USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1020 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 102 HIS : no HD1:sc= -1.03 K(o=-1.5,f=-2.3) USER MOD Set 1.2: A 126 GLN : amide:sc= -0.498 K(o=-1.5,f=-3.7) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.249 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -1.73 K(o=-1.7,f=-4.8!) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0446) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0182) USER MOD Single : A 33 HIS :FLIP no HD1:sc= -1.13 F(o=-2.3,f=-1.1) USER MOD Single : A 35 ASN : amide:sc= -9.25! C(o=-9.2!,f=-14!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -5.77! C(o=-5.8!,f=-10!) USER MOD Single : A 49 GLN : amide:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.206 K(o=-0.21,f=-1.3!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 58 THR OG1 : rot 32:sc= 0.657 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot -151:sc= -0.319 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 CYS SG : rot -176:sc= -8.53! USER MOD Single : A 84 ASN : amide:sc= 0.0609 X(o=0.061,f=0) USER MOD Single : A 89 ASN : amide:sc= 0.705 K(o=0.71,f=-0.78) USER MOD Single : A 90 ASN : amide:sc= -1.88 X(o=-1.9,f=-1.5) USER MOD Single : A 91 THR OG1 : rot -160:sc= -1.86 USER MOD Single : A 94 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0746) USER MOD Single : A 106 HIS : no HD1:sc= -0.378 X(o=-0.38,f=-0.015) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= -0.0164 (180deg=-0.0164) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 30:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN :FLIP amide:sc= -0.147 F(o=-1.2,f=-0.15) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N ILE A 2 1.019 -1.768 12.477 1.00 0.00 N ATOM 19 CA ILE A 2 1.392 -2.326 11.188 1.00 0.00 C ATOM 20 C ILE A 2 2.891 -2.632 11.185 1.00 0.00 C ATOM 21 O ILE A 2 3.648 -2.054 11.963 1.00 0.00 O ATOM 22 CB ILE A 2 0.952 -1.397 10.054 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.573 -1.371 9.928 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.630 -1.780 8.737 1.00 0.00 C ATOM 25 CD1 ILE A 2 -1.179 -0.293 10.828 1.00 0.00 C ATOM 0 HA ILE A 2 0.873 -3.269 11.016 1.00 0.00 H new ATOM 0 HB ILE A 2 1.272 -0.384 10.298 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -0.853 -1.184 8.891 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.980 -2.346 10.197 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.300 -1.104 7.948 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.712 -1.706 8.850 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.362 -2.803 8.474 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.264 -0.296 10.719 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.918 -0.497 11.866 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -0.788 0.683 10.540 1.00 0.00 H new ATOM 37 N ARG A 3 3.276 -3.540 10.299 1.00 0.00 N ATOM 38 CA ARG A 3 4.671 -3.929 10.185 1.00 0.00 C ATOM 39 C ARG A 3 5.276 -3.362 8.899 1.00 0.00 C ATOM 40 O ARG A 3 4.673 -3.454 7.831 1.00 0.00 O ATOM 41 CB ARG A 3 4.819 -5.452 10.181 1.00 0.00 C ATOM 42 CG ARG A 3 5.607 -5.929 11.402 1.00 0.00 C ATOM 43 CD ARG A 3 5.167 -7.332 11.826 1.00 0.00 C ATOM 44 NE ARG A 3 6.321 -8.083 12.368 1.00 0.00 N ATOM 45 CZ ARG A 3 6.414 -9.429 12.372 1.00 0.00 C ATOM 46 NH1 ARG A 3 5.420 -10.186 11.860 1.00 0.00 N ATOM 47 NH2 ARG A 3 7.492 -9.995 12.883 1.00 0.00 N ATOM 0 H ARG A 3 2.646 -4.017 9.654 1.00 0.00 H new ATOM 0 HA ARG A 3 5.200 -3.526 11.049 1.00 0.00 H new ATOM 0 HB2 ARG A 3 3.833 -5.917 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 3 5.326 -5.769 9.270 1.00 0.00 H new ATOM 0 HG2 ARG A 3 6.673 -5.932 11.173 1.00 0.00 H new ATOM 0 HG3 ARG A 3 5.461 -5.233 12.228 1.00 0.00 H new ATOM 0 HD2 ARG A 3 4.381 -7.264 12.579 1.00 0.00 H new ATOM 0 HD3 ARG A 3 4.746 -7.863 10.973 1.00 0.00 H new ATOM 0 HE ARG A 3 7.095 -7.549 12.764 1.00 0.00 H new ATOM 0 HH11 ARG A 3 4.591 -9.741 11.466 1.00 0.00 H new ATOM 0 HH12 ARG A 3 5.498 -11.203 11.867 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.239 -9.416 13.267 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.578 -11.011 12.894 1.00 0.00 H new ATOM 60 N ILE A 4 6.462 -2.788 9.044 1.00 0.00 N ATOM 61 CA ILE A 4 7.155 -2.205 7.908 1.00 0.00 C ATOM 62 C ILE A 4 8.589 -2.738 7.864 1.00 0.00 C ATOM 63 O ILE A 4 9.388 -2.455 8.755 1.00 0.00 O ATOM 64 CB ILE A 4 7.068 -0.678 7.952 1.00 0.00 C ATOM 65 CG1 ILE A 4 6.170 -0.213 9.101 1.00 0.00 C ATOM 66 CG2 ILE A 4 6.611 -0.116 6.604 1.00 0.00 C ATOM 67 CD1 ILE A 4 6.025 1.310 9.101 1.00 0.00 C ATOM 0 H ILE A 4 6.960 -2.714 9.931 1.00 0.00 H new ATOM 0 HA ILE A 4 6.674 -2.501 6.976 1.00 0.00 H new ATOM 0 HB ILE A 4 8.066 -0.284 8.144 1.00 0.00 H new ATOM 0 HG12 ILE A 4 5.187 -0.676 9.009 1.00 0.00 H new ATOM 0 HG13 ILE A 4 6.590 -0.542 10.052 1.00 0.00 H new ATOM 0 HG21 ILE A 4 6.557 0.971 6.662 1.00 0.00 H new ATOM 0 HG22 ILE A 4 7.323 -0.403 5.830 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.627 -0.515 6.358 1.00 0.00 H new ATOM 0 HD11 ILE A 4 5.382 1.614 9.927 1.00 0.00 H new ATOM 0 HD12 ILE A 4 7.007 1.769 9.217 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.582 1.633 8.159 1.00 0.00 H new ATOM 79 N LEU A 5 8.871 -3.500 6.817 1.00 0.00 N ATOM 80 CA LEU A 5 10.194 -4.074 6.645 1.00 0.00 C ATOM 81 C LEU A 5 10.883 -3.410 5.451 1.00 0.00 C ATOM 82 O LEU A 5 10.226 -2.785 4.620 1.00 0.00 O ATOM 83 CB LEU A 5 10.107 -5.598 6.535 1.00 0.00 C ATOM 84 CG LEU A 5 9.182 -6.139 5.443 1.00 0.00 C ATOM 85 CD1 LEU A 5 9.679 -7.490 4.924 1.00 0.00 C ATOM 86 CD2 LEU A 5 7.735 -6.212 5.936 1.00 0.00 C ATOM 0 H LEU A 5 8.206 -3.733 6.080 1.00 0.00 H new ATOM 0 HA LEU A 5 10.812 -3.875 7.521 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.110 -5.988 6.360 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.774 -5.993 7.495 1.00 0.00 H new ATOM 0 HG LEU A 5 9.201 -5.444 4.604 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.004 -7.853 4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.680 -7.374 4.508 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.708 -8.207 5.745 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.099 -6.600 5.140 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.678 -6.873 6.801 1.00 0.00 H new ATOM 0 HD23 LEU A 5 7.396 -5.215 6.218 1.00 0.00 H new ATOM 98 N GLY A 6 12.197 -3.569 5.403 1.00 0.00 N ATOM 99 CA GLY A 6 12.982 -2.992 4.324 1.00 0.00 C ATOM 100 C GLY A 6 13.240 -1.504 4.569 1.00 0.00 C ATOM 101 O GLY A 6 13.314 -1.063 5.715 1.00 0.00 O ATOM 0 H GLY A 6 12.738 -4.089 6.094 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.932 -3.520 4.238 1.00 0.00 H new ATOM 0 HA3 GLY A 6 12.457 -3.123 3.378 1.00 0.00 H new ATOM 105 N GLU A 7 13.370 -0.771 3.473 1.00 0.00 N ATOM 106 CA GLU A 7 13.619 0.658 3.554 1.00 0.00 C ATOM 107 C GLU A 7 13.300 1.329 2.217 1.00 0.00 C ATOM 108 O GLU A 7 13.453 0.719 1.160 1.00 0.00 O ATOM 109 CB GLU A 7 15.061 0.941 3.979 1.00 0.00 C ATOM 110 CG GLU A 7 16.024 -0.071 3.357 1.00 0.00 C ATOM 111 CD GLU A 7 16.633 -0.979 4.427 1.00 0.00 C ATOM 112 OE1 GLU A 7 16.827 -0.545 5.572 1.00 0.00 O ATOM 113 OE2 GLU A 7 16.907 -2.177 4.034 1.00 0.00 O ATOM 0 H GLU A 7 13.308 -1.140 2.524 1.00 0.00 H new ATOM 0 HA GLU A 7 12.962 1.078 4.315 1.00 0.00 H new ATOM 0 HB2 GLU A 7 15.342 1.950 3.676 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.138 0.902 5.066 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.495 -0.676 2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.818 0.455 2.827 1.00 0.00 H new ATOM 121 N GLY A 8 12.863 2.577 2.306 1.00 0.00 N ATOM 122 CA GLY A 8 12.522 3.337 1.116 1.00 0.00 C ATOM 123 C GLY A 8 11.304 4.229 1.366 1.00 0.00 C ATOM 124 O GLY A 8 10.413 3.869 2.133 1.00 0.00 O ATOM 0 H GLY A 8 12.737 3.080 3.184 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.371 3.951 0.816 1.00 0.00 H new ATOM 0 HA3 GLY A 8 12.315 2.655 0.291 1.00 0.00 H new ATOM 128 N LYS A 9 11.305 5.377 0.703 1.00 0.00 N ATOM 129 CA LYS A 9 10.211 6.323 0.843 1.00 0.00 C ATOM 130 C LYS A 9 8.886 5.560 0.903 1.00 0.00 C ATOM 131 O LYS A 9 8.396 5.079 -0.117 1.00 0.00 O ATOM 132 CB LYS A 9 10.266 7.374 -0.267 1.00 0.00 C ATOM 133 CG LYS A 9 9.899 8.759 0.270 1.00 0.00 C ATOM 134 CD LYS A 9 10.576 9.861 -0.548 1.00 0.00 C ATOM 135 CE LYS A 9 9.575 10.952 -0.932 1.00 0.00 C ATOM 136 NZ LYS A 9 8.704 10.490 -2.036 1.00 0.00 N ATOM 0 H LYS A 9 12.046 5.673 0.068 1.00 0.00 H new ATOM 0 HA LYS A 9 10.303 6.876 1.778 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.267 7.401 -0.698 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.581 7.098 -1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.817 8.890 0.239 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.200 8.839 1.315 1.00 0.00 H new ATOM 0 HD2 LYS A 9 11.392 10.297 0.028 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.016 9.432 -1.449 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.967 11.217 -0.067 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.108 11.853 -1.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 8.030 11.242 -2.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.288 10.260 -2.