 1.00 0.00 H new ATOM 0 HA LEU A 57 -6.998 8.637 6.902 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.526 9.972 5.759 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.238 10.220 7.341 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.804 7.741 6.347 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.243 8.252 8.183 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.344 9.586 7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.186 9.711 8.572 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.191 6.800 8.591 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.213 8.199 8.996 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.716 7.070 7.716 1.00 0.00 H new ATOM 656 N PRO A 58 -8.037 10.759 6.005 1.00 0.00 N ATOM 657 CA PRO A 58 -8.834 11.836 5.406 1.00 0.00 C ATOM 658 C PRO A 58 -8.026 13.104 5.153 1.00 0.00 C ATOM 659 O PRO A 58 -8.385 13.919 4.301 1.00 0.00 O ATOM 660 CB PRO A 58 -9.913 12.096 6.455 1.00 0.00 C ATOM 661 CG PRO A 58 -9.278 11.718 7.747 1.00 0.00 C ATOM 662 CD PRO A 58 -8.355 10.571 7.435 1.00 0.00 C ATOM 0 HA PRO A 58 -9.220 11.553 4.427 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.222 13.141 6.456 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.805 11.500 6.262 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -8.728 12.557 8.172 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.029 11.426 8.480 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -7.457 10.600 8.052 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -8.835 9.609 7.616 1.00 0.00 H new ATOM 670 N ARG A 59 -6.940 13.272 5.897 1.00 0.00 N ATOM 671 CA ARG A 59 -6.091 14.446 5.751 1.00 0.00 C ATOM 672 C ARG A 59 -4.715 14.057 5.225 1.00 0.00 C ATOM 673 O ARG A 59 -3.720 14.117 5.950 1.00 0.00 O ATOM 674 CB ARG A 59 -5.957 15.175 7.089 1.00 0.00 C ATOM 675 CG ARG A 59 -7.285 15.393 7.797 1.00 0.00 C ATOM 676 CD ARG A 59 -7.172 16.448 8.888 1.00 0.00 C ATOM 677 NE ARG A 59 -7.559 15.925 10.196 1.00 0.00 N ATOM 678 CZ ARG A 59 -7.881 16.692 11.234 1.00 0.00 C ATOM 679 NH1 ARG A 59 -7.866 18.015 11.123 1.00 0.00 N ATOM 680 NH2 ARG A 59 -8.222 16.135 12.389 1.00 0.00 N ATOM 0 H ARG A 59 -6.627 12.610 6.607 1.00 0.00 H new ATOM 0 HA ARG A 59 -6.558 15.116 5.029 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -5.297 14.603 7.741 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.481 16.141 6.921 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -8.039 15.698 7.071 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -7.624 14.453 8.233 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.147 16.815 8.933 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -7.804 17.299 8.636 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.584 14.913 10.321 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.606 18.450 10.237 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.114 18.597 11.923 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -8.237 15.119 12.481 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -8.469 16.723 13.185 1.00 0.00 H new ATOM 694 N GLY A 60 -4.665 13.658 3.960 1.00 0.00 N ATOM 695 CA GLY A 60 -3.406 13.262 3.358 1.00 0.00 C ATOM 696 C GLY A 60 -3.364 13.528 1.867 1.00 0.00 C ATOM 697 O GLY A 60 -4.329 14.030 1.290 1.00 0.00 O ATOM 0 H GLY A 60 -5.473 13.602 3.340 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.591 13.800 3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -3.239 12.200 3.539 1.00 0.00 H new ATOM 701 N ALA A 61 -2.239 13.194 1.241 1.00 0.00 N ATOM 702 CA ALA A 61 -2.067 13.404 -0.192 1.00 0.00 C ATOM 703 C ALA A 61 -2.835 12.369 -1.009 1.00 0.00 C ATOM 704 O ALA A 61 -3.405 12.690 -2.050 1.00 0.00 O ATOM 705 CB ALA A 61 -0.589 13.378 -0.555 1.00 0.00 C ATOM 0 H ALA A 61 -1.432 12.776 1.705 1.00 0.00 H new ATOM 0 HA ALA A 61 -2.476 14.385 -0.436 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.475 13.536 -1.627 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.068 14.168 -0.014 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -0.165 12.411 -0.283 1.00 0.00 H new ATOM 711 N ALA A 62 -2.838 11.126 -0.540 1.00 0.00 N ATOM 712 CA ALA A 62 -3.531 10.050 -1.244 1.00 0.00 C ATOM 713 C ALA A 62 -5.011 10.365 -1.421 1.00 0.00 C ATOM 714 O ALA A 62 -5.521 10.371 -2.542 1.00 0.00 O ATOM 715 CB ALA A 62 -3.355 8.731 -0.507 1.00 0.00 C ATOM 0 H ALA A 62 -2.371 10.838 0.320 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.086 9.961 -2.235 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.878 7.941 -1.046 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -2.294 8.488 -0.445 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.767 8.818 0.499 1.00 0.00 H new ATOM 721 N ILE A 63 -5.698 10.631 -0.317 1.00 0.00 N ATOM 722 CA ILE A 63 -7.114 10.949 -0.367 1.00 0.00 C ATOM 723 C ILE A 63 -7.354 12.238 -1.137 1.00 0.00 C ATOM 724 O ILE A 63 -8.327 12.360 -1.883 1.00 0.00 O ATOM 725 CB ILE A 63 -7.704 11.083 1.047 1.00 0.00 C ATOM 726 CG1 ILE A 63 -9.129 10.541 1.049 1.00 0.00 C ATOM 727 CG2 ILE A 63 -7.665 12.535 1.525 1.00 0.00 C ATOM 728 CD1 ILE A 63 -9.685 10.315 2.432 1.00 0.00 C ATOM 0 H ILE A 63 -5.296 10.632 0.620 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.612 10.127 -0.881 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.100 10.500 1.743 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.775 11.238 0.516 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -9.152 9.600 0.499 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.088 12.600 2.527 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -6.633 12.884 1.544 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.246 13.158 0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -10.702 9.929 2.357 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -9.062 9.594 2.962 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -9.694 11.258 2.979 1.00 0.00 H new ATOM 740 N GLN A 64 -6.463 13.200 -0.941 1.00 0.00 N ATOM 741 CA GLN A 64 -6.564 14.476 -1.593 1.00 0.00 C ATOM 742 C GLN A 64 -6.348 14.328 -3.098 1.00 0.00 C ATOM 743 O GLN A 64 -6.967 15.034 -3.895 1.00 0.00 O ATOM 744 CB GLN A 64 -5.539 15.422 -0.975 1.00 0.00 C ATOM 745 CG GLN A 64 -5.264 16.631 -1.821 1.00 0.00 C ATOM 746 CD GLN A 64 -4.308 17.608 -1.166 1.00 0.00 C ATOM 747 OE1 GLN A 64 -4.012 17.504 0.024 1.00 0.00 O ATOM 748 NE2 GLN A 64 -3.817 18.567 -1.944 1.00 0.00 N ATOM 0 H GLN A 64 -5.655 13.108 -0.325 1.00 0.00 H new ATOM 0 HA GLN A 64 -7.563 14.889 -1.450 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -5.896 15.745 0.003 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -4.607 14.881 -0.812 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -4.850 16.312 -2.777 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -6.204 17.139 -2.035 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -4.089 18.617 -2.926 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.168 19.254 -1.559 1.00 0.00 H new ATOM 757 N ASP A 65 -5.476 13.399 -3.478 1.00 0.00 N ATOM 758 CA ASP A 65 -5.192 13.152 -4.885 1.00 0.00 C ATOM 759 C ASP A 65 -6.378 12.465 -5.556 1.00 0.00 C ATOM 760 O ASP A 65 -6.655 12.692 -6.734 1.00 0.00 O ATOM 761 CB ASP A 65 -3.933 12.295 -5.033 1.00 0.00 C ATOM 762 CG ASP A 65 -2.720 13.116 -5.422 1.00 0.00 C ATOM 763 OD1 ASP A 65 -2.424 14.108 -4.724 1.00 0.00 O ATOM 764 OD2 ASP A 65 -2.065 12.767 -6.427 1.00 0.00 O ATOM 0 H ASP A 65 -4.955 12.806 -2.831 1.00 0.00 H new ATOM 0 HA ASP A 65 -5.022 14.111 -5.375 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.734 11.780 -4.093 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -4.106 11.527 -5.787 1.00 0.00 H new ATOM 769 N GLY A 66 -7.071 11.623 -4.796 1.00 0.00 N ATOM 770 CA GLY A 66 -8.217 10.911 -5.328 1.00 0.00 C ATOM 771 C GLY A 66 -7.826 9.901 -6.387 1.00 0.00 C ATOM 772 O GLY A 66 -8.331 9.939 -7.508 1.00 0.00 O ATOM 0 H GLY A 66 -6.858 11.421 -3.819 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -8.734 10.400 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -8.921 11.626 -5.754 1.00 0.00 H new ATOM 776 N ARG A 67 -6.919 8.996 -6.030 1.00 0.00 N ATOM 777 CA ARG A 67 -6.458 7.974 -6.962 1.00 0.00 C ATOM 778 C ARG A 67 -6.313 6.622 -6.271 1.00 0.00 C ATOM 779 O ARG A 67 -6.805 5.608 -6.765 1.00 0.00 O ATOM 780 CB ARG A 67 -5.124 8.389 -7.582 1.00 0.00 C ATOM 781 CG ARG A 67 -5.179 9.720 -8.313 1.00 0.00 C ATOM 782 CD ARG A 67 -4.207 9.757 -9.480 1.00 0.00 C ATOM 783 NE ARG A 67 -4.262 11.027 -10.198 1.00 0.00 N ATOM 784 CZ ARG A 67 -3.302 11.461 -11.014 1.00 0.00 C ATOM 785 NH1 ARG A 67 -2.214 10.730 -11.217 1.00 0.00 N ATOM 786 NH2 ARG A 67 -3.432 12.630 -11.627 1.00 0.00 N ATOM 0 H ARG A 67 -6.491 8.950 -5.105 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.205 7.875 -7.749 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.370 8.447 -6.797 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.800 7.615 -8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.192 9.895 -8.676 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -4.946 10.527 -7.619 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -3.194 9.592 -9.113 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -4.434 8.942 -10.167 1.00 0.00 H new ATOM 0 HE ARG A 67 -5.084 11.617 -10.067 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -2.109 9.831 -10.747 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -1.482 11.067 -11.843 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -4.266 13.196 -11.474 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -2.698 12.963 -12.252 1.00 0.00 H new ATOM 800 N LEU A 68 -5.638 6.614 -5.128 1.00 0.00 N ATOM 801 CA LEU A 68 -5.429 5.385 -4.377 1.00 0.00 C ATOM 802 C LEU A 68 -6.333 5.343 -3.144 1.00 0.00 C ATOM 803 O LEU A 68 -6.254 6.209 -2.272 1.00 0.00 O ATOM 804 CB LEU A 68 -3.947 5.254 -3.986 1.00 0.00 C ATOM 805 CG LEU A 68 -3.663 4.945 -2.514 1.00 0.00 C ATOM 806 CD1 LEU A 68 -4.174 3.561 -2.148 1.00 0.00 C ATOM 807 CD2 LEU A 68 -2.174 5.056 -2.226 1.00 0.00 C ATOM 0 H LEU A 68 -5.227 7.445 -4.702 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.694 4.537 -5.008 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.500 4.467 -4.594 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.440 6.184 -4.245 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.190 5.677 -1.902 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.962 3.361 -1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.250 3.514 -2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.677 2.814 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.989 4.833 -1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.629 4.346 -2.849 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.835 6.068 -2.447 1.00 0.00 H new ATOM 819 N LYS A 69 -7.191 4.331 -3.085 1.00 0.00 N ATOM 820 CA LYS A 69 -8.111 4.169 -1.968 1.00 0.00 C ATOM 821 C LYS A 69 -7.731 2.961 -1.120 1.00 0.00 C ATOM 822 O LYS A 69 -6.657 2.384 -1.291 1.00 0.00 O ATOM 823 CB LYS A 69 -9.536 4.010 -2.489 1.00 0.00 C ATOM 824 CG LYS A 69 -10.287 5.322 -2.592 1.00 0.00 C ATOM 825 CD LYS A 69 -11.516 5.173 -3.463 1.00 0.00 C ATOM 826 CE LYS A 69 -12.373 6.428 -3.447 1.00 0.00 C ATOM 827 NZ LYS A 69 -13.642 6.225 -2.693 1.00 0.00 N ATOM 0 H LYS A 69 -7.268 3.609 -3.801 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.051 5.059 -1.342 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.506 3.539 -3.471 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -10.084 3.337 -1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.580 5.657 -1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -9.633 6.089 -3.007 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -11.212 4.953 -4.486 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -12.107 4.325 -3.117 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -11.810 7.246 -2.997 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -12.602 6.724 -4.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -14.198 7.104 -2.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -14.191 5.462 -3.