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.181 9.643 -1.735 1.00 0.00 H new ATOM 149 N GLY A 10 8.345 5.472 2.109 1.00 0.00 N ATOM 150 CA GLY A 10 7.086 4.775 2.316 1.00 0.00 C ATOM 151 C GLY A 10 6.907 4.391 3.786 1.00 0.00 C ATOM 152 O GLY A 10 5.790 4.396 4.301 1.00 0.00 O ATOM 0 H GLY A 10 8.755 5.872 2.953 1.00 0.00 H new ATOM 0 HA2 GLY A 10 6.259 5.410 1.999 1.00 0.00 H new ATOM 0 HA3 GLY A 10 7.056 3.879 1.696 1.00 0.00 H new ATOM 156 N SER A 11 8.024 4.067 4.420 1.00 0.00 N ATOM 157 CA SER A 11 8.005 3.680 5.820 1.00 0.00 C ATOM 158 C SER A 11 7.340 4.776 6.656 1.00 0.00 C ATOM 159 O SER A 11 6.411 4.505 7.415 1.00 0.00 O ATOM 160 CB SER A 11 9.419 3.404 6.335 1.00 0.00 C ATOM 161 OG SER A 11 10.222 4.581 6.347 1.00 0.00 O ATOM 0 H SER A 11 8.949 4.065 3.990 1.00 0.00 H new ATOM 0 HA SER A 11 7.428 2.760 5.913 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.364 2.992 7.343 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.892 2.649 5.708 1.00 0.00 H new ATOM 0 HG SER A 11 11.116 4.363 6.684 1.00 0.00 H new ATOM 167 N LYS A 12 7.843 5.990 6.489 1.00 0.00 N ATOM 168 CA LYS A 12 7.309 7.128 7.218 1.00 0.00 C ATOM 169 C LYS A 12 5.936 7.494 6.651 1.00 0.00 C ATOM 170 O LYS A 12 5.002 7.764 7.404 1.00 0.00 O ATOM 171 CB LYS A 12 8.308 8.288 7.207 1.00 0.00 C ATOM 172 CG LYS A 12 8.985 8.415 5.841 1.00 0.00 C ATOM 173 CD LYS A 12 9.420 9.858 5.577 1.00 0.00 C ATOM 174 CE LYS A 12 10.532 9.912 4.528 1.00 0.00 C ATOM 175 NZ LYS A 12 11.598 10.848 4.950 1.00 0.00 N ATOM 0 H LYS A 12 8.615 6.211 5.860 1.00 0.00 H new ATOM 0 HA LYS A 12 7.163 6.873 8.268 1.00 0.00 H new ATOM 0 HB2 LYS A 12 7.794 9.218 7.450 1.00 0.00 H new ATOM 0 HB3 LYS A 12 9.063 8.130 7.978 1.00 0.00 H new ATOM 0 HG2 LYS A 12 9.852 7.756 5.798 1.00 0.00 H new ATOM 0 HG3 LYS A 12 8.299 8.089 5.059 1.00 0.00 H new ATOM 0 HD2 LYS A 12 8.565 10.443 5.237 1.00 0.00 H new ATOM 0 HD3 LYS A 12 9.768 10.312 6.505 1.00 0.00 H new ATOM 0 HE2 LYS A 12 10.951 8.916 4.382 1.00 0.00 H new ATOM 0 HE3 LYS A 12 10.121 10.228 3.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.345 10.873 4.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 11.197 11.801 5.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 12.002 10.529 5.854 1.00 0.00 H new ATOM 188 N LEU A 13 5.857 7.491 5.329 1.00 0.00 N ATOM 189 CA LEU A 13 4.614 7.819 4.652 1.00 0.00 C ATOM 190 C LEU A 13 3.479 6.982 5.246 1.00 0.00 C ATOM 191 O LEU A 13 2.350 7.454 5.362 1.00 0.00 O ATOM 192 CB LEU A 13 4.769 7.658 3.139 1.00 0.00 C ATOM 193 CG LEU A 13 3.792 6.694 2.463 1.00 0.00 C ATOM 194 CD1 LEU A 13 2.347 7.164 2.640 1.00 0.00 C ATOM 195 CD2 LEU A 13 4.153 6.492 0.990 1.00 0.00 C ATOM 0 H LEU A 13 6.634 7.266 4.708 1.00 0.00 H new ATOM 0 HA LEU A 13 4.357 8.866 4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.659 8.639 2.676 1.00 0.00 H new ATOM 0 HB3 LEU A 13 5.784 7.320 2.932 1.00 0.00 H new ATOM 0 HG LEU A 13 3.876 5.723 2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.673 6.461 2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.109 7.215 3.702 1.00 0.00 H new ATOM 0 HD13 LEU A 13 2.228 8.151 2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 13 3.443 5.803 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 13 4.114 7.450 0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.159 6.079 0.915 1.00 0.00 H new ATOM 207 N LEU A 14 3.819 5.753 5.607 1.00 0.00 N ATOM 208 CA LEU A 14 2.843 4.846 6.186 1.00 0.00 C ATOM 209 C LEU A 14 2.532 5.285 7.618 1.00 0.00 C ATOM 210 O LEU A 14 1.369 5.465 7.977 1.00 0.00 O ATOM 211 CB LEU A 14 3.326 3.398 6.077 1.00 0.00 C ATOM 212 CG LEU A 14 2.237 2.324 6.091 1.00 0.00 C ATOM 213 CD1 LEU A 14 1.023 2.785 6.900 1.00 0.00 C ATOM 214 CD2 LEU A 14 1.855 1.913 4.668 1.00 0.00 C ATOM 0 H LEU A 14 4.757 5.364 5.510 1.00 0.00 H new ATOM 0 HA LEU A 14 1.907 4.888 5.629 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.898 3.295 5.155 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.012 3.202 6.901 1.00 0.00 H new ATOM 0 HG LEU A 14 2.636 1.439 6.586 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.264 2.003 6.894 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.326 2.989 7.927 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.613 3.692 6.456 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.079 1.148 4.706 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.482 2.782 4.126 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.732 1.515 4.156 1.00 0.00 H new ATOM 226 N GLU A 15 3.591 5.443 8.397 1.00 0.00 N ATOM 227 CA GLU A 15 3.446 5.858 9.783 1.00 0.00 C ATOM 228 C GLU A 15 2.584 7.119 9.872 1.00 0.00 C ATOM 229 O GLU A 15 2.030 7.423 10.927 1.00 0.00 O ATOM 230 CB GLU A 15 4.812 6.080 10.435 1.00 0.00 C ATOM 231 CG GLU A 15 5.553 4.755 10.620 1.00 0.00 C ATOM 232 CD GLU A 15 6.484 4.813 11.833 1.00 0.00 C ATOM 233 OE1 GLU A 15 6.083 4.426 12.941 1.00 0.00 O ATOM 234 OE2 GLU A 15 7.663 5.278 11.595 1.00 0.00 O ATOM 0 H GLU A 15 4.554 5.291 8.096 1.00 0.00 H new ATOM 0 HA GLU A 15 2.945 5.060 10.330 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.409 6.751 9.818 1.00 0.00 H new ATOM 0 HB3 GLU A 15 4.683 6.567 11.402 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.833 3.946 10.748 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.131 4.529 9.724 1.00 0.00 H new ATOM 242 N ASN A 16 2.498 7.818 8.750 1.00 0.00 N ATOM 243 CA ASN A 16 1.712 9.039 8.688 1.00 0.00 C ATOM 244 C ASN A 16 0.225 8.683 8.662 1.00 0.00 C ATOM 245 O ASN A 16 -0.565 9.241 9.423 1.00 0.00 O ATOM 246 CB ASN A 16 2.030 9.835 7.421 1.00 0.00 C ATOM 247 CG ASN A 16 3.500 10.262 7.395 1.00 0.00 C ATOM 248 OD1 ASN A 16 4.289 9.912 8.257 1.00 0.00 O ATOM 249 ND2 ASN A 16 3.821 11.035 6.362 1.00 0.00 N ATOM 0 H ASN A 16 2.959 7.563 7.877 1.00 0.00 H new ATOM 0 HA ASN A 16 1.956 9.641 9.563 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.808 9.230 6.542 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.391 10.716 7.371 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.778 11.373 6.255 1.00 0.00 H new ATOM 0 HD22 ASN A 16 3.111 11.290 5.676 1.00 0.00 H new ATOM 256 N LEU A 17 -0.114 7.756 7.777 1.00 0.00 N ATOM 257 CA LEU A 17 -1.493 7.319 7.642 1.00 0.00 C ATOM 258 C LEU A 17 -1.624 5.889 8.170 1.00 0.00 C ATOM 259 O LEU A 17 -2.346 5.075 7.596 1.00 0.00 O ATOM 260 CB LEU A 17 -1.968 7.487 6.197 1.00 0.00 C ATOM 261 CG LEU A 17 -0.914 7.254 5.113 1.00 0.00 C ATOM 262 CD1 LEU A 17 -0.346 5.837 5.196 1.00 0.00 C ATOM 263 CD2 LEU A 17 -1.478 7.565 3.725 1.00 0.00 C ATOM 0 H LEU A 17 0.543 7.296 7.147 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.152 7.943 8.245 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.795 6.799 6.025 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.363 8.496 6.080 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.087 7.943 5.287 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.401 5.698 4.414 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.117 5.687 6.171 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.151 5.114 5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.709 7.391 2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -2.333 6.918 3.526 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.795 8.607 3.686 1.00 0.00 H new ATOM 275 N LYS A 18 -0.915 5.627 9.259 1.00 0.00 N ATOM 276 CA LYS A 18 -0.944 4.310 9.871 1.00 0.00 C ATOM 277 C LYS A 18 -2.307 4.087 10.528 1.00 0.00 C ATOM 278 O LYS A 18 -2.968 3.083 10.270 1.00 0.00 O ATOM 279 CB LYS A 18 0.236 4.139 10.830 1.00 0.00 C ATOM 280 CG LYS A 18 1.061 2.902 10.469 1.00 0.00 C ATOM 281 CD LYS A 18 1.678 2.271 11.719 1.00 0.00 C ATOM 282 CE LYS A 18 3.204 2.373 11.689 1.00 0.00 C ATOM 283 NZ LYS A 18 3.813 1.258 12.447 1.00 0.00 N ATOM 0 H LYS A 18 -0.317 6.305 9.733 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.825 3.535 9.113 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.869 5.026 10.795 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.132 4.050 11.852 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.428 2.173 9.964 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.850 3.178 9.769 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.294 2.769 12.609 1.00 0.00 H new ATOM 0 HD3 LYS A 18 1.381 1.224 11.787 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.555 2.354 10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.519 3.325 12.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.849 1.343 12.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.492 1.294 13.