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -13.424 5.968 -1.709 1.00 0.00 H new ATOM 841 N ALA A 70 -8.618 2.580 -0.207 1.00 0.00 N ATOM 842 CA ALA A 70 -8.374 1.436 0.663 1.00 0.00 C ATOM 843 C ALA A 70 -8.645 0.127 -0.071 1.00 0.00 C ATOM 844 O ALA A 70 -9.053 0.128 -1.232 1.00 0.00 O ATOM 845 CB ALA A 70 -9.233 1.530 1.915 1.00 0.00 C ATOM 0 H ALA A 70 -9.512 3.046 -0.051 1.00 0.00 H new ATOM 0 HA ALA A 70 -7.325 1.450 0.957 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -9.040 0.669 2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -8.990 2.445 2.455 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -10.286 1.544 1.634 1.00 0.00 H new ATOM 851 N GLY A 71 -8.414 -0.989 0.614 1.00 0.00 N ATOM 852 CA GLY A 71 -8.639 -2.287 0.009 1.00 0.00 C ATOM 853 C GLY A 71 -7.806 -2.500 -1.242 1.00 0.00 C ATOM 854 O GLY A 71 -8.126 -3.355 -2.069 1.00 0.00 O ATOM 0 H GLY A 71 -8.076 -1.016 1.576 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.405 -3.067 0.734 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -9.695 -2.389 -0.240 1.00 0.00 H new ATOM 858 N ASP A 72 -6.737 -1.722 -1.380 1.00 0.00 N ATOM 859 CA ASP A 72 -5.857 -1.829 -2.538 1.00 0.00 C ATOM 860 C ASP A 72 -4.606 -2.632 -2.193 1.00 0.00 C ATOM 861 O ASP A 72 -4.164 -2.645 -1.044 1.00 0.00 O ATOM 862 CB ASP A 72 -5.466 -0.436 -3.037 1.00 0.00 C ATOM 863 CG ASP A 72 -6.217 -0.044 -4.296 1.00 0.00 C ATOM 864 OD1 ASP A 72 -6.441 -0.925 -5.152 1.00 0.00 O ATOM 865 OD2 ASP A 72 -6.580 1.144 -4.424 1.00 0.00 O ATOM 0 H ASP A 72 -6.459 -1.010 -0.704 1.00 0.00 H new ATOM 0 HA ASP A 72 -6.395 -2.351 -3.330 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.665 0.297 -2.255 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -4.394 -0.410 -3.233 1.00 0.00 H new ATOM 870 N ARG A 73 -4.039 -3.299 -3.192 1.00 0.00 N ATOM 871 CA ARG A 73 -2.839 -4.102 -2.987 1.00 0.00 C ATOM 872 C ARG A 73 -1.618 -3.443 -3.622 1.00 0.00 C ATOM 873 O ARG A 73 -1.552 -3.279 -4.841 1.00 0.00 O ATOM 874 CB ARG A 73 -3.030 -5.506 -3.563 1.00 0.00 C ATOM 875 CG ARG A 73 -1.878 -6.451 -3.255 1.00 0.00 C ATOM 876 CD ARG A 73 -1.502 -7.289 -4.468 1.00 0.00 C ATOM 877 NE ARG A 73 -2.629 -8.079 -4.957 1.00 0.00 N ATOM 878 CZ ARG A 73 -2.537 -8.976 -5.936 1.00 0.00 C ATOM 879 NH1 ARG A 73 -1.373 -9.199 -6.533 1.00 0.00 N ATOM 880 NH2 ARG A 73 -3.611 -9.651 -6.321 1.00 0.00 N ATOM 0 H ARG A 73 -4.390 -3.300 -4.150 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.669 -4.176 -1.913 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -3.953 -5.930 -3.167 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.151 -5.433 -4.644 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -1.012 -5.876 -2.927 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.156 -7.107 -2.430 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.145 -6.635 -5.264 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.678 -7.954 -4.208 1.00 0.00 H new ATOM 0 HE ARG A 73 -3.540 -7.935 -4.523 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.543 -8.682 -6.242 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -1.308 -9.888 -7.283 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -4.509 -9.483 -5.867 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -3.540 -10.338 -7.071 1.00 0.00 H new ATOM 894 N LEU A 74 -0.656 -3.069 -2.785 1.00 0.00 N ATOM 895 CA LEU A 74 0.567 -2.430 -3.252 1.00 0.00 C ATOM 896 C LEU A 74 1.416 -3.395 -4.066 1.00 0.00 C ATOM 897 O LEU A 74 1.844 -4.438 -3.572 1.00 0.00 O ATOM 898 CB LEU A 74 1.371 -1.909 -2.061 1.00 0.00 C ATOM 899 CG LEU A 74 0.991 -0.504 -1.604 1.00 0.00 C ATOM 900 CD1 LEU A 74 -0.057 -0.563 -0.506 1.00 0.00 C ATOM 901 CD2 LEU A 74 2.223 0.256 -1.133 1.00 0.00 C ATOM 0 H LEU A 74 -0.701 -3.199 -1.774 1.00 0.00 H new ATOM 0 HA LEU A 74 0.288 -1.596 -3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.243 -2.596 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.429 -1.918 -2.322 1.00 0.00 H new ATOM 0 HG LEU A 74 0.564 0.030 -2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.314 0.449 -0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.949 -1.065 -0.881 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.339 -1.116 0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.933 1.256 -0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.681 -0.275 -0.299 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.939 0.332 -1.952 1.00 0.00 H new ATOM 913 N ILE A 75 1.663 -3.029 -5.316 1.00 0.00 N ATOM 914 CA ILE A 75 2.468 -3.845 -6.209 1.00 0.00 C ATOM 915 C ILE A 75 3.860 -3.245 -6.378 1.00 0.00 C ATOM 916 O ILE A 75 4.830 -3.959 -6.635 1.00 0.00 O ATOM 917 CB ILE A 75 1.804 -3.982 -7.587 1.00 0.00 C ATOM 918 CG1 ILE A 75 0.377 -4.506 -7.414 1.00 0.00 C ATOM 919 CG2 ILE A 75 2.622 -4.904 -8.488 1.00 0.00 C ATOM 920 CD1 ILE A 75 -0.203 -5.134 -8.660 1.00 0.00 C ATOM 0 H ILE A 75 1.314 -2.167 -5.735 1.00 0.00 H new ATOM 0 HA ILE A 75 2.552 -4.834 -5.759 1.00 0.00 H new ATOM 0 HB ILE A 75 1.764 -3.004 -8.066 1.00 0.00 H new ATOM 0 HG12 ILE A 75 0.366 -5.242 -6.610 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.266 -3.683 -7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 75 2.136 -4.989 -9.460 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.623 -4.492 -8.618 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.693 -5.891 -8.031 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.216 -5.480 -8.455 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.227 -4.396 -9.462 1.00 0.00 H new ATOM 0 HD13 ILE A 75 0.415 -5.979 -8.963 1.00 0.00 H new ATOM 932 N GLU A 76 3.951 -1.925 -6.229 1.00 0.00 N ATOM 933 CA GLU A 76 5.229 -1.233 -6.370 1.00 0.00 C ATOM 934 C GLU A 76 5.218 0.116 -5.654 1.00 0.00 C ATOM 935 O GLU A 76 4.168 0.737 -5.487 1.00 0.00 O ATOM 936 CB GLU A 76 5.560 -1.032 -7.849 1.00 0.00 C ATOM 937 CG GLU A 76 5.829 -2.330 -8.595 1.00 0.00 C ATOM 938 CD GLU A 76 6.643 -2.118 -9.857 1.00 0.00 C ATOM 939 OE1 GLU A 76 7.315 -1.070 -9.961 1.00 0.00 O ATOM 940 OE2 GLU A 76 6.608 -2.999 -10.740 1.00 0.00 O ATOM 0 H GLU A 76 3.161 -1.317 -6.012 1.00 0.00 H new ATOM 0 HA GLU A 76 5.995 -1.855 -5.907 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.732 -0.511 -8.330 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.435 -0.387 -7.933 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.358 -3.020 -7.937 1.00 0.00 H new ATOM 0 HG3 GLU A 76 4.880 -2.800 -8.854 1.00 0.00 H new ATOM 947 N VAL A 77 6.401 0.563 -5.243 1.00 0.00 N ATOM 948 CA VAL A 77 6.549 1.840 -4.553 1.00 0.00 C ATOM 949 C VAL A 77 7.780 2.584 -5.065 1.00 0.00 C ATOM 950 O VAL A 77 8.889 2.049 -5.051 1.00 0.00 O ATOM 951 CB VAL A 77 6.670 1.649 -3.026 1.00 0.00 C ATOM 952 CG1 VAL A 77 6.920 2.979 -2.327 1.00 0.00 C ATOM 953 CG2 VAL A 77 5.423 0.978 -2.468 1.00 0.00 C ATOM 0 H VAL A 77 7.276 0.056 -5.377 1.00 0.00 H new ATOM 0 HA VAL A 77 5.653 2.425 -4.760 1.00 0.00 H new ATOM 0 HB VAL A 77 7.525 1.001 -2.835 1.00 0.00 H new ATOM 0 HG11 VAL A 77 7.001 2.816 -1.252 1.00 0.00 H new ATOM 0 HG12 VAL A 77 7.847 3.417 -2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.091 3.658 -2.529 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.529 0.853 -1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.551 1.598 -2.677 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.295 0.002 -2.936 1.00 0.00 H new ATOM 963 N ASN A 78 7.579 3.817 -5.522 1.00 0.00 N ATOM 964 CA ASN A 78 8.675 4.627 -6.042 1.00 0.00 C ATOM 965 C ASN A 78 9.392 3.903 -7.178 1.00 0.00 C ATOM 966 O ASN A 78 10.594 4.080 -7.380 1.00 0.00 O ATOM 967 CB ASN A 78 9.668 4.959 -4.925 1.00 0.00 C ATOM 968 CG ASN A 78 9.291 6.221 -4.174 1.00 0.00 C ATOM 969 OD1 ASN A 78 9.066 6.194 -2.963 1.00 0.00 O ATOM 970 ND2 ASN A 78 9.221 7.337 -4.891 1.00 0.00 N ATOM 0 H ASN A 78 6.668 4.276 -5.543 1.00 0.00 H new ATOM 0 HA ASN A 78 8.256 5.555 -6.432 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.717 4.124 -4.226 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.664 5.077 -5.351 1.00 0.00 H new ATOM 0 HD21 ASN A 78 8.973 8.218 -4.441 1.00 0.00 H new ATOM 0 HD22 ASN A 78 9.416 7.313 -5.892 1.00 0.00 H new ATOM 977 N GLY A 79 8.644 3.089 -7.916 1.00 0.00 N ATOM 978 CA GLY A 79 9.220 2.349 -9.022 1.00 0.00 C ATOM 979 C GLY A 79 9.925 1.081 -8.575 1.00 0.00 C ATOM 980 O GLY A 79 10.687 0.487 -9.338 1.00 0.00 O ATOM 0 H GLY A 79 7.648 2.929 -7.767 1.00 0.00 H new ATOM 0 HA2 GLY A 79 8.433 2.092 -9.731 1.00 0.00 H new ATOM 0 HA3 GLY A 79 9.929 2.987 -9.551 1.00 0.00 H new ATOM 984 N VAL A 80 9.674 0.666 -7.336 1.00 0.00 N ATOM 985 CA VAL A 80 10.293 -0.535 -6.791 1.00 0.00 C ATOM 986 C VAL A 80 9.282 -1.668 -6.654 1.00 0.00 C ATOM 987 O VAL A 80 8.097 -1.432 -6.419 1.00 0.00 O ATOM 988 CB VAL A 80 10.933 -0.266 -5.415 1.00 0.00 C ATOM 989 CG1 VAL A 80 11.480 -1.551 -4.810 1.00 0.00 C ATOM 990 CG2 VAL A 80 12.029 0.780 -5.534 1.00 0.00 C ATOM 0 H VAL A 80 9.045 1.145 -6.691 1.00 0.00 H new ATOM 0 HA VAL A 80 11.071 -0.831 -7.495 1.00 0.00 H new ATOM 0 HB VAL A 80 10.160 0.118 -4.749 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.926 -1.335 -3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 80 10.669 -2.268 -4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.237 -1.971 -5.472 1.00 0.00 H new ATOM 0 HG21 VAL A 80 12.470 0.958 -4.553 1.00 0.00 H new ATOM 0 HG22 VAL A 80 12.799 0.424 -6.219 1.00 0.00 H new ATOM 0 HG23 VAL A 80 11.605 1.709 -5.915 1.00 0.00 H new ATOM 1000 N ASP A 81 9.765 -2.897 -6.785 1.00 0.00 N ATOM 1001 CA ASP A 81 8.913 -4.071 -6.662 1.00 0.00 C ATOM 1002 C ASP A 81 8.837 -4.522 -5.208 1.00 0.00 C ATOM 1003 O ASP A 81 9.846 -4.894 -4.609 1.00 0.00 O ATOM 1004 CB ASP A 81 9.444 -5.210 -7.536 1.00 0.00 C ATOM 1005 CG ASP A 81 8.419 -6.308 -7.741 1.00 0.00 C ATOM 1006 OD1 ASP A 81 7.359 -6.026 -8.340 1.00 0.00 O ATOM 1007 OD2 ASP A 81 8.675 -7.449 -7.302 1.00 0.00 O ATOM 0 H ASP A 81 10.745 -3.106 -6.977 1.00 0.00 H new ATOM 0 HA ASP A 81 7.911 -3.806 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 81 9.744 -4.811 -8.505 1.00 0.00 H new ATOM 0 HB3 ASP A 81 10.337 -5.632 -7.075 1.00 0.00 H new ATOM 1012 N LEU A 82 7.635 -4.483 -4.646 1.00 0.00 N ATOM 1013 CA LEU A 82 7.427 -4.885 -3.259 1.00 0.00 C ATOM 1014 C LEU A 82 7.121 -6.375 -3.158 1.00 0.00 C ATOM 1015 O LEU A 82 6.577 -6.837 -2.155 1.00 0.00 O ATOM 1016 CB LEU A 82 6.286 -4.079 -2.638 1.00 0.00 C ATOM 1017 CG LEU A 82 6.213 -2.617 -3.077 1.00 0.00 C ATOM 1018 CD1 LEU A 82 4.833 -2.045 -2.792 1.00 0.00 C ATOM 1019 CD2 LEU A 82 7.290 -1.798 -2.380 1.00 0.00 C ATOM 0 H LEU A 82 6.790 -4.177 -5.128 1.00 0.00 H new ATOM 0 HA LEU A 82 8.348 -4.685 -2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.342 -4.564 -2.886 1.00 0.00 H new ATOM 0 HB3 LEU A 82 6.387 -4.112 -1.553 1.00 0.00 H new ATOM 0 HG LEU A 82 6.388 -2.568 -4.152 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.798 -1.003 -3.111 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.082 -2.617 -3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.628 -2.105 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 82 7.224 -0.759 -2.704 1.00 0.00 H new ATOM 0 HD22 LEU A 82 7.146 -1.851 -1.301 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.272 -2.196 -2.635 1.00 0.00 H new ATOM 1031 N ALA A 83 7.470 -7.124 -4.198 1.00 0.00 N ATOM 1032 CA ALA A 83 7.229 -8.562 -4.212 1.00 0.00 C ATOM 1033 C ALA A 83 8.458 -9.324 -3.736 1.00 0.00 C ATOM 1034 O ALA A 83 9.158 -9.955 -4.528 1.00 0.00 O ATOM 1035 CB ALA A 83 6.823 -9.018 -5.605 1.00 0.00 C ATOM 0 H ALA A 83 7.919 -6.761 -5.039 1.00 0.00 H new ATOM 0 HA ALA A 83 6.411 -8.777 -3.524 1.00 0.00 H new ATOM 0 HB1 ALA A 83 6.647 -10.094 -5.599 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.911 -8.502 -5.905 1.00 0.00 H new ATOM 0 HB3 ALA A 83 7.620 -8.785 -6.311 1.00 0.00 H new ATOM 1041 N GLY A 84 8.717 -9.257 -2.434 1.00 0.00 N ATOM 1042 CA GLY A 84 9.864 -9.943 -1.869 1.00 0.00 C ATOM 1043 C GLY A 84 10.726 -9.025 -1.024 1.00 0.00 C