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.527 0.353 12.023 1.00 0.00 H new ATOM 296 N GLU A 19 -2.688 5.041 11.365 1.00 0.00 N ATOM 297 CA GLU A 19 -3.961 4.962 12.062 1.00 0.00 C ATOM 298 C GLU A 19 -5.114 4.930 11.057 1.00 0.00 C ATOM 299 O GLU A 19 -6.191 4.416 11.359 1.00 0.00 O ATOM 300 CB GLU A 19 -4.122 6.124 13.044 1.00 0.00 C ATOM 301 CG GLU A 19 -4.186 7.462 12.305 1.00 0.00 C ATOM 302 CD GLU A 19 -3.122 8.429 12.829 1.00 0.00 C ATOM 303 OE1 GLU A 19 -1.999 8.459 12.303 1.00 0.00 O ATOM 304 OE2 GLU A 19 -3.495 9.167 13.819 1.00 0.00 O ATOM 0 H GLU A 19 -2.137 5.873 11.576 1.00 0.00 H new ATOM 0 HA GLU A 19 -3.981 4.037 12.639 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -5.030 5.985 13.631 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -3.287 6.131 13.745 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -4.040 7.299 11.237 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -5.175 7.903 12.428 1.00 0.00 H new ATOM 312 N LYS A 20 -4.850 5.485 9.884 1.00 0.00 N ATOM 313 CA LYS A 20 -5.853 5.526 8.833 1.00 0.00 C ATOM 314 C LYS A 20 -6.180 4.099 8.389 1.00 0.00 C ATOM 315 O LYS A 20 -7.341 3.770 8.150 1.00 0.00 O ATOM 316 CB LYS A 20 -5.395 6.435 7.691 1.00 0.00 C ATOM 317 CG LYS A 20 -6.442 7.511 7.392 1.00 0.00 C ATOM 318 CD LYS A 20 -6.488 8.556 8.509 1.00 0.00 C ATOM 319 CE LYS A 20 -7.921 8.774 8.997 1.00 0.00 C ATOM 320 NZ LYS A 20 -8.759 9.331 7.912 1.00 0.00 N ATOM 0 H LYS A 20 -3.956 5.910 9.638 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.779 5.964 9.207 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.448 6.907 7.955 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.216 5.839 6.796 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.209 7.996 6.444 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.423 7.048 7.281 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.862 8.232 9.341 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.076 9.498 8.148 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.342 7.829 9.341 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.922 9.453 9.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.663 9.662 8.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.264 10.129 7.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.940 8.594 7.201 1.00 0.00 H new ATOM 333 N LEU A 21 -5.136 3.289 8.293 1.00 0.00 N ATOM 334 CA LEU A 21 -5.297 1.905 7.883 1.00 0.00 C ATOM 335 C LEU A 21 -5.782 1.077 9.074 1.00 0.00 C ATOM 336 O LEU A 21 -6.459 0.066 8.898 1.00 0.00 O ATOM 337 CB LEU A 21 -4.006 1.379 7.253 1.00 0.00 C ATOM 338 CG LEU A 21 -3.358 2.278 6.199 1.00 0.00 C ATOM 339 CD1 LEU A 21 -1.833 2.253 6.318 1.00 0.00 C ATOM 340 CD2 LEU A 21 -3.830 1.901 4.793 1.00 0.00 C ATOM 0 H LEU A 21 -4.175 3.565 8.492 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.059 1.824 7.108 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.282 1.206 8.049 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.216 0.412 6.797 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.677 3.304 6.382 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.398 2.901 5.557 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.539 2.607 7.306 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.474 1.234 6.176 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.355 2.555 4.062 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.560 0.866 4.584 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.912 2.013 4.730 1.00 0.00 H new ATOM 352 N GLU A 22 -5.418 1.538 10.262 1.00 0.00 N ATOM 353 CA GLU A 22 -5.807 0.853 11.483 1.00 0.00 C ATOM 354 C GLU A 22 -7.330 0.864 11.634 1.00 0.00 C ATOM 355 O GLU A 22 -7.885 0.088 12.410 1.00 0.00 O ATOM 356 CB GLU A 22 -5.130 1.480 12.703 1.00 0.00 C ATOM 357 CG GLU A 22 -3.636 1.151 12.731 1.00 0.00 C ATOM 358 CD GLU A 22 -3.160 0.883 14.160 1.00 0.00 C ATOM 359 OE1 GLU A 22 -2.018 1.220 14.506 1.00 0.00 O ATOM 360 OE2 GLU A 22 -4.024 0.302 14.922 1.00 0.00 O ATOM 0 H GLU A 22 -4.857 2.378 10.405 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.475 -0.183 11.418 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.268 2.561 12.684 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.604 1.114 13.614 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.441 0.277 12.109 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.070 1.979 12.305 1.00 0.00 H new ATOM 368 N GLU A 23 -7.961 1.752 10.881 1.00 0.00 N ATOM 369 CA GLU A 23 -9.409 1.874 10.922 1.00 0.00 C ATOM 370 C GLU A 23 -10.058 0.771 10.084 1.00 0.00 C ATOM 371 O GLU A 23 -10.905 0.028 10.579 1.00 0.00 O ATOM 372 CB GLU A 23 -9.856 3.258 10.448 1.00 0.00 C ATOM 373 CG GLU A 23 -8.859 4.335 10.880 1.00 0.00 C ATOM 374 CD GLU A 23 -9.576 5.646 11.209 1.00 0.00 C ATOM 375 OE1 GLU A 23 -9.777 6.483 10.317 1.00 0.00 O ATOM 376 OE2 GLU A 23 -9.930 5.779 12.443 1.00 0.00 O ATOM 0 H GLU A 23 -7.497 2.394 10.239 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.735 1.758 11.956 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.952 3.261 9.362 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.841 3.485 10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -8.303 3.992 11.752 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.133 4.503 10.085 1.00 0.00 H new ATOM 384 N ILE A 24 -9.637 0.699 8.830 1.00 0.00 N ATOM 385 CA ILE A 24 -10.167 -0.301 7.919 1.00 0.00 C ATOM 386 C ILE A 24 -10.061 -1.683 8.568 1.00 0.00 C ATOM 387 O ILE A 24 -11.024 -2.448 8.569 1.00 0.00 O ATOM 388 CB ILE A 24 -9.476 -0.206 6.558 1.00 0.00 C ATOM 389 CG1 ILE A 24 -7.954 -0.193 6.715 1.00 0.00 C ATOM 390 CG2 ILE A 24 -9.981 1.004 5.770 1.00 0.00 C ATOM 391 CD1 ILE A 24 -7.261 -0.246 5.352 1.00 0.00 C ATOM 0 H ILE A 24 -8.935 1.317 8.423 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.224 -0.119 7.727 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.733 -1.095 5.982 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -7.648 0.707 7.248 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.640 -1.044 7.320 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.474 1.048 4.806 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.055 0.912 5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.774 1.915 6.331 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.180 -0.236 5.493 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.550 -1.159 4.832 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.558 0.619 4.759 1.00 0.00 H new ATOM 403 N VAL A 25 -8.881 -1.961 9.103 1.00 0.00 N ATOM 404 CA VAL A 25 -8.637 -3.237 9.753 1.00 0.00 C ATOM 405 C VAL A 25 -9.561 -3.373 10.964 1.00 0.00 C ATOM 406 O VAL A 25 -9.998 -4.474 11.296 1.00 0.00 O ATOM 407 CB VAL A 25 -7.156 -3.365 10.114 1.00 0.00 C ATOM 408 CG1 VAL A 25 -6.321 -3.732 8.885 1.00 0.00 C ATOM 409 CG2 VAL A 25 -6.637 -2.082 10.766 1.00 0.00 C ATOM 0 H VAL A 25 -8.084 -1.324 9.099 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.866 -4.060 9.076 1.00 0.00 H new ATOM 0 HB VAL A 25 -7.057 -4.173 10.839 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.272 -3.817 9.170 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.666 -4.684 8.482 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.430 -2.957 8.127 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.582 -2.200 11.013 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.757 -1.248 10.074 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -7.202 -1.882 11.676 1.00 0.00 H new ATOM 419 N LYS A 26 -9.832 -2.238 11.592 1.00 0.00 N ATOM 420 CA LYS A 26 -10.697 -2.217 12.760 1.00 0.00 C ATOM 421 C LYS A 26 -12.055 -2.820 12.394 1.00 0.00 C ATOM 422 O LYS A 26 -12.558 -3.697 13.095 1.00 0.00 O ATOM 423 CB LYS A 26 -10.787 -0.802 13.334 1.00 0.00 C ATOM 424 CG LYS A 26 -10.766 -0.828 14.863 1.00 0.00 C ATOM 425 CD LYS A 26 -9.359 -0.550 15.397 1.00 0.00 C ATOM 426 CE LYS A 26 -9.265 0.859 15.985 1.00 0.00 C ATOM 427 NZ LYS A 26 -9.367 0.813 17.461 1.00 0.00 N ATOM 0 H LYS A 26 -9.468 -1.327 11.314 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.278 -2.833 13.556 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -9.954 -0.203 12.966 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -11.703 -0.323 12.987 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.460 -0.083 15.252 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.108 -1.800 15.218 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -9.104 -1.285 16.161 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -8.632 -0.662 14.593 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.320 1.318 15.694 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.061 1.483 15.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.301 1.778 17.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.279 0.394 17.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.592 0.235 17.845 1.00 0.00 H new ATOM 440 N LYS A 27 -12.610 -2.326 11.297 1.00 0.00 N ATOM 441 CA LYS A 27 -13.900 -2.805 10.830 1.00 0.00 C ATOM 442 C LYS A 27 -13.779 -4.277 10.433 1.00 0.00 C ATOM 443 O LYS A 27 -14.701 -5.061 10.653 1.00 0.00 O ATOM 444 CB LYS A 27 -14.432 -1.907 9.711 1.00 0.00 C ATOM 445 CG LYS A 27 -15.780 -2.414 9.196 1.00 0.00 C ATOM 446 CD LYS A 27 -16.759 -1.256 8.989 1.00 0.00 C ATOM 447 CE LYS A 27 -17.559 -0.980 10.264 1.00 0.00 C ATOM 448 NZ LYS A 27 -17.042 0.226 10.949 1.00 0.00 N ATOM 0 H LYS A 27 -12.190 -1.599 10.718 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.639 -2.750 11.629 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -14.540 -0.887 10.079 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -13.714 -1.876 8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.637 -2.947 8.256 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.200 -3.127 9.906 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -16.211 -0.360 8.698 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -17.440 -1.493 8.172 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -18.612 -0.842 10.017 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -17.498 -1.839 10.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -17.657 0.458 11.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -16.077 0.044 11.