ATOM 1044 O GLY A 84 11.953 -9.105 -1.065 1.00 0.00 O ATOM 0 H GLY A 84 8.153 -8.740 -1.760 1.00 0.00 H new ATOM 0 HA2 GLY A 84 9.520 -10.778 -1.259 1.00 0.00 H new ATOM 0 HA3 GLY A 84 10.466 -10.363 -2.675 1.00 0.00 H new ATOM 1048 N LYS A 85 10.082 -8.151 -0.257 1.00 0.00 N ATOM 1049 CA LYS A 85 10.798 -7.215 0.601 1.00 0.00 C ATOM 1050 C LYS A 85 10.331 -7.333 2.053 1.00 0.00 C ATOM 1051 O LYS A 85 10.885 -8.115 2.826 1.00 0.00 O ATOM 1052 CB LYS A 85 10.615 -5.783 0.090 1.00 0.00 C ATOM 1053 CG LYS A 85 11.266 -5.531 -1.260 1.00 0.00 C ATOM 1054 CD LYS A 85 12.010 -4.206 -1.282 1.00 0.00 C ATOM 1055 CE LYS A 85 12.526 -3.882 -2.675 1.00 0.00 C ATOM 1056 NZ LYS A 85 13.707 -2.978 -2.634 1.00 0.00 N ATOM 0 H LYS A 85 9.066 -8.072 -0.212 1.00 0.00 H new ATOM 0 HA LYS A 85 11.859 -7.465 0.570 1.00 0.00 H new ATOM 0 HB2 LYS A 85 9.549 -5.566 0.016 1.00 0.00 H new ATOM 0 HB3 LYS A 85 11.032 -5.089 0.820 1.00 0.00 H new ATOM 0 HG2 LYS A 85 11.958 -6.342 -1.488 1.00 0.00 H new ATOM 0 HG3 LYS A 85 10.503 -5.534 -2.039 1.00 0.00 H new ATOM 0 HD2 LYS A 85 11.347 -3.409 -0.943 1.00 0.00 H new ATOM 0 HD3 LYS A 85 12.845 -4.244 -0.583 1.00 0.00 H new ATOM 0 HE2 LYS A 85 12.794 -4.806 -3.187 1.00 0.00 H new ATOM 0 HE3 LYS A 85 11.731 -3.415 -3.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 14.028 -2.782 -3.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.445 -2.086 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 14.475 -3.434 -2.101 1.00 0.00 H new ATOM 1070 N SER A 86 9.311 -6.555 2.418 1.00 0.00 N ATOM 1071 CA SER A 86 8.770 -6.572 3.774 1.00 0.00 C ATOM 1072 C SER A 86 7.833 -5.388 3.987 1.00 0.00 C ATOM 1073 O SER A 86 7.893 -4.401 3.254 1.00 0.00 O ATOM 1074 CB SER A 86 9.897 -6.536 4.811 1.00 0.00 C ATOM 1075 OG SER A 86 9.931 -7.733 5.570 1.00 0.00 O ATOM 0 H SER A 86 8.842 -5.903 1.789 1.00 0.00 H new ATOM 0 HA SER A 86 8.209 -7.498 3.902 1.00 0.00 H new ATOM 0 HB2 SER A 86 10.854 -6.393 4.308 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.756 -5.684 5.476 1.00 0.00 H new ATOM 0 HG SER A 86 10.272 -8.464 5.013 1.00 0.00 H new ATOM 1081 N GLN A 87 6.977 -5.484 4.996 1.00 0.00 N ATOM 1082 CA GLN A 87 6.042 -4.409 5.300 1.00 0.00 C ATOM 1083 C GLN A 87 6.791 -3.200 5.828 1.00 0.00 C ATOM 1084 O GLN A 87 6.677 -2.099 5.293 1.00 0.00 O ATOM 1085 CB GLN A 87 5.000 -4.869 6.319 1.00 0.00 C ATOM 1086 CG GLN A 87 3.763 -3.984 6.356 1.00 0.00 C ATOM 1087 CD GLN A 87 2.842 -4.315 7.511 1.00 0.00 C ATOM 1088 OE1 GLN A 87 3.084 -5.256 8.265 1.00 0.00 O ATOM 1089 NE2 GLN A 87 1.776 -3.537 7.654 1.00 0.00 N ATOM 0 H GLN A 87 6.911 -6.292 5.615 1.00 0.00 H new ATOM 0 HA GLN A 87 5.525 -4.133 4.381 1.00 0.00 H new ATOM 0 HB2 GLN A 87 4.700 -5.891 6.086 1.00 0.00 H new ATOM 0 HB3 GLN A 87 5.454 -4.888 7.310 1.00 0.00 H new ATOM 0 HG2 GLN A 87 4.070 -2.941 6.429 1.00 0.00 H new ATOM 0 HG3 GLN A 87 3.217 -4.091 5.419 1.00 0.00 H new ATOM 0 HE21 GLN A 87 1.615 -2.767 7.004 1.00 0.00 H new ATOM 0 HE22 GLN A 87 1.117 -3.709 8.414 1.00 0.00 H new ATOM 1098 N GLU A 88 7.578 -3.424 6.871 1.00 0.00 N ATOM 1099 CA GLU A 88 8.372 -2.360 7.461 1.00 0.00 C ATOM 1100 C GLU A 88 9.390 -1.861 6.447 1.00 0.00 C ATOM 1101 O GLU A 88 9.757 -0.687 6.442 1.00 0.00 O ATOM 1102 CB GLU A 88 9.077 -2.849 8.727 1.00 0.00 C ATOM 1103 CG GLU A 88 9.830 -4.155 8.538 1.00 0.00 C ATOM 1104 CD GLU A 88 10.802 -4.435 9.668 1.00 0.00 C ATOM 1105 OE1 GLU A 88 10.603 -3.887 10.772 1.00 0.00 O ATOM 1106 OE2 GLU A 88 11.763 -5.203 9.448 1.00 0.00 O ATOM 0 H GLU A 88 7.682 -4.332 7.324 1.00 0.00 H new ATOM 0 HA GLU A 88 7.710 -1.539 7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 88 9.775 -2.082 9.063 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.338 -2.977 9.518 1.00 0.00 H new ATOM 0 HG2 GLU A 88 9.116 -4.975 8.466 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.375 -4.123 7.594 1.00 0.00 H new ATOM 1113 N GLU A 89 9.828 -2.765 5.573 1.00 0.00 N ATOM 1114 CA GLU A 89 10.787 -2.411 4.537 1.00 0.00 C ATOM 1115 C GLU A 89 10.113 -1.526 3.502 1.00 0.00 C ATOM 1116 O GLU A 89 10.606 -0.449 3.165 1.00 0.00 O ATOM 1117 CB GLU A 89 11.349 -3.668 3.872 1.00 0.00 C ATOM 1118 CG GLU A 89 12.364 -4.406 4.730 1.00 0.00 C ATOM 1119 CD GLU A 89 13.694 -3.684 4.807 1.00 0.00 C ATOM 1120 OE1 GLU A 89 13.716 -2.526 5.274 1.00 0.00 O ATOM 1121 OE2 GLU A 89 14.717 -4.278 4.402 1.00 0.00 O ATOM 0 H GLU A 89 9.534 -3.742 5.564 1.00 0.00 H new ATOM 0 HA GLU A 89 11.615 -1.867 4.992 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.526 -4.343 3.635 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.817 -3.391 2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.963 -4.530 5.736 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.520 -5.405 4.324 1.00 0.00 H new ATOM 1128 N VAL A 90 8.965 -1.987 3.016 1.00 0.00 N ATOM 1129 CA VAL A 90 8.192 -1.242 2.031 1.00 0.00 C ATOM 1130 C VAL A 90 7.822 0.131 2.580 1.00 0.00 C ATOM 1131 O VAL A 90 8.003 1.153 1.911 1.00 0.00 O ATOM 1132 CB VAL A 90 6.913 -2.011 1.633 1.00 0.00 C ATOM 1133 CG1 VAL A 90 5.977 -1.133 0.813 1.00 0.00 C ATOM 1134 CG2 VAL A 90 7.274 -3.272 0.863 1.00 0.00 C ATOM 0 H VAL A 90 8.549 -2.877 3.290 1.00 0.00 H new ATOM 0 HA VAL A 90 8.809 -1.118 1.141 1.00 0.00 H new ATOM 0 HB VAL A 90 6.390 -2.296 2.546 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.085 -1.701 0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 90 5.690 -0.260 1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.485 -0.809 -0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 90 6.363 -3.804 0.589 1.00 0.00 H new ATOM 0 HG22 VAL A 90 7.823 -3.003 -0.040 1.00 0.00 H new ATOM 0 HG23 VAL A 90 7.895 -3.914 1.487 1.00 0.00 H new ATOM 1144 N VAL A 91 7.322 0.153 3.810 1.00 0.00 N ATOM 1145 CA VAL A 91 6.950 1.400 4.455 1.00 0.00 C ATOM 1146 C VAL A 91 8.175 2.287 4.616 1.00 0.00 C ATOM 1147 O VAL A 91 8.084 3.511 4.552 1.00 0.00 O ATOM 1148 CB VAL A 91 6.310 1.160 5.836 1.00 0.00 C ATOM 1149 CG1 VAL A 91 5.808 2.467 6.430 1.00 0.00 C