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -17.028 1.025 10.283 1.00 0.00 H new ATOM 461 N GLU A 28 -12.634 -4.608 9.854 1.00 0.00 N ATOM 462 CA GLU A 28 -12.380 -5.973 9.423 1.00 0.00 C ATOM 463 C GLU A 28 -12.268 -6.900 10.635 1.00 0.00 C ATOM 464 O GLU A 28 -13.058 -7.830 10.785 1.00 0.00 O ATOM 465 CB GLU A 28 -11.122 -6.049 8.556 1.00 0.00 C ATOM 466 CG GLU A 28 -10.795 -7.499 8.192 1.00 0.00 C ATOM 467 CD GLU A 28 -12.010 -8.199 7.580 1.00 0.00 C ATOM 468 OE1 GLU A 28 -12.889 -7.533 7.014 1.00 0.00 O ATOM 469 OE2 GLU A 28 -12.021 -9.482 7.708 1.00 0.00 O ATOM 0 H GLU A 28 -11.872 -3.955 9.673 1.00 0.00 H new ATOM 0 HA GLU A 28 -13.221 -6.304 8.814 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -11.267 -5.466 7.647 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -10.281 -5.605 9.089 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.964 -7.522 7.487 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.472 -8.037 9.083 1.00 0.00 H new ATOM 477 N ILE A 29 -11.279 -6.613 11.469 1.00 0.00 N ATOM 478 CA ILE A 29 -11.053 -7.409 12.664 1.00 0.00 C ATOM 479 C ILE A 29 -10.468 -6.518 13.762 1.00 0.00 C ATOM 480 O ILE A 29 -11.068 -6.362 14.824 1.00 0.00 O ATOM 481 CB ILE A 29 -10.190 -8.630 12.338 1.00 0.00 C ATOM 482 CG1 ILE A 29 -9.892 -9.443 13.600 1.00 0.00 C ATOM 483 CG2 ILE A 29 -8.911 -8.218 11.606 1.00 0.00 C ATOM 484 CD1 ILE A 29 -9.127 -10.723 13.259 1.00 0.00 C ATOM 0 H ILE A 29 -10.625 -5.841 11.341 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.995 -7.805 13.043 1.00 0.00 H new ATOM 0 HB ILE A 29 -10.752 -9.276 11.664 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.308 -8.840 14.296 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -10.825 -9.696 14.103 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.316 -9.104 11.386 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -9.171 -7.715 10.674 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.334 -7.540 12.235 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.928 -11.282 14.173 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.724 -11.334 12.582 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -8.183 -10.466 12.778 1.00 0.00 H new ATOM 496 N GLY A 30 -9.305 -5.957 13.468 1.00 0.00 N ATOM 497 CA GLY A 30 -8.633 -5.086 14.417 1.00 0.00 C ATOM 498 C GLY A 30 -7.120 -5.315 14.396 1.00 0.00 C ATOM 499 O GLY A 30 -6.395 -4.630 13.676 1.00 0.00 O ATOM 0 H GLY A 30 -8.810 -6.089 12.586 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.850 -4.045 14.177 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.018 -5.269 15.420 1.00 0.00 H new ATOM 503 N ASP A 31 -6.688 -6.282 15.193 1.00 0.00 N ATOM 504 CA ASP A 31 -5.275 -6.609 15.274 1.00 0.00 C ATOM 505 C ASP A 31 -4.893 -7.498 14.089 1.00 0.00 C ATOM 506 O ASP A 31 -5.102 -8.709 14.124 1.00 0.00 O ATOM 507 CB ASP A 31 -4.961 -7.376 16.561 1.00 0.00 C ATOM 508 CG ASP A 31 -3.482 -7.406 16.951 1.00 0.00 C ATOM 509 OD1 ASP A 31 -2.593 -7.366 16.088 1.00 0.00 O ATOM 510 OD2 ASP A 31 -3.254 -7.474 18.219 1.00 0.00 O ATOM 0 H ASP A 31 -7.292 -6.849 15.788 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.711 -5.676 15.263 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -5.528 -6.931 17.379 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -5.313 -8.402 16.450 1.00 0.00 H new ATOM 516 N VAL A 32 -4.339 -6.861 13.068 1.00 0.00 N ATOM 517 CA VAL A 32 -3.926 -7.578 11.874 1.00 0.00 C ATOM 518 C VAL A 32 -2.398 -7.625 11.815 1.00 0.00 C ATOM 519 O VAL A 32 -1.725 -7.283 12.787 1.00 0.00 O ATOM 520 CB VAL A 32 -4.552 -6.936 10.634 1.00 0.00 C ATOM 521 CG1 VAL A 32 -6.075 -7.087 10.648 1.00 0.00 C ATOM 522 CG2 VAL A 32 -4.148 -5.465 10.515 1.00 0.00 C ATOM 0 H VAL A 32 -4.167 -5.856 13.043 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.282 -8.608 11.905 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.171 -7.460 9.757 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.495 -6.622 9.756 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -6.336 -8.145 10.663 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.481 -6.601 11.535 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.606 -5.033 9.626 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.486 -4.922 11.398 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.063 -5.391 10.437 1.00 0.00 H new ATOM 532 N HIS A 33 -1.894 -8.051 10.666 1.00 0.00 N ATOM 533 CA HIS A 33 -0.458 -8.147 10.469 1.00 0.00 C ATOM 534 C HIS A 33 -0.128 -7.935 8.990 1.00 0.00 C ATOM 535 O HIS A 33 -0.242 -8.860 8.186 1.00 0.00 O ATOM 536 CB HIS A 33 0.078 -9.473 11.012 1.00 0.00 C ATOM 537 CG HIS A 33 0.018 -9.590 12.516 1.00 0.00 C ATOM 538 ND1 HIS A 33 -1.011 -9.931 13.344 1.00 0.00 N flip ATOM 539 CD2 HIS A 33 1.108 -9.340 13.331 1.00 0.00 C flip ATOM 540 CE1 HIS A 33 -0.573 -9.893 14.596 1.00 0.00 C flip ATOM 541 NE2 HIS A 33 0.741 -9.526 14.591 1.00 0.00 N flip ATOM 0 H HIS A 33 -2.455 -8.333 9.862 1.00 0.00 H new ATOM 0 HA HIS A 33 0.043 -7.361 11.034 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -0.492 -10.291 10.571 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.112 -9.594 10.689 1.00 0.00 H new ATOM 0 HD2 HIS A 33 2.091 -9.044 12.997 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -1.160 -10.116 15.475 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.336 -9.414 15.412 1.00 0.00 H new ATOM 549 N VAL A 34 0.275 -6.713 8.676 1.00 0.00 N ATOM 550 CA VAL A 34 0.623 -6.368 7.307 1.00 0.00 C ATOM 551 C VAL A 34 2.098 -5.966 7.246 1.00 0.00 C ATOM 552 O VAL A 34 2.462 -4.866 7.656 1.00 0.00 O ATOM 553 CB VAL A 34 -0.316 -5.278 6.788 1.00 0.00 C ATOM 554 CG1 VAL A 34 0.407 -4.353 5.808 1.00 0.00 C ATOM 555 CG2 VAL A 34 -1.564 -5.888 6.147 1.00 0.00 C ATOM 0 H VAL A 34 0.369 -5.949 9.345 1.00 0.00 H new ATOM 0 HA VAL A 34 0.494 -7.229 6.651 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.637 -4.679 7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.283 -3.587 5.454 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.250 -3.878 6.310 1.00 0.00 H new ATOM 0 HG13 VAL A 34 0.770 -4.934 4.960 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.214 -5.091 5.787 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.270 -6.523 5.311 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.098 -6.485 6.886 1.00 0.00 H new ATOM 565 N ASN A 35 2.906 -6.881 6.730 1.00 0.00 N ATOM 566 CA ASN A 35 4.333 -6.635 6.610 1.00 0.00 C ATOM 567 C ASN A 35 4.636 -6.082 5.216 1.00 0.00 C ATOM 568 O ASN A 35 4.574 -6.813 4.228 1.00 0.00 O ATOM 569 CB ASN A 35 5.132 -7.928 6.789 1.00 0.00 C ATOM 570 CG ASN A 35 5.897 -7.921 8.114 1.00 0.00 C ATOM 571 OD1 ASN A 35 6.769 -7.102 8.353 1.00 0.00 O ATOM 572 ND2 ASN A 35 5.523 -8.877 8.960 1.00 0.00 N ATOM 0 H ASN A 35 2.600 -7.793 6.391 1.00 0.00 H new ATOM 0 HA ASN A 35 4.618 -5.924 7.385 1.00 0.00 H new ATOM 0 HB2 ASN A 35 4.457 -8.784 6.759 1.00 0.00 H new ATOM 0 HB3 ASN A 35 5.832 -8.045 5.962 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.974 -8.956 9.872 1.00 0.00 H new ATOM 0 HD22 ASN A 35 4.786 -9.531 8.697 1.00 0.00 H new ATOM 579 N VAL A 36 4.955 -4.797 5.181 1.00 0.00 N ATOM 580 CA VAL A 36 5.267 -4.138 3.924 1.00 0.00 C ATOM 581 C VAL A 36 6.786 -4.073 3.750 1.00 0.00 C ATOM 582 O VAL A 36 7.512 -3.792 4.702 1.00 0.00 O ATOM 583 CB VAL A 36 4.601 -2.761 3.875 1.00 0.00 C ATOM 584 CG1 VAL A 36 5.440 -1.774 3.061 1.00 0.00 C ATOM 585 CG2 VAL A 36 3.179 -2.860 3.320 1.00 0.00 C ATOM 0 H VAL A 36 5.004 -4.194 6.003 1.00 0.00 H new ATOM 0 HA VAL A 36 4.867 -4.708 3.085 1.00 0.00 H new ATOM 0 HB VAL A 36 4.537 -2.383 4.895 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.944 -0.804 3.042 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.424 -1.670 3.518 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.551 -2.145 2.042 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.728 -1.868 3.296 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.210 -3.269 2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.584 -3.513 3.958 1.00 0.00 H new ATOM 595 N ILE A 37 7.221 -4.338 2.527 1.00 0.00 N ATOM 596 CA ILE A 37 8.641 -4.314 2.216 1.00 0.00 C ATOM 597 C ILE A 37 8.924 -3.172 1.239 1.00 0.00 C ATOM 598 O ILE A 37 8.525 -3.231 0.077 1.00 0.00 O ATOM 599 CB ILE A 37 9.103 -5.683 1.714 1.00 0.00 C ATOM 600 CG1 ILE A 37 8.366 -6.811 2.439 1.00 0.00 C ATOM 601 CG2 ILE A 37 10.622 -5.825 1.827 1.00 0.00 C ATOM 602 CD1 ILE A 37 7.187 -7.319 1.609 1.00 0.00 C ATOM 0 H ILE A 37 6.616 -4.570 1.740 1.00 0.00 H new ATOM 0 HA ILE A 37 9.225 -4.117 3.115 1.00 0.00 H new ATOM 0 HB ILE A 37 8.850 -5.761 0.657 1.00 0.00 H new ATOM 0 HG12 ILE A 37 9.055 -7.632 2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.008 -6.454 3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 37 10.924 -6.807 1.463 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.105 -5.053 1.229 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.921 -5.716 2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.681 -8.120 2.148 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.487 -6.502 1.433 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.551 -7.698 0.654 1.00 0.00 H new ATOM 614 N LEU A 38 9.612 -2.159 1.745 1.00 0.00 N ATOM 615 CA LEU A 38 9.954 -1.005 0.931 1.00 0.00 C ATOM 616 C LEU A 38 11.297 -1.254 0.240 1.00 0.00 C ATOM 617 O LEU A 38 12.313 -1.454 0.904 1.00 0.00 O ATOM 618 CB LEU A 38 9.923 0.272 1.772 1.00 0.00 C ATOM 619 CG LEU A 38 8.677 0.476 2.636 1.00 0.00 C ATOM 620 