ATOM 1150 CG2 VAL A 91 5.179 0.145 5.732 1.00 0.00 C ATOM 0 H VAL A 91 7.166 -0.680 4.378 1.00 0.00 H new ATOM 0 HA VAL A 91 6.214 1.891 3.819 1.00 0.00 H new ATOM 0 HB VAL A 91 7.072 0.755 6.502 1.00 0.00 H new ATOM 0 HG11 VAL A 91 5.360 2.275 7.405 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.642 3.159 6.544 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.062 2.905 5.767 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.739 -0.012 6.717 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.416 0.519 5.049 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.571 -0.800 5.355 1.00 0.00 H new ATOM 1160 N SER A 92 9.327 1.655 4.810 1.00 0.00 N ATOM 1161 CA SER A 92 10.579 2.381 4.963 1.00 0.00 C ATOM 1162 C SER A 92 10.916 3.129 3.679 1.00 0.00 C ATOM 1163 O SER A 92 11.467 4.230 3.716 1.00 0.00 O ATOM 1164 CB SER A 92 11.713 1.423 5.329 1.00 0.00 C ATOM 1165 OG SER A 92 11.979 1.453 6.721 1.00 0.00 O ATOM 0 H SER A 92 9.418 0.641 4.865 1.00 0.00 H new ATOM 0 HA SER A 92 10.462 3.104 5.770 1.00 0.00 H new ATOM 0 HB2 SER A 92 11.448 0.409 5.028 1.00 0.00 H new ATOM 0 HB3 SER A 92 12.614 1.694 4.778 1.00 0.00 H new ATOM 0 HG SER A 92 11.411 0.798 7.177 1.00 0.00 H new ATOM 1171 N LEU A 93 10.573 2.529 2.540 1.00 0.00 N ATOM 1172 CA LEU A 93 10.836 3.152 1.247 1.00 0.00 C ATOM 1173 C LEU A 93 9.979 4.399 1.078 1.00 0.00 C ATOM 1174 O LEU A 93 10.484 5.479 0.775 1.00 0.00 O ATOM 1175 CB LEU A 93 10.559 2.186 0.094 1.00 0.00 C ATOM 1176 CG LEU A 93 10.865 0.722 0.385 1.00 0.00 C ATOM 1177 CD1 LEU A 93 10.474 -0.152 -0.796 1.00 0.00 C ATOM 1178 CD2 LEU A 93 12.336 0.539 0.725 1.00 0.00 C ATOM 0 H LEU A 93 10.116 1.619 2.487 1.00 0.00 H new ATOM 0 HA LEU A 93 11.891 3.425 1.223 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.509 2.272 -0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.146 2.498 -0.769 1.00 0.00 H new ATOM 0 HG LEU A 93 10.275 0.414 1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.700 -1.194 -0.568 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.406 -0.046 -0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.034 0.157 -1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.534 -0.513 0.930 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.947 0.866 -0.116 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.582 1.132 1.605 1.00 0.00 H new ATOM 1190 N LEU A 94 8.675 4.240 1.282 1.00 0.00 N ATOM 1191 CA LEU A 94 7.746 5.355 1.158 1.00 0.00 C ATOM 1192 C LEU A 94 7.972 6.367 2.276 1.00 0.00 C ATOM 1193 O LEU A 94 7.785 7.568 2.091 1.00 0.00 O ATOM 1194 CB LEU A 94 6.299 4.854 1.168 1.00 0.00 C ATOM 1195 CG LEU A 94 5.750 4.456 2.539 1.00 0.00 C ATOM 1196 CD1 LEU A 94 5.106 5.649 3.225 1.00 0.00 C ATOM 1197 CD2 LEU A 94 4.752 3.315 2.400 1.00 0.00 C ATOM 0 H LEU A 94 8.240 3.352 1.533 1.00 0.00 H new ATOM 0 HA LEU A 94 7.930 5.851 0.205 1.00 0.00 H new ATOM 0 HB2 LEU A 94 5.660 5.633 0.752 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.226 3.994 0.503 1.00 0.00 H new ATOM 0 HG LEU A 94 6.581 4.115 3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.722 5.345 4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.848 6.437 3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.286 6.022 2.612 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.370 3.043 3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.925 3.631 1.765 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.245 2.453 1.952 1.00 0.00 H new ATOM 1209 N ARG A 95 8.388 5.874 3.438 1.00 0.00 N ATOM 1210 CA ARG A 95 8.656 6.737 4.582 1.00 0.00 C ATOM 1211 C ARG A 95 9.940 7.534 4.369 1.00 0.00 C ATOM 1212 O ARG A 95 10.080 8.651 4.867 1.00 0.00 O ATOM 1213 CB ARG A 95 8.762 5.911 5.865 1.00 0.00 C ATOM 1214 CG ARG A 95 7.415 5.586 6.489 1.00 0.00 C ATOM 1215 CD ARG A 95 7.573 5.028 7.893 1.00 0.00 C ATOM 1216 NE ARG A 95 6.288 4.898 8.578 1.00 0.00 N ATOM 1217 CZ ARG A 95 6.087 4.114 9.635 1.00 0.00 C ATOM 1218 NH1 ARG A 95 7.081 3.389 10.132 1.00 0.00 N ATOM 1219 NH2 ARG A 95 4.887 4.056 10.197 1.00 0.00 N ATOM 0 H ARG A 95 8.547 4.882 3.612 1.00 0.00 H new ATOM 0 HA ARG A 95 7.824 7.435 4.680 1.00 0.00 H new ATOM 0 HB2 ARG A 95 9.286 4.981 5.647 1.00 0.00 H new ATOM 0 HB3 ARG A 95 9.367 6.456 6.590 1.00 0.00 H new ATOM 0 HG2 ARG A 95 6.801 6.486 6.521 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.889 4.863 5.866 1.00 0.00 H new ATOM 0 HD2 ARG A 95 8.058 4.053 7.843 1.00 0.00 H new ATOM 0 HD3 ARG A 95 8.228 5.680 8.471 1.00 0.00 H new ATOM 0 HE ARG A 95 5.499 5.440 8.225 1.00 0.00 H new ATOM 0 HH11 ARG A 95 8.006 3.430 9.704 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.920 2.790 10.942 1.00 0.00 H new ATOM 0 HH21 ARG A 95 4.120 4.612 9.819 1.00 0.00 H new ATOM 0 HH22 ARG A 95 4.732 3.456 11.007 1.00 0.00 H new ATOM 1233 N SER A 96 10.880 6.944 3.631 1.00 0.00 N ATOM 1234 CA SER A 96 12.161 7.588 3.360 1.00 0.00 C ATOM 1235 C SER A 96 11.971 8.896 2.602 1.00 0.00 C ATOM 1236 O SER A 96 12.693 9.866 2.829 1.00 0.00 O ATOM 1237 CB SER A 96 13.068 6.653 2.560 1.00 0.00 C ATOM 1238 OG SER A 96 12.668 6.594 1.201 1.00 0.00 O ATOM 0 H SER A 96 10.776 6.020 3.211 1.00 0.00 H new ATOM 0 HA SER A 96 12.631 7.811 4.318 1.00 0.00 H new ATOM 0 HB2 SER A 96 14.100 6.999 2.624 1.00 0.00 H new ATOM 0 HB3 SER A 96 13.039 5.654 2.995 1.00 0.00 H new ATOM 0 HG SER A 96 12.033 5.858 1.079 1.00 0.00 H new ATOM 1244 N THR A 97 10.997 8.917 1.699 1.00 0.00 N ATOM 1245 CA THR A 97 10.715 10.109 0.906 1.00 0.00 C ATOM 1246 C THR A 97 10.566 11.334 1.803 1.00 0.00 C ATOM 1247 O THR A 97 9.858 11.299 2.808 1.00 0.00 O ATOM 1248 CB THR A 97 9.446 9.913 0.073 1.00 0.00 C ATOM 1249 OG1 THR A 97 8.896 8.627 0.286 1.00 0.00 O ATOM 1250 CG2 THR A 97 9.672 10.066 -1.413 1.00 0.00 C ATOM 0 H THR A 97 10.389 8.123 1.498 1.00 0.00 H new ATOM 0 HA THR A 97 11.556 10.272 0.232 1.00 0.00 H new ATOM 0 HB THR A 97 8.766 10.697 0.406 1.00 0.00 H new ATOM 0 HG1 THR A 97 8.419 8.613 1.142 1.00 0.00 H new ATOM 0 HG21 THR A 97 8.731 9.914 -1.942 