CD1 LEU A 38 8.963 1.433 3.795 1.00 0.00 C ATOM 621 CD2 LEU A 38 7.491 0.941 1.788 1.00 0.00 C ATOM 0 H LEU A 38 9.942 -2.114 2.709 1.00 0.00 H new ATOM 0 HA LEU A 38 9.213 -0.860 0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.797 0.276 2.423 1.00 0.00 H new ATOM 0 HB3 LEU A 38 10.021 1.127 1.103 1.00 0.00 H new ATOM 0 HG LEU A 38 8.404 -0.485 3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.061 1.560 4.393 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.757 1.022 4.419 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.276 2.400 3.400 1.00 0.00 H new ATOM 0 HD21 LEU A 38 6.619 1.078 2.427 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.738 1.886 1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.270 0.191 1.029 1.00 0.00 H new ATOM 633 N VAL A 39 11.258 -1.233 -1.084 1.00 0.00 N ATOM 634 CA VAL A 39 12.459 -1.453 -1.872 1.00 0.00 C ATOM 635 C VAL A 39 12.396 -0.599 -3.139 1.00 0.00 C ATOM 636 O VAL A 39 11.342 -0.484 -3.763 1.00 0.00 O ATOM 637 CB VAL A 39 12.626 -2.946 -2.165 1.00 0.00 C ATOM 638 CG1 VAL A 39 12.705 -3.753 -0.867 1.00 0.00 C ATOM 639 CG2 VAL A 39 11.497 -3.458 -3.061 1.00 0.00 C ATOM 0 H VAL A 39 10.413 -1.067 -1.631 1.00 0.00 H new ATOM 0 HA VAL A 39 13.343 -1.143 -1.315 1.00 0.00 H new ATOM 0 HB VAL A 39 13.566 -3.080 -2.701 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.823 -4.811 -1.103 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.558 -3.414 -0.279 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.789 -3.610 -0.293 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.639 -4.521 -3.254 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.539 -3.305 -2.563 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.506 -2.913 -4.005 1.00 0.00 H new ATOM 649 N SER A 40 13.538 -0.021 -3.482 1.00 0.00 N ATOM 650 CA SER A 40 13.626 0.820 -4.664 1.00 0.00 C ATOM 651 C SER A 40 13.564 -0.044 -5.926 1.00 0.00 C ATOM 652 O SER A 40 13.226 -1.224 -5.859 1.00 0.00 O ATOM 653 CB SER A 40 14.909 1.653 -4.653 1.00 0.00 C ATOM 654 OG SER A 40 15.254 2.084 -3.340 1.00 0.00 O ATOM 0 H SER A 40 14.410 -0.118 -2.962 1.00 0.00 H new ATOM 0 HA SER A 40 12.780 1.507 -4.659 1.00 0.00 H new ATOM 0 HB2 SER A 40 15.727 1.064 -5.068 1.00 0.00 H new ATOM 0 HB3 SER A 40 14.782 2.522 -5.298 1.00 0.00 H new ATOM 0 HG SER A 40 16.079 2.611 -3.375 1.00 0.00 H new ATOM 660 N GLU A 41 13.896 0.579 -7.047 1.00 0.00 N ATOM 661 CA GLU A 41 13.882 -0.117 -8.323 1.00 0.00 C ATOM 662 C GLU A 41 15.068 -1.079 -8.415 1.00 0.00 C ATOM 663 O GLU A 41 14.900 -2.246 -8.764 1.00 0.00 O ATOM 664 CB GLU A 41 13.888 0.874 -9.489 1.00 0.00 C ATOM 665 CG GLU A 41 14.187 0.163 -10.810 1.00 0.00 C ATOM 666 CD GLU A 41 14.218 1.158 -11.972 1.00 0.00 C ATOM 667 OE1 GLU A 41 13.227 1.285 -12.706 1.00 0.00 O ATOM 668 OE2 GLU A 41 15.322 1.813 -12.100 1.00 0.00 O ATOM 0 H GLU A 41 14.176 1.558 -7.099 1.00 0.00 H new ATOM 0 HA GLU A 41 12.962 -0.698 -8.388 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.921 1.374 -9.551 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.635 1.647 -9.310 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.145 -0.352 -10.741 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.429 -0.598 -10.998 1.00 0.00 H new ATOM 676 N ASP A 42 16.242 -0.553 -8.095 1.00 0.00 N ATOM 677 CA ASP A 42 17.456 -1.351 -8.137 1.00 0.00 C ATOM 678 C ASP A 42 17.435 -2.364 -6.991 1.00 0.00 C ATOM 679 O ASP A 42 18.036 -3.433 -7.092 1.00 0.00 O ATOM 680 CB ASP A 42 18.697 -0.473 -7.969 1.00 0.00 C ATOM 681 CG ASP A 42 19.761 -0.642 -9.056 1.00 0.00 C ATOM 682 OD1 ASP A 42 19.990 -1.753 -9.558 1.00 0.00 O ATOM 683 OD2 ASP A 42 20.377 0.441 -9.390 1.00 0.00 O ATOM 0 H ASP A 42 16.378 0.416 -7.806 1.00 0.00 H new ATOM 0 HA ASP A 42 17.497 -1.853 -9.104 1.00 0.00 H new ATOM 0 HB2 ASP A 42 18.385 0.571 -7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 42 19.150 -0.691 -7.002 1.00 0.00 H new ATOM 689 N GLU A 43 16.736 -1.994 -5.928 1.00 0.00 N ATOM 690 CA GLU A 43 16.629 -2.857 -4.765 1.00 0.00 C ATOM 691 C GLU A 43 15.602 -3.963 -5.017 1.00 0.00 C ATOM 692 O GLU A 43 15.823 -5.116 -4.651 1.00 0.00 O ATOM 693 CB GLU A 43 16.272 -2.051 -3.515 1.00 0.00 C ATOM 694 CG GLU A 43 17.522 -1.728 -2.694 1.00 0.00 C ATOM 695 CD GLU A 43 17.164 -1.459 -1.231 1.00 0.00 C ATOM 696 OE1 GLU A 43 17.414 -2.310 -0.365 1.00 0.00 O ATOM 697 OE2 GLU A 43 16.607 -0.317 -1.008 1.00 0.00 O ATOM 0 H GLU A 43 16.238 -1.107 -5.848 1.00 0.00 H new ATOM 0 HA GLU A 43 17.599 -3.322 -4.592 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.774 -1.126 -3.805 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.567 -2.615 -2.904 1.00 0.00 H new ATOM 0 HG2 GLU A 43 18.225 -2.559 -2.753 1.00 0.00 H new ATOM 0 HG3 GLU A 43 18.023 -0.856 -3.116 1.00 0.00 H new ATOM 705 N ILE A 44 14.500 -3.572 -5.640 1.00 0.00 N ATOM 706 CA ILE A 44 13.438 -4.515 -5.946 1.00 0.00 C ATOM 707 C ILE A 44 13.868 -5.399 -7.118 1.00 0.00 C ATOM 708 O ILE A 44 13.502 -6.571 -7.183 1.00 0.00 O ATOM 709 CB ILE A 44 12.119 -3.778 -6.183 1.00 0.00 C ATOM 710 CG1 ILE A 44 10.926 -4.723 -6.026 1.00 0.00 C ATOM 711 CG2 ILE A 44 12.119 -3.077 -7.543 1.00 0.00 C ATOM 712 CD1 ILE A 44 9.632 -3.941 -5.794 1.00 0.00 C ATOM 0 H ILE A 44 14.320 -2.614 -5.941 1.00 0.00 H new ATOM 0 HA ILE A 44 13.259 -5.175 -5.098 1.00 0.00 H new ATOM 0 HB ILE A 44 12.019 -3.004 -5.422 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.827 -5.340 -6.919 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.101 -5.399 -5.189 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.170 -2.561 -7.686 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.934 -2.354 -7.580 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.253 -3.816 -8.333 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.800 -4.637 -5.686 1.00 0.00 H new ATOM 0 HD12 ILE A 44 9.725 -3.344 -4.887 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.447 -3.284 -6.644 1.00 0.00 H new ATOM 724 N LYS A 45 14.639 -4.802 -8.016 1.00 0.00 N ATOM 725 CA LYS A 45 15.123 -5.520 -9.182 1.00 0.00 C ATOM 726 C LYS A 45 15.731 -6.853 -8.740 1.00 0.00 C ATOM 727 O LYS A 45 15.489 -7.887 -9.361 1.00 0.00 O ATOM 728 CB LYS A 45 16.083 -4.645 -9.990 1.00 0.00 C ATOM 729 CG LYS A 45 16.750 -5.449 -11.108 1.00 0.00 C ATOM 730 CD LYS A 45 18.168 -5.867 -10.713 1.00 0.00 C ATOM 731 CE LYS A 45 18.937 -6.408 -11.920 1.00 0.00 C ATOM 732 NZ LYS A 45 20.312 -5.863 -11.945 1.00 0.00 N ATOM 0 H LYS A 45 14.940 -3.829 -7.959 1.00 0.00 H new ATOM 0 HA LYS A 45 14.298 -5.753 -9.855 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.540 -3.802 -10.418 1.00 0.00 H new ATOM 0 HB3 LYS A 45 16.846 -4.231 -9.330 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.154 -6.335 -11.329 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.784 -4.852 -12.019 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.699 -5.013 -10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 45 18.123 -6.629 -9.935 1.00 0.00 H new ATOM 0 HE2 LYS A 45 18.972 -7.497 -11.878 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.417 -6.141 -12.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 20.820 -6.240 -12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 20.273 -4.826 -12.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 20.811 -6.140 -11.075 1.00 0.00 H new ATOM 745 N GLU A 46 16.508 -6.786 -7.669 1.00 0.00 N ATOM 746 CA GLU A 46 17.152 -7.974 -7.136 1.00 0.00 C ATOM 747 C GLU A 46 16.152 -8.803 -6.328 1.00 0.00 C ATOM 748 O GLU A 46 16.045 -10.013 -6.519 1.00 0.00 O ATOM 749 CB GLU A 46 18.370 -7.604 -6.287 1.00 0.00 C ATOM 750 CG GLU A 46 19.396 -6.823 -7.110 1.00 0.00 C ATOM 751 CD GLU A 46 20.806 -7.376 -6.895 1.00 0.00 C ATOM 752 OE1 GLU A 46 21.198 -8.350 -7.556 1.00 0.00 O ATOM 753 OE2 GLU A 46 21.505 -6.756 -6.006 1.00 0.00 O ATOM 0 H GLU A 46 16.706 -5.927 -7.156 1.00 0.00 H new ATOM 0 HA GLU A 46 17.503 -8.578 -7.972 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.054 -7.006 -5.432 1.00 0.00 H new ATOM 0 HB3 GLU A 46 18.830 -8.509 -5.891 1.00 0.00 H new ATOM 0 HG2 GLU A 46 19.137 -6.878 -8.167 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.368 -5.770 -6.829 1.00 0.00 H new ATOM 761 N LEU A 47 15.444 -8.118 -5.441 1.00 0.00 N ATOM 762 CA LEU A 47 14.456 -8.776 -4.603 1.00 0.00 C ATOM 763 C LEU A 47 13.595 -9.699 -5.467 1.00 0.00 C ATOM 764 O LEU A 47 13.082 -10.707 -4.983 1.00 0.00 O ATOM 765 CB LEU A 47 13.649 -7.742 -3.814 1.00 0.00 C ATOM 766 CG LEU A 47 12.799 -8.289 -2.666 1.00 0.00 C ATOM 767 CD1 LEU A 47 11.684 -9.195 -3.193 1.00 0.00 C ATOM 768 CD2 LEU A 47 13.671 -8.998 -1.628 1.00 0.00 C ATOM 0 H LEU A 47 15.535 -7.114 -5.285 1.00 0.00 H new ATOM 0 HA LEU A 47 14.945 -9.402 -3.857 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.340 -7.004 -3.408 1.00 0.00 H new ATOM 0 HB3 LEU A 47 12.992 -7.217 -4.508 1.00 0.00 H new ATOM 0 HG LEU A 47 12.320 -7.448 -2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 47 11.095 -9.571 -2.357 1.00 0.00 H new ATOM 0 HD12 LEU A 47 11.040 -8.627 -3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 47 12.122 -10.034 -3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 47 13.042 -9.377 -0.823 1.00 0.00 H new ATOM 0 HD22 LEU A 47 14.196 -9.828 -2.100 1.00 0.00 H new ATOM 0 HD23 LEU A 47 14.397 -8.294 -1.221 1.00 0.00 H new ATOM 780 N ASN A 48 13.463 -9.322 -6.730 1.00 0.00 N ATOM 781 CA ASN A 48 12.672 -10.104 -7.666 1.00 0.00 C ATOM 782 C ASN A 48 13.449 -11.364 -8.054 1.00 0.00 C ATOM 783 O ASN A 48 12.931 -12.475 -7.948 1.00 0.00 O ATOM 784 CB ASN A 48 12.387 -9.312 -8.943 1.00 0.00 C ATOM 785 CG ASN A 48 10.998 -9.641 -9.494 1.00 0.00 C ATOM 786 OD1 ASN A 48 10.473 -10.728 -9.316 1.00 0.00 O ATOM 787 ND2 ASN A 48 10.434 -8.644 -10.170 1.00 0.00 N ATOM 0 H ASN A 48 13.890 -8.485 -7.128 1.00 0.00 H new ATOM 0 HA ASN A 48 11.729 -10.357 -7.182 1.00 0.00 H new ATOM 0 HB2 ASN A 48 12.456 -8.244 -8.736 1.00 0.00 H new ATOM 0 HB3 ASN A 48 13.143 -9.541 -9.694 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.506 -8.764 -10.577 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.929 -7.759 -10.282 1.00 0.00 H new ATOM 794 N GLN A 49 14.679 -11.149 -8.497 1.00 0.00 N ATOM 795 CA GLN A 49 15.533 -12.253 -8.902 1.00 0.00 C ATOM 796 C GLN A 49 15.768 -13.202 -7.725 1.00 0.00 C ATOM 797 O GLN A 49 16.055 -14.382 -7.922 1.00 0.00 O ATOM 798 CB GLN A 49 16.859 -11.742 -9.468 1.00 0.00 C ATOM 799 CG GLN A 49 16.701 -11.301 -10.924 1.00 0.00 C ATOM 800 CD GLN A 49 18.062 -11.192 -11.615 1.00 0.00 C ATOM 801 OE1 GLN A 49 18.923 -10.419 -11.229 1.00 0.00 O ATOM 802 NE2 GLN A 49 18.207 -12.009 -12.655 1.00 0.00 N ATOM 0 H GLN A 49 15.105 -10.226 -8.584 1.00 0.00 H new ATOM 0 HA GLN A 49 15.027 -12.806 -9.694 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.216 -10.905 -8.868 1.00 0.00 H new ATOM 0 HB3 GLN A 49 17.613 -12.526 -9.402 1.00 0.00 H new ATOM 0 HG2 GLN A 49 16.074 -12.015 -11.458 1.00 0.00 H new ATOM 0 HG3 GLN A 49 16.191 -10.338 -10.963 1.00 0.00 H new ATOM 0 HE21 GLN A 49 17.445 -12.631 -12.925 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.080 -12.013 -13.183 1.00 0.00 H new ATOM 811 N GLN A 50 15.637 -12.651 -6.527 1.00 0.00 N ATOM 812 CA GLN A 50 15.831 -13.434 -5.319 1.00 0.00 C ATOM 813 C GLN A 50 14.962 -14.692 -5.356 1.00 0.00 C ATOM 814 O GLN A 50 15.350 -15.735 -4.831 1.00 0.00 O ATOM 815 CB GLN A 50 15.535 -12.599 -4.071 1.00 0.00 C ATOM 816 CG GLN A 50 16.635 -11.564 -3.830 1.00 0.00 C ATOM 817 CD GLN A 50 16.651 -11.111 -2.368 1.00 0.00 C ATOM 818 OE1 GLN A 50 16.372 -11.869 -1.454 1.00 0.00 O ATOM 819 NE2 GLN A 50 16.993 -9.837 -2.200 1.00 0.00 N ATOM 0 H GLN A 50 15.399 -11.672 -6.367 1.00 0.00 H new ATOM 0 HA GLN A 50 16.876 -13.740 -5.272 1.00 0.00 H new ATOM 0 HB2 GLN A 50 14.575 -12.095 -4.186 1.00 0.00 H new ATOM 0 HB3 GLN A 50 15.450 -13.253 -3.203 1.00 0.00 H new ATOM 0 HG2 GLN A 50 17.603 -11.989 -4.093 1.00 0.00 H new ATOM 0 HG3 GLN A 50 16.478 -10.703 -4.480 1.00 0.00 H new ATOM 0 HE21 GLN A 50 17.215 -9.257 -3.010 1.00 0.00 H new ATOM 0 HE22 GLN A 50 17.034 -9.439 -1.262 1.00 0.00 H new ATOM 828 N PHE A 51 13.802 -14.553 -5.981 1.00 0.00 N ATOM 829 CA PHE A 51 12.874 -15.666 -6.093 1.00 0.00 C ATOM 830 C PHE A 51 12.458 -15.888 -7.548 1.00 0.00 C ATOM 831 O PHE A 51 12.514 -17.010 -8.050 1.00 0.00 O ATOM 832 CB PHE A 51 11.637 -15.302 -5.271 1.00 0.00 C ATOM 833 CG PHE A 51 11.954 -14.636 -3.930 1.00 0.00 C ATOM 834 CD1 PHE A 51 12.822 -15.227 -3.066 1.00 0.00 C ATOM 835 CD2 PHE A 51 11.369 -13.453 -3.603 1.00 0.00 C ATOM 836 CE1 PHE A 51 13.116 -14.609 -1.822 1.00 0.00 C ATOM 837 CE2 PHE A 51 11.663 -12.835 -2.359 1.00 0.00 C ATOM 838 CZ PHE A 51 12.531 -13.426 -1.494 1.00 0.00 C ATOM 0 H PHE A 51 13.483 -13.687 -6.415 1.00 0.00 H new ATOM 0 HA PHE A 51 13.345 -16.581 -5.734 1.00 0.00 H new ATOM 0 HB2 PHE A 51 11.008 -14.633 -5.858 1.00 0.00 H new ATOM 0 HB3 PHE A 51 11.056 -16.206 -5.088 1.00 0.00 H new ATOM 0 HD1 PHE A 51 13.288 -16.166 -3.326 1.00 0.00 H new ATOM 0 HD2 PHE A 51 10.680 -12.983 -4.290 1.00 0.00 H new ATOM 0 HE1 PHE A 51 13.805 -15.079 -1.136 1.00 0.00 H new ATOM 0 HE2 PHE A 51 11.198 -11.896 -2.099 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.755 -12.956 -0.548 1.00 0.00 H new ATOM 848 N ARG A 52 12.050 -14.801 -8.186 1.00 0.00 N ATOM 849 CA ARG A 52 11.624 -14.863 -9.574 1.00 0.00 C ATOM 850 C ARG A 52 12.828 -15.098 -10.488 1.00 0.00 C ATOM 851 O ARG A 52 12.669 -15.505 -11.638 1.00 0.00 O ATOM 852 CB ARG A 52 10.919 -13.571 -9.992 1.00 0.00 C ATOM 853 CG ARG A 52 9.497 -13.515 -9.430 1.00 0.00 C ATOM 854 CD ARG A 52 8.461 -13.686 -10.543 1.00 0.00 C ATOM 855 NE ARG A 52 7.524 -12.541 -10.542 1.00 0.00 N ATOM 856 CZ ARG A 52 6.417 -12.467 -11.311 1.00 0.00 C ATOM 857 NH1 ARG A 52 6.100 -13.474 -12.152 1.00 0.00 N ATOM 858 NH2 ARG A 52 5.651 -11.396 -11.229 1.00 0.00 N ATOM 0 H ARG A 52 12.005 -13.872 -7.767 1.00 0.00 H new ATOM 0 HA ARG A 52 10.923 -15.693 -9.670 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.488 -12.711 -9.638 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.887 -13.506 -11.080 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.366 -14.298 -8.683 1.00 0.00 H new ATOM 0 HG3 ARG A 52 9.339 -12.562 -8.924 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.961 -13.756 -11.509 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.911 -14.616 -10.400 1.00 0.00 H new ATOM 0 HE ARG A 52 7.727 -11.758 -9.921 1.00 0.00 H new ATOM 0 HH11 ARG A 52 6.699 -14.298 -12.210 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.262 -13.411 -12.730 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.899 -10.639 -10.591 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.811 -11.325 -11.803 1.00 0.00 H new ATOM 871 N GLY A 53 14.006 -14.831 -9.943 1.00 0.00 N ATOM 872 CA GLY A 53 15.236 -15.009 -10.695 1.00 0.00 C ATOM 873 C GLY A 53 15.194 -14.224 -12.008 1.00 0.00 C ATOM 874 O GLY A 53 15.981 -14.484 -12.917 1.00 0.00 O ATOM 0 H GLY A 53 14.134 -14.493 -8.989 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.084 -14.677 -10.096 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.388 -16.068 -10.905 1.00 0.00 H new ATOM 878 N GLN A 54 14.268 -13.278 -12.066 1.00 0.00 N ATOM 879 CA GLN A 54 14.113 -12.453 -13.252 1.00 0.00 C ATOM 880 C GLN A 54 14.450 -10.996 -12.932 1.00 0.00 C ATOM 881 O GLN A 54 14.138 -10.506 -11.848 1.00 0.00 O ATOM 882 CB GLN A 54 12.700 -12.576 -13.824 1.00 0.00 C ATOM 883 CG GLN A 54 12.597 -13.768 -14.778 1.00 0.00 C ATOM 884 CD GLN A 54 11.599 -13.485 -15.903 1.00 0.00 C ATOM 885 OE1 GLN A 54 10.572 -12.855 -15.714 1.00 0.00 O ATOM 886 NE2 GLN A 54 11.959 -13.984 -17.083 1.00 0.00 N ATOM 0 H GLN A 54 13.617 -13.064 -11.310 1.00 0.00 H new ATOM 0 HA GLN A 54 14.809 -12.808 -14.012 1.00 0.00 H new ATOM 0 HB2 GLN A 54 11.984 -12.693 -13.011 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.436 -11.659 -14.352 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.577 -13.984 -15.203 1.00 0.00 H new ATOM 0 HG3 GLN A 54 12.286 -14.655 -14.226 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.833 -14.502 -17.172 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.361 -13.848 -17.898 1.00 0.00 H new ATOM 895 N ASP A 55 15.083 -10.343 -13.896 1.00 0.00 N ATOM 896 CA ASP A 55 15.466 -8.951 -13.731 1.00 0.00 C ATOM 897 C ASP A 55 14.426 -8.057 -14.408 1.00 0.00 C ATOM 898 O ASP A 55 14.511 -7.799 -15.608 1.00 0.00 O ATOM 899 CB ASP A 55 16.824 -8.673 -14.380 1.00 0.00 C ATOM 900 CG ASP A 55 17.151 -7.192 -14.584 1.00 0.00 C ATOM 901 OD1 ASP A 55 16.498 -6.308 -14.009 1.00 0.00 O ATOM 902 OD2 ASP A 55 18.137 -6.957 -15.382 1.00 0.00 O ATOM 0 H ASP A 55 15.340 -10.752 -14.794 1.00 0.00 H new ATOM 0 HA ASP A 55 15.527 -8.742 -12.663 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.603 -9.120 -13.763 1.00 0.00 H new ATOM 0 HB3 ASP A 55 16.857 -9.174 -15.348 1.00 0.00 H new ATOM 908 N ARG A 56 13.468 -7.609 -13.610 1.00 0.00 N ATOM 909 CA ARG A 56 12.413 -6.749 -14.118 1.00 0.00 C ATOM 910 C ARG A 56 11.512 -6.282 -12.973 1.00 0.00 C ATOM 911 O ARG A 56 11.048 -7.093 -12.173 1.00 0.00 O ATOM 912 CB ARG A 56 11.563 -7.477 -15.162 1.00 0.00 C ATOM 913 CG ARG A 56 10.716 -8.573 -14.512 1.00 0.00 C ATOM 914 CD ARG A 56 9.275 -8.103 -14.307 1.00 0.00 C ATOM 915 NE ARG A 56 8.332 -9.136 -14.791 1.00 0.00 N ATOM 916 CZ ARG A 56 6.998 -8.956 -14.891 1.00 0.00 C ATOM 917 NH1 ARG A 56 6.437 -7.779 -14.541 1.00 0.00 N ATOM 918 NH2 ARG A 56 6.250 -9.949 -15.336 1.00 0.00 N ATOM 0 H ARG A 56 13.400 -7.825 -12.616 1.00 0.00 H new ATOM 0 HA ARG A 56 12.886 -5.887 -14.588 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.914 -6.763 -15.669 1.00 0.00 H new ATOM 0 HB3 ARG A 56 12.210 -7.915 -15.922 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.726 -9.465 -15.139 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.151 -8.853 -13.553 1.00 0.00 H new ATOM 0 HD2 ARG A 56 9.096 -7.902 -13.251 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.109 -7.168 -14.842 1.00 0.00 H new ATOM 0 HE ARG A 56 8.714 -10.041 -15.066 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.022 -7.017 -14.198 1.00 0.00 H new ATOM 0 HH12 ARG A 56 5.428 -7.652 -14.620 1.00 0.00 H new ATOM 0 HH21 ARG A 56 6.682 -10.835 -15.598 1.00 0.00 H new ATOM 0 HH22 ARG A 56 5.240 -9.830 -15.418 1.00 0.00 H new ATOM 931 N PRO A 57 11.284 -4.942 -12.930 1.00 0.00 N ATOM 932 CA PRO A 57 10.447 -4.357 -11.896 1.00 0.00 C ATOM 933 C PRO A 57 8.967 -4.635 -12.168 1.00 0.00 C ATOM 934 O PRO A 57 8.594 -5.001 -13.281 1.00 0.00 O ATOM 935 CB PRO A 57 10.785 -2.875 -11.907 1.00 0.00 C ATOM 936 CG PRO A 57 11.449 -2.609 -13.248 1.00 0.00 C ATOM 937 CD PRO A 57 11.816 -3.951 -13.861 1.00 