1.00 0.00 H new ATOM 0 HG22 THR A 97 10.049 11.067 -1.623 1.00 0.00 H new ATOM 0 HG23 THR A 97 10.400 9.327 -1.748 1.00 0.00 H new ATOM 1258 N LYS A 98 11.240 12.414 1.429 1.00 0.00 N ATOM 1259 CA LYS A 98 11.185 13.653 2.197 1.00 0.00 C ATOM 1260 C LYS A 98 10.190 14.625 1.579 1.00 0.00 C ATOM 1261 O LYS A 98 9.535 14.309 0.585 1.00 0.00 O ATOM 1262 CB LYS A 98 12.571 14.302 2.267 1.00 0.00 C ATOM 1263 CG LYS A 98 13.714 13.302 2.357 1.00 0.00 C ATOM 1264 CD LYS A 98 13.761 12.629 3.719 1.00 0.00 C ATOM 1265 CE LYS A 98 14.946 11.684 3.836 1.00 0.00 C ATOM 1266 NZ LYS A 98 15.879 12.094 4.920 1.00 0.00 N ATOM 0 H LYS A 98 11.831 12.458 0.599 1.00 0.00 H new ATOM 0 HA LYS A 98 10.856 13.410 3.207 1.00 0.00 H new ATOM 0 HB2 LYS A 98 12.715 14.925 1.385 1.00 0.00 H new ATOM 0 HB3 LYS A 98 12.609 14.962 3.133 1.00 0.00 H new ATOM 0 HG2 LYS A 98 13.599 12.546 1.580 1.00 0.00 H new ATOM 0 HG3 LYS A 98 14.659 13.811 2.169 1.00 0.00 H new ATOM 0 HD2 LYS A 98 13.822 13.388 4.499 1.00 0.00 H new ATOM 0 HD3 LYS A 98 12.836 12.076 3.884 1.00 0.00 H new ATOM 0 HE2 LYS A 98 14.586 10.673 4.030 1.00 0.00 H new ATOM 0 HE3 LYS A 98 15.482 11.655 2.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 16.673 11.424 4.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 16.242 13.048 4.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 15.375 12.097 5.830 1.00 0.00 H new ATOM 1280 N MET A 99 10.081 15.813 2.166 1.00 0.00 N ATOM 1281 CA MET A 99 9.166 16.829 1.660 1.00 0.00 C ATOM 1282 C MET A 99 9.448 17.117 0.190 1.00 0.00 C ATOM 1283 O MET A 99 10.597 17.067 -0.251 1.00 0.00 O ATOM 1284 CB MET A 99 9.289 18.115 2.481 1.00 0.00 C ATOM 1285 CG MET A 99 8.324 18.181 3.654 1.00 0.00 C ATOM 1286 SD MET A 99 9.104 17.746 5.222 1.00 0.00 S ATOM 1287 CE MET A 99 8.140 16.313 5.692 1.00 0.00 C ATOM 0 H MET A 99 10.613 16.095 2.989 1.00 0.00 H new ATOM 0 HA MET A 99 8.148 16.450 1.752 1.00 0.00 H new ATOM 0 HB2 MET A 99 10.309 18.202 2.855 1.00 0.00 H new ATOM 0 HB3 MET A 99 9.115 18.971 1.829 1.00 0.00 H new ATOM 0 HG2 MET A 99 7.912 19.188 3.725 1.00 0.00 H new ATOM 0 HG3 MET A 99 7.488 17.507 3.470 1.00 0.00 H new ATOM 0 HE1 MET A 99 8.502 15.927 6.645 1.00 0.00 H new ATOM 0 HE2 MET A 99 7.092 16.596 5.790 1.00 0.00 H new ATOM 0 HE3 MET A 99 8.238 15.542 4.928 1.00 0.00 H new ATOM 1297 N GLU A 100 8.397 17.406 -0.570 1.00 0.00 N ATOM 1298 CA GLU A 100 8.544 17.687 -1.992 1.00 0.00 C ATOM 1299 C GLU A 100 9.140 16.481 -2.712 1.00 0.00 C ATOM 1300 O GLU A 100 10.350 16.404 -2.920 1.00 0.00 O ATOM 1301 CB GLU A 100 9.429 18.917 -2.207 1.00 0.00 C ATOM 1302 CG GLU A 100 8.734 20.229 -1.885 1.00 0.00 C ATOM 1303 CD GLU A 100 7.850 20.714 -3.017 1.00 0.00 C ATOM 1304 OE1 GLU A 100 6.818 20.062 -3.284 1.00 0.00 O ATOM 1305 OE2 GLU A 100 8.189 21.744 -3.636 1.00 0.00 O ATOM 0 H GLU A 100 7.438 17.452 -0.226 1.00 0.00 H new ATOM 0 HA GLU A 100 7.556 17.891 -2.406 1.00 0.00 H new ATOM 0 HB2 GLU A 100 10.321 18.826 -1.587 1.00 0.00 H new ATOM 0 HB3 GLU A 100 9.763 18.937 -3.244 1.00 0.00 H new ATOM 0 HG2 GLU A 100 8.131 20.105 -0.986 1.00 0.00 H new ATOM 0 HG3 GLU A 100 9.484 20.988 -1.664 1.00 0.00 H new ATOM 1312 N GLY A 101 8.278 15.540 -3.079 1.00 0.00 N ATOM 1313 CA GLY A 101 8.725 14.343 -3.762 1.00 0.00 C ATOM 1314 C GLY A 101 7.572 13.422 -4.092 1.00 0.00 C ATOM 1315 O GLY A 101 7.023 12.758 -3.212 1.00 0.00 O ATOM 0 H GLY A 101 7.272 15.586 -2.914 1.00 0.00 H new ATOM 0 HA2 GLY A 101 9.243 14.620 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 101 9.445 13.815 -3.137 1.00 0.00 H new ATOM 1319 N THR A 102 7.194 13.392 -5.362 1.00 0.00 N ATOM 1320 CA THR A 102 6.087 12.557 -5.808 1.00 0.00 C ATOM 1321 C THR A 102 6.459 11.079 -5.768 1.00 0.00 C ATOM 1322 O THR A 102 7.295 10.613 -6.541 1.00 0.00 O ATOM 1323 CB THR A 102 5.666 12.946 -7.227 1.00 0.00 C ATOM 1324 OG1 THR A 102 5.412 14.336 -7.312 1.00 0.00 O ATOM 1325 CG2 THR A 102 4.424 12.222 -7.701 1.00 0.00 C ATOM 0 H THR A 102 7.637 13.936 -6.102 1.00 0.00 H new ATOM 0 HA THR A 102 5.252 12.720 -5.127 1.00 0.00 H new ATOM 0 HB THR A 102 6.501 12.658 -7.865 1.00 0.00 H new ATOM 0 HG1 THR A 102 5.146 14.565 -8.227 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.180 12.543 -8.714 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.605 11.147 -7.695 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.592 12.454 -7.036 1.00 0.00 H new ATOM 1333 N VAL A 103 5.819 10.346 -4.862 1.00 0.00 N ATOM 1334 CA VAL A 103 6.067 8.919 -4.715 1.00 0.00 C ATOM 1335 C VAL A 103 5.044 8.120 -5.521 1.00 0.00 C ATOM 1336 O VAL A 103 3.853 8.127 -5.211 1.00 0.00 O ATOM 1337 CB VAL A 103 6.011 8.493 -3.230 1.00 0.00 C ATOM 1338 CG1 VAL A 103 6.033 6.977 -3.086 1.00 0.00 C ATOM 1339 CG2 VAL A 103 7.158 9.119 -2.458 1.00 0.00 C ATOM 0 H VAL A 103 5.123 10.720 -4.217 1.00 0.00 H new ATOM 0 HA VAL A 103 7.068 8.711 -5.094 1.00 0.00 H new ATOM 0 HB VAL A 103 5.070 8.852 -2.813 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.992 6.711 -2.030 1.00 0.00 H new ATOM 0 HG12 VAL A 103 5.172 6.550 -3.601 1.00 0.00 H new ATOM 0 HG13 VAL A 103 6.950 6.583 -3.524 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.105 8.810 -1.414 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.106 8.792 -2.886 1.00 0.00 H new ATOM 0 HG23 VAL A 103 7.088 10.205 -2.519 1.00 0.00 H new ATOM 1349 N SER A 104 5.518 7.440 -6.561 1.00 0.00 N ATOM 1350 CA SER A 104 4.644 6.648 -7.416 1.00 0.00 C ATOM 1351 C SER A 104 4.425 5.257 -6.835 1.00 0.00 C ATOM 1352 O SER A 104 5.365 4.477 -6.691 1.00 0.00 O ATOM 1353 CB SER A 104 5.236 6.538 -8.823 1.00 0.00 C ATOM 1354 OG SER A 104 4.216 6.379 -9.794 1.00 0.00 O ATOM 0 H SER A 104 6.502 7.422 -6.831 1.00 0.00 H new ATOM 0 HA SER A 104 3.680 7.153 -7.472 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.819 7.431 -9.046 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.921 5.691 -8.868 1.00 0.00 H new ATOM 0 HG SER A 104 4.620 6.313 -10.685 1.00 0.00 H new ATOM 1360 N LEU A 105 3.174 4.953 -6.503 