0.00 C ATOM 0 HA PRO A 57 10.632 -4.786 -10.911 1.00 0.00 H new ATOM 0 HB2 PRO A 57 9.887 -2.269 -11.789 1.00 0.00 H new ATOM 0 HB3 PRO A 57 11.452 -2.620 -11.083 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.775 -2.061 -13.906 1.00 0.00 H new ATOM 0 HG3 PRO A 57 12.339 -1.993 -13.118 1.00 0.00 H new ATOM 0 HD2 PRO A 57 11.380 -4.066 -14.853 1.00 0.00 H new ATOM 0 HD3 PRO A 57 12.895 -4.053 -13.974 1.00 0.00 H new ATOM 945 N THR A 58 8.163 -4.449 -11.131 1.00 0.00 N ATOM 946 CA THR A 58 6.732 -4.675 -11.243 1.00 0.00 C ATOM 947 C THR A 58 5.963 -3.644 -10.414 1.00 0.00 C ATOM 948 O THR A 58 4.756 -3.776 -10.217 1.00 0.00 O ATOM 949 CB THR A 58 6.448 -6.120 -10.831 1.00 0.00 C ATOM 950 OG1 THR A 58 5.136 -6.071 -10.276 1.00 0.00 O ATOM 951 CG2 THR A 58 7.328 -6.582 -9.667 1.00 0.00 C ATOM 0 H THR A 58 8.476 -4.144 -10.209 1.00 0.00 H new ATOM 0 HA THR A 58 6.389 -4.541 -12.269 1.00 0.00 H new ATOM 0 HB THR A 58 6.603 -6.778 -11.686 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.614 -5.377 -10.730 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.085 -7.614 -9.415 1.00 0.00 H new ATOM 0 HG22 THR A 58 8.377 -6.516 -9.955 1.00 0.00 H new ATOM 0 HG23 THR A 58 7.149 -5.945 -8.801 1.00 0.00 H new ATOM 959 N ASP A 59 6.694 -2.640 -9.951 1.00 0.00 N ATOM 960 CA ASP A 59 6.095 -1.588 -9.148 1.00 0.00 C ATOM 961 C ASP A 59 5.884 -2.098 -7.721 1.00 0.00 C ATOM 962 O ASP A 59 6.296 -1.451 -6.759 1.00 0.00 O ATOM 963 CB ASP A 59 4.733 -1.174 -9.709 1.00 0.00 C ATOM 964 CG ASP A 59 4.683 -1.008 -11.229 1.00 0.00 C ATOM 965 OD1 ASP A 59 5.441 -1.655 -11.967 1.00 0.00 O ATOM 966 OD2 ASP A 59 3.808 -0.162 -11.656 1.00 0.00 O ATOM 0 H ASP A 59 7.695 -2.533 -10.117 1.00 0.00 H new ATOM 0 HA ASP A 59 6.767 -0.730 -9.162 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.994 -1.920 -9.416 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.437 -0.233 -9.246 1.00 0.00 H new ATOM 972 N VAL A 60 5.243 -3.254 -7.629 1.00 0.00 N ATOM 973 CA VAL A 60 4.972 -3.858 -6.336 1.00 0.00 C ATOM 974 C VAL A 60 5.064 -5.381 -6.460 1.00 0.00 C ATOM 975 O VAL A 60 4.366 -5.984 -7.274 1.00 0.00 O ATOM 976 CB VAL A 60 3.617 -3.382 -5.809 1.00 0.00 C ATOM 977 CG1 VAL A 60 2.517 -3.599 -6.851 1.00 0.00 C ATOM 978 CG2 VAL A 60 3.267 -4.074 -4.490 1.00 0.00 C ATOM 0 H VAL A 60 4.904 -3.788 -8.429 1.00 0.00 H new ATOM 0 HA VAL A 60 5.718 -3.545 -5.605 1.00 0.00 H new ATOM 0 HB VAL A 60 3.690 -2.312 -5.616 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.564 -3.252 -6.452 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.757 -3.039 -7.755 1.00 0.00 H new ATOM 0 HG13 VAL A 60 2.446 -4.660 -7.090 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.299 -3.717 -4.138 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.222 -5.152 -4.645 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.030 -3.846 -3.746 1.00 0.00 H new ATOM 988 N LEU A 61 5.931 -5.958 -5.641 1.00 0.00 N ATOM 989 CA LEU A 61 6.123 -7.398 -5.649 1.00 0.00 C ATOM 990 C LEU A 61 5.261 -8.029 -4.554 1.00 0.00 C ATOM 991 O LEU A 61 5.384 -7.676 -3.382 1.00 0.00 O ATOM 992 CB LEU A 61 7.610 -7.741 -5.535 1.00 0.00 C ATOM 993 CG LEU A 61 8.273 -8.278 -6.805 1.00 0.00 C ATOM 994 CD1 LEU A 61 9.390 -7.345 -7.277 1.00 0.00 C ATOM 995 CD2 LEU A 61 8.772 -9.710 -6.600 1.00 0.00 C ATOM 0 H LEU A 61 6.508 -5.454 -4.968 1.00 0.00 H new ATOM 0 HA LEU A 61 5.794 -7.821 -6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.146 -6.846 -5.220 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.732 -8.481 -4.744 1.00 0.00 H new ATOM 0 HG LEU A 61 7.523 -8.308 -7.595 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.845 -7.750 -8.181 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.975 -6.360 -7.489 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.147 -7.260 -6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.239 -10.067 -7.518 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.502 -9.729 -5.791 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.931 -10.355 -6.345 1.00 0.00 H new ATOM 1007 N THR A 62 4.408 -8.952 -4.975 1.00 0.00 N ATOM 1008 CA THR A 62 3.526 -9.635 -4.044 1.00 0.00 C ATOM 1009 C THR A 62 3.637 -11.151 -4.220 1.00 0.00 C ATOM 1010 O THR A 62 3.391 -11.674 -5.306 1.00 0.00 O ATOM 1011 CB THR A 62 2.108 -9.101 -4.258 1.00 0.00 C ATOM 1012 OG1 THR A 62 1.293 -9.952 -3.457 1.00 0.00 O ATOM 1013 CG2 THR A 62 1.603 -9.334 -5.683 1.00 0.00 C ATOM 0 H THR A 62 4.309 -9.242 -5.948 1.00 0.00 H new ATOM 0 HA THR A 62 3.811 -9.437 -3.011 1.00 0.00 H new ATOM 0 HB THR A 62 2.084 -8.034 -4.035 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.356 -9.676 -3.535 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.593 -8.936 -5.781 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.262 -8.829 -6.390 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.594 -10.403 -5.896 1.00 0.00 H new ATOM 1021 N PHE A 63 4.008 -11.815 -3.135 1.00 0.00 N ATOM 1022 CA PHE A 63 4.155 -13.260 -3.155 1.00 0.00 C ATOM 1023 C PHE A 63 2.907 -13.946 -2.595 1.00 0.00 C ATOM 1024 O PHE A 63 2.133 -13.332 -1.864 1.00 0.00 O ATOM 1025 CB PHE A 63 5.352 -13.601 -2.265 1.00 0.00 C ATOM 1026 CG PHE A 63 5.245 -13.052 -0.841 1.00 0.00 C ATOM 1027 CD1 PHE A 63 4.462 -13.684 0.074 1.00 0.00 C ATOM 1028 CD2 PHE A 63 5.934 -11.932 -0.490 1.00 0.00 C ATOM 1029 CE1 PHE A 63 4.363 -13.174 1.396 1.00 0.00 C ATOM 1030 CE2 PHE A 63 5.834 -11.423 0.831 1.00 0.00 C ATOM 1031 CZ PHE A 63 5.051 -12.055 1.746 1.00 0.00 C ATOM 0 H PHE A 63 4.211 -11.378 -2.236 1.00 0.00 H new ATOM 0 HA PHE A 63 4.298 -13.605 -4.179 1.00 0.00 H new ATOM 0 HB2 PHE A 63 5.460 -14.685 -2.218 1.00 0.00 H new ATOM 0 HB3 PHE A 63 6.258 -13.210 -2.727 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.916 -14.573 -0.204 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.557 -11.431 -1.216 1.00 0.00 H new ATOM 0 HE1 PHE A 63 3.741 -13.675 2.123 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.380 -10.534 1.110 1.00 0.00 H new ATOM 0 HZ PHE A 63 4.976 -11.668 2.751 1.00 0.00 H new ATOM 1041 N PRO A 64 2.748 -15.244 -2.970 1.00 0.00 N ATOM 1042 CA PRO A 64 1.607 -16.020 -2.514 1.00 0.00 C ATOM 1043 C PRO A 64 1.773 -16.427 -1.048 1.00 0.00 C ATOM 1044 O PRO A 64 2.769 -17.049 -0.682 1.00 0.00 O ATOM 1045 CB PRO A 64 1.538 -17.209 -3.457 1.00 0.00 C ATOM 1046 CG PRO A 64 2.907 -17.303 -4.111 1.00 0.00 C ATOM 1047 CD PRO A 64 3.645 -16.003 -3.836 1.00 0.00 C ATOM 0 HA PRO A 64 0.675 -15.455 -2.540 1.00 0.00 H new ATOM 0 HB2 PRO A 64 1.301 -18.124 -2.915 1.00 0.00 H new ATOM 0 HB3 PRO A 64 0.757 -17.070 -4.204 1.00 0.00 H new ATOM 0 HG2 PRO A 64 3.464 -18.150 -3.711 1.00 0.00 H new ATOM 0 HG3 PRO A 64 2.807 -17.466 -5.184 1.00 0.00 H new ATOM 0 HD2 PRO A 64 4.603 -16.187 -3.350 1.00 0.00 H new ATOM 0 HD3 PRO A 64 3.854 -15.463 -4.760 1.00 0.00 H new ATOM 1136 N VAL A 70 -4.474 -14.199 4.736 1.00 0.00 N ATOM 1137 CA VAL A 70 -3.339 -13.429 4.256 1.00 0.00 C ATOM 1138 C VAL A 70 -2.328 -13.256 5.392 1.00 0.00 C ATOM 1139 O VAL A 70 -1.520 -14.147 5.650 1.00 0.00 O ATOM 1140 CB VAL A 70 -3.818 -12.097 3.674 1.00 0.00 C ATOM 1141 CG1 VAL A 70 -4.972 -11.523 4.498 1.00 0.00 C ATOM 1142 CG2 VAL A 70 -2.665 -11.097 3.574 1.00 0.00 C ATOM 0 HA VAL A 70 -2.833 -13.958 3.448 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.187 -12.284 2.666 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.294 -10.577 4.063 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.805 -12.225 4.496 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.640 -11.357 5.523 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.032 -10.159 3.157 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.253 -10.917 4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.887 -11.502 2.926 1.00 0.00 H new ATOM 1152 N TYR A 71 -2.407 -12.104 6.041 1.00 0.00 N ATOM 1153 CA TYR A 71 -1.510 -11.803 7.144 1.00 0.00 C ATOM 1154 C TYR A 71 -0.063 -12.144 6.782 1.00 0.00 C ATOM 1155 O TYR A 71 0.644 -12.776 7.565 1.00 0.00 O ATOM 1156 CB TYR A 71 -1.956 -12.693 8.306 1.00 0.00 C ATOM 1157 CG TYR A 71 -3.019 -12.057 9.204 1.00 0.00 C ATOM 1158 CD1 TYR A 71 -4.063 -11.350 8.643 1.00 0.00 C ATOM 1159 CD2 TYR A 71 -2.934 -12.192 10.574 1.00 0.00 C ATOM 1160 CE1 TYR A 71 -5.064 -10.752 9.488 1.00 0.00 C ATOM 1161 CE2 TYR A 71 -3.935 -11.593 11.420 1.00 0.00 C ATOM 1162 CZ TYR A 71 -4.951 -10.904 10.835 1.00 0.00 C ATOM 1163 OH TYR A 71 -5.896 -10.339 11.633 1.00 0.00 O ATOM 0 H TYR A 71 -3.079 -11.367 5.824 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.549 -10.742 7.392 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -2.346 -13.628 7.905 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.086 -12.945 8.912 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -4.129 -11.245 7.570 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -2.118 -12.746 11.013 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -5.886 -10.196 9.062 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -3.880 -11.689 12.494 1.00 0.00 H new ATOM 0 HH TYR A 71 -5.499 -10.111 12.500 1.00 0.00 H new ATOM 1173 N GLY A 72 0.334 -11.711 5.594 1.00 0.00 N ATOM 1174 CA GLY A 72 1.684 -11.962 5.119 1.00 0.00 C ATOM 1175 C GLY A 72 2.445 -10.651 4.909 1.00 0.00 C ATOM 1176 O GLY A 72 2.414 -9.768 5.765 1.00 0.00 O ATOM 0 H GLY A 72 -0.256 -11.188 4.947 