1.00 0.00 N ATOM 1361 CA LEU A 105 2.830 3.657 -5.937 1.00 0.00 C ATOM 1362 C LEU A 105 1.772 2.957 -6.783 1.00 0.00 C ATOM 1363 O LEU A 105 0.645 3.437 -6.909 1.00 0.00 O ATOM 1364 CB LEU A 105 2.322 3.825 -4.502 1.00 0.00 C ATOM 1365 CG LEU A 105 3.107 4.831 -3.653 1.00 0.00 C ATOM 1366 CD1 LEU A 105 2.258 6.058 -3.354 1.00 0.00 C ATOM 1367 CD2 LEU A 105 3.583 4.184 -2.360 1.00 0.00 C ATOM 0 H LEU A 105 2.383 5.587 -6.617 1.00 0.00 H new ATOM 0 HA LEU A 105 3.729 3.041 -5.929 1.00 0.00 H new ATOM 0 HB2 LEU A 105 1.278 4.137 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.349 2.854 -4.007 1.00 0.00 H new ATOM 0 HG LEU A 105 3.981 5.149 -4.221 1.00 0.00 H new ATOM 0 HD11 LEU A 105 2.833 6.760 -2.750 1.00 0.00 H new ATOM 0 HD12 LEU A 105 1.968 6.537 -4.289 1.00 0.00 H new ATOM 0 HD13 LEU A 105 1.364 5.757 -2.808 1.00 0.00 H new ATOM 0 HD21 LEU A 105 4.138 4.914 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.722 3.836 -1.789 1.00 0.00 H new ATOM 0 HD23 LEU A 105 4.230 3.338 -2.593 1.00 0.00 H new ATOM 1379 N LEU A 106 2.141 1.818 -7.357 1.00 0.00 N ATOM 1380 CA LEU A 106 1.221 1.048 -8.185 1.00 0.00 C ATOM 1381 C LEU A 106 0.392 0.107 -7.320 1.00 0.00 C ATOM 1382 O LEU A 106 0.912 -0.858 -6.764 1.00 0.00 O ATOM 1383 CB LEU A 106 1.993 0.250 -9.237 1.00 0.00 C ATOM 1384 CG LEU A 106 1.128 -0.593 -10.176 1.00 0.00 C ATOM 1385 CD1 LEU A 106 0.835 0.170 -11.459 1.00 0.00 C ATOM 1386 CD2 LEU A 106 1.809 -1.920 -10.485 1.00 0.00 C ATOM 0 H LEU A 106 3.070 1.408 -7.264 1.00 0.00 H new ATOM 0 HA LEU A 106 0.550 1.741 -8.693 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.583 0.944 -9.836 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.696 -0.408 -8.727 1.00 0.00 H new ATOM 0 HG LEU A 106 0.182 -0.802 -9.677 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.219 -0.445 -12.115 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.304 1.092 -11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.772 0.410 -11.961 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.178 -2.505 -11.154 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.770 -1.733 -10.963 1.00 0.00 H new ATOM 0 HD23 LEU A 106 1.966 -2.473 -9.559 1.00 0.00 H new ATOM 1398 N VAL A 107 -0.899 0.397 -7.206 1.00 0.00 N ATOM 1399 CA VAL A 107 -1.796 -0.423 -6.401 1.00 0.00 C ATOM 1400 C VAL A 107 -2.689 -1.291 -7.281 1.00 0.00 C ATOM 1401 O VAL A 107 -2.719 -1.130 -8.500 1.00 0.00 O ATOM 1402 CB VAL A 107 -2.683 0.451 -5.487 1.00 0.00 C ATOM 1403 CG1 VAL A 107 -1.829 1.423 -4.690 1.00 0.00 C ATOM 1404 CG2 VAL A 107 -3.732 1.199 -6.301 1.00 0.00 C ATOM 0 H VAL A 107 -1.347 1.193 -7.660 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.170 -1.066 -5.783 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.203 -0.205 -4.789 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -2.470 2.031 -4.051 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -1.124 0.866 -4.072 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -1.280 2.070 -5.374 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.344 1.807 -5.635 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.237 1.843 -7.028 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.366 0.483 -6.823 1.00 0.00 H new ATOM 1414 N PHE A 108 -3.422 -2.203 -6.654 1.00 0.00 N ATOM 1415 CA PHE A 108 -4.324 -3.084 -7.382 1.00 0.00 C ATOM 1416 C PHE A 108 -5.740 -2.980 -6.825 1.00 0.00 C ATOM 1417 O PHE A 108 -5.988 -3.318 -5.668 1.00 0.00 O ATOM 1418 CB PHE A 108 -3.840 -4.532 -7.312 1.00 0.00 C ATOM 1419 CG PHE A 108 -4.640 -5.472 -8.171 1.00 0.00 C ATOM 1420 CD1 PHE A 108 -5.889 -5.911 -7.762 1.00 0.00 C ATOM 1421 CD2 PHE A 108 -4.145 -5.914 -9.388 1.00 0.00 C ATOM 1422 CE1 PHE A 108 -6.629 -6.772 -8.548 1.00 0.00 C ATOM 1423 CE2 PHE A 108 -4.880 -6.776 -10.178 1.00 0.00 C ATOM 1424 CZ PHE A 108 -6.124 -7.205 -9.759 1.00 0.00 C ATOM 0 H PHE A 108 -3.409 -2.351 -5.645 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.333 -2.770 -8.426 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.795 -4.573 -7.618 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.883 -4.872 -6.277 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -6.289 -5.575 -6.816 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.174 -5.581 -9.722 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -7.601 -7.106 -8.217 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -4.482 -7.114 -11.123 1.00 0.00 H new ATOM 0 HZ PHE A 108 -6.701 -7.877 -10.377 1.00 0.00 H new ATOM 1434 N ARG A 109 -6.661 -2.505 -7.657 1.00 0.00 N ATOM 1435 CA ARG A 109 -8.051 -2.352 -7.247 1.00 0.00 C ATOM 1436 C ARG A 109 -8.894 -3.535 -7.710 1.00 0.00 C ATOM 1437 O ARG A 109 -8.662 -4.094 -8.781 1.00 0.00 O ATOM 1438 CB ARG A 109 -8.625 -1.051 -7.809 1.00 0.00 C ATOM 1439 CG ARG A 109 -9.781 -0.497 -6.994 1.00 0.00 C ATOM 1440 CD ARG A 109 -9.314 0.570 -6.017 1.00 0.00 C ATOM 1441 NE ARG A 109 -8.846 1.773 -6.702 1.00 0.00 N ATOM 1442 CZ ARG A 109 -9.655 2.689 -7.228 1.00 0.00 C ATOM 1443 NH1 ARG A 109 -10.972 2.545 -7.148 1.00 0.00 N ATOM 1444 NH2 ARG A 109 -9.147 3.753 -7.834 1.00 0.00 N ATOM 0 H ARG A 109 -6.470 -2.220 -8.618 1.00 0.00 H new ATOM 0 HA ARG A 109 -8.080 -2.318 -6.158 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -7.833 -0.304 -7.856 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.961 -1.223 -8.831 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -10.530 -0.075 -7.664 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -10.263 -1.307 -6.447 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -10.133 0.830 -5.346 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -8.511 0.169 -5.399 1.00 0.00 H new ATOM 0 HE ARG A 109 -7.840 1.919 -6.782 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -11.368 1.729 -6.682 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.588 3.250 -7.553 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -8.136 3.870 -7.897 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -9.767 4.455 -8.237 1.00 0.00 H new