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.216 -12.584 5.838 1.00 0.00 H new ATOM 0 HA3 GLY A 72 1.646 -12.518 4.183 1.00 0.00 H new ATOM 1180 N GLU A 73 3.110 -10.566 3.766 1.00 0.00 N ATOM 1181 CA GLU A 73 3.877 -9.378 3.434 1.00 0.00 C ATOM 1182 C GLU A 73 3.720 -9.044 1.949 1.00 0.00 C ATOM 1183 O GLU A 73 3.339 -9.901 1.153 1.00 0.00 O ATOM 1184 CB GLU A 73 5.351 -9.556 3.803 1.00 0.00 C ATOM 1185 CG GLU A 73 5.508 -10.512 4.988 1.00 0.00 C ATOM 1186 CD GLU A 73 6.815 -10.245 5.738 1.00 0.00 C ATOM 1187 OE1 GLU A 73 7.845 -9.965 5.108 1.00 0.00 O ATOM 1188 OE2 GLU A 73 6.734 -10.336 7.022 1.00 0.00 O ATOM 0 H GLU A 73 3.133 -11.300 3.059 1.00 0.00 H new ATOM 0 HA GLU A 73 3.489 -8.543 4.018 1.00 0.00 H new ATOM 0 HB2 GLU A 73 5.900 -9.942 2.944 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.787 -8.588 4.052 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.664 -10.396 5.668 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.492 -11.543 4.633 1.00 0.00 H new ATOM 1196 N ILE A 74 4.023 -7.797 1.620 1.00 0.00 N ATOM 1197 CA ILE A 74 3.921 -7.339 0.245 1.00 0.00 C ATOM 1198 C ILE A 74 5.001 -6.289 -0.020 1.00 0.00 C ATOM 1199 O ILE A 74 5.076 -5.280 0.680 1.00 0.00 O ATOM 1200 CB ILE A 74 2.502 -6.850 -0.052 1.00 0.00 C ATOM 1201 CG1 ILE A 74 2.379 -6.370 -1.500 1.00 0.00 C ATOM 1202 CG2 ILE A 74 2.072 -5.773 0.946 1.00 0.00 C ATOM 1203 CD1 ILE A 74 0.945 -5.942 -1.816 1.00 0.00 C ATOM 0 H ILE A 74 4.339 -7.089 2.283 1.00 0.00 H new ATOM 0 HA ILE A 74 4.101 -8.163 -0.446 1.00 0.00 H new ATOM 0 HB ILE A 74 1.820 -7.691 0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 74 3.057 -5.534 -1.668 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.682 -7.168 -2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.060 -5.443 0.712 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.096 -6.182 1.956 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.754 -4.925 0.882 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.885 -5.605 -2.851 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.272 -6.787 -1.670 1.00 0.00 H new ATOM 0 HD13 ILE A 74 0.654 -5.128 -1.152 1.00 0.00 H new ATOM 1215 N TYR A 75 5.812 -6.562 -1.032 1.00 0.00 N ATOM 1216 CA TYR A 75 6.885 -5.654 -1.398 1.00 0.00 C ATOM 1217 C TYR A 75 6.370 -4.535 -2.306 1.00 0.00 C ATOM 1218 O TYR A 75 5.701 -4.800 -3.304 1.00 0.00 O ATOM 1219 CB TYR A 75 7.904 -6.494 -2.171 1.00 0.00 C ATOM 1220 CG TYR A 75 8.574 -7.585 -1.333 1.00 0.00 C ATOM 1221 CD1 TYR A 75 7.901 -8.759 -1.063 1.00 0.00 C ATOM 1222 CD2 TYR A 75 9.851 -7.394 -0.846 1.00 0.00 C ATOM 1223 CE1 TYR A 75 8.532 -9.786 -0.275 1.00 0.00 C ATOM 1224 CE2 TYR A 75 10.482 -8.421 -0.058 1.00 0.00 C ATOM 1225 CZ TYR A 75 9.791 -9.566 0.189 1.00 0.00 C ATOM 1226 OH TYR A 75 10.387 -10.536 0.934 1.00 0.00 O ATOM 0 H TYR A 75 5.747 -7.400 -1.610 1.00 0.00 H new ATOM 0 HA TYR A 75 7.314 -5.190 -0.510 1.00 0.00 H new ATOM 0 HB2 TYR A 75 7.406 -6.958 -3.022 1.00 0.00 H new ATOM 0 HB3 TYR A 75 8.673 -5.835 -2.573 1.00 0.00 H new ATOM 0 HD1 TYR A 75 6.901 -8.908 -1.443 1.00 0.00 H new ATOM 0 HD2 TYR A 75 10.377 -6.474 -1.056 1.00 0.00 H new ATOM 0 HE1 TYR A 75 8.017 -10.710 -0.058 1.00 0.00 H new ATOM 0 HE2 TYR A 75 11.481 -8.285 0.328 1.00 0.00 H new ATOM 0 HH TYR A 75 11.284 -10.242 1.196 1.00 0.00 H new ATOM 1236 N VAL A 76 6.703 -3.310 -1.929 1.00 0.00 N ATOM 1237 CA VAL A 76 6.283 -2.150 -2.697 1.00 0.00 C ATOM 1238 C VAL A 76 7.516 -1.342 -3.108 1.00 0.00 C ATOM 1239 O VAL A 76 8.529 -1.351 -2.410 1.00 0.00 O ATOM 1240 CB VAL A 76 5.270 -1.330 -1.895 1.00 0.00 C ATOM 1241 CG1 VAL A 76 5.280 0.135 -2.335 1.00 0.00 C ATOM 1242 CG2 VAL A 76 3.867 -1.928 -2.010 1.00 0.00 C ATOM 0 H VAL A 76 7.259 -3.095 -1.101 1.00 0.00 H new ATOM 0 HA VAL A 76 5.778 -2.460 -3.612 1.00 0.00 H new ATOM 0 HB VAL A 76 5.564 -1.367 -0.846 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.551 0.696 -1.750 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.273 0.556 -2.177 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.023 0.199 -3.392 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.166 -1.326 -1.431 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.560 -1.937 -3.056 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.874 -2.948 -1.625 1.00 0.00 H new ATOM 1252 N CYS A 77 7.389 -0.662 -4.238 1.00 0.00 N ATOM 1253 CA CYS A 77 8.480 0.149 -4.750 1.00 0.00 C ATOM 1254 C CYS A 77 7.886 1.415 -5.371 1.00 0.00 C ATOM 1255 O CYS A 77 7.399 1.387 -6.500 1.00 0.00 O ATOM 1256 CB CYS A 77 9.342 -0.626 -5.747 1.00 0.00 C ATOM 1257 SG CYS A 77 10.674 0.450 -6.392 1.00 0.00 S ATOM 0 H CYS A 77 6.547 -0.656 -4.813 1.00 0.00 H new ATOM 0 HA CYS A 77 9.147 0.424 -3.933 1.00 0.00 H new ATOM 0 HB2 CYS A 77 9.773 -1.502 -5.263 1.00 0.00 H new ATOM 0 HB3 CYS A 77 8.725 -0.988 -6.570 1.00 0.00 H new ATOM 0 HG CYS A 77 11.349 -0.192 -7.299 1.00 0.00 H new ATOM 1263 N PRO A 78 7.948 2.524 -4.587 1.00 0.00 N ATOM 1264 CA PRO A 78 7.423 3.798 -5.048 1.00 0.00 C ATOM 1265 C PRO A 78 8.356 4.434 -6.081 1.00 0.00 C ATOM 1266 O PRO A 78 8.091 5.532 -6.569 1.00 0.00 O ATOM 1267 CB PRO A 78 7.268 4.638 -3.792 1.00 0.00 C ATOM 1268 CG PRO A 78 8.142 3.978 -2.738 1.00 0.00 C ATOM 1269 CD PRO A 78 8.519 2.595 -3.245 1.00 0.00 C ATOM 0 HA PRO A 78 6.468 3.697 -5.564 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.580 5.667 -3.970 1.00 0.00 H new ATOM 0 HB3 PRO A 78 6.227 4.672 -3.471 1.00 0.00 H new ATOM 0 HG2 PRO A 78 9.036 4.574 -2.555 1.00 0.00 H new ATOM 0 HG3 PRO A 78 7.608 3.905 -1.790 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.601 2.463 -3.267 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.116 1.814 -2.601 1.00 0.00 H new ATOM 1277 N LEU A 79 9.428 3.717 -6.384 1.00 0.00 N ATOM 1278 CA LEU A 79 10.401 4.197 -7.350 1.00 0.00 C ATOM 1279 C LEU A 79 9.766 4.213 -8.742 1.00 0.00 C ATOM 1280 O LEU A 79 9.666 5.265 -9.371 1.00 0.00 O ATOM 1281 CB LEU A 79 11.687 3.372 -7.270 1.00 0.00 C ATOM 1282 CG LEU A 79 12.992 4.142 -7.489 1.00 0.00 C ATOM 1283 CD1 LEU A 79 12.943 4.945 -8.790 1.00 0.00 C ATOM 1284 CD2 LEU A 79 13.317 5.024 -6.282 1.00 0.00 C ATOM 0 H LEU A 79 9.644 2.807 -5.977 1.00 0.00 H new ATOM 0 HA LEU A 79 10.692 5.222 -7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.729 2.895 -6.291 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.630 2.574 -8.011 1.00 0.00 H new ATOM 0 HG LEU A 79 13.803 3.420 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.882 5.483 -8.921 1.00 0.00 H new ATOM 0 HD12 LEU A 79 12.792 4.267 -9.630 1.00 0.00 H new ATOM 0 HD13 LEU A 79 12.120 5.658 -8.747 1.00 0.00 H new ATOM 0 HD21 LEU A 79 14.249 5.560 -6.463 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.510 5.741 -6.127 1.00 0.00 H new ATOM 0 HD23 LEU A 79 13.424 4.401 -5.394 1.00 0.00 H new ATOM 1296 N ILE A 80 9.353 3.033 -9.183 1.00 0.00 N ATOM 1297 CA ILE A 80 8.731 2.899 -10.489 1.00 0.00 C ATOM 1298 C ILE A 80 7.344 3.543 -10.457 1.00 0.00 C ATOM 1299 O ILE A 80 6.966 4.258 -11.384 1.00 0.00 O ATOM 1300 CB ILE A 80 8.719 1.433 -10.928 1.00 0.00 C ATOM 1301 CG1 ILE A 80 10.134 0.850 -10.935 1.00 0.00 C ATOM 1302 CG2 ILE A 80 8.026 1.272 -12.283 1.00 0.00 C ATOM 1303 CD1 ILE A 80 10.323 -0.143 -9.786 1.00 0.00 C ATOM 0 H ILE A 80 9.437 2.162 -8.659 1.00 0.00 H new ATOM 0 HA ILE A 80 9.311 3.429 -11.244 1.00 0.00 H new ATOM 0 HB ILE A 80 8.140 0.864 -10.200 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.321 0.351 -11.886 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.864 1.655 -10.848 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.031 0.221 -12.572 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.997 1.623 -12.209 1.00 0.00 H new ATOM 0 HG23 ILE A 80 8.556 1.857 -13.034 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.337 -0.543 -9.814 1.00 0.00 H new ATOM 0 HD12 ILE A 80 10.159 0.365 -8.836 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.608 -0.959 -9.889 1.00 0.00 H new ATOM 1315 N VAL A 81 6.623 3.266 -9.381 1.00 0.00 N ATOM 1316 CA VAL A 81 5.285 3.810 -9.216 1.00 0.00 C ATOM 1317 C VAL A 81 5.331 5.328 -9.398 1.00 0.00 C ATOM 1318 O VAL A 81 4.457 5.906 -10.043 1.00 0.00 O ATOM 1319 CB VAL A 81 4.712 3.387 -7.862 1.00 0.00 C ATOM 1320 CG1 VAL A 81 3.351 4.041 -7.615 1.00 0.00 C ATOM 1321 CG2 VAL A 81 4.615 1.864 -7.760 1.00 0.00 C ATOM 0 H VAL A 81 6.940 2.672 -8.615 1.00 0.00 H new ATOM 0 HA VAL A 81 4.614 3.412 -9.977 1.00 0.00 H new ATOM 0 HB VAL A 81 5.395 3.732 -7.086 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.965 3.724 -6.646 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.461 5.125 -7.625 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.655 3.740 -8.398 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.205 1.590 -6.788 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.963 1.487 -8.548 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.608 1.428 -7.871 1.00 0.00 H new ATOM 1331 N GLU A 82 6.358 5.931 -8.818 1.00 0.00 N ATOM 1332 CA GLU A 82 6.529 7.371 -8.908 1.00 0.00 C ATOM 1333 C GLU A 82 6.739 7.791 -10.364 1.00 0.00 C ATOM 1334 O GLU A 82 6.045 8.674 -10.866 1.00 0.00 O ATOM 1335 CB GLU A 82 7.689 7.842 -8.029 1.00 0.00 C ATOM 1336 CG GLU A 82 7.901 9.351 -8.162 1.00 0.00 C ATOM 1337 CD GLU A 82 9.266 9.765 -7.607 1.00 0.00 C ATOM 1338 OE1 GLU A 82 10.277 9.109 -7.897 1.00 0.00 O ATOM 1339 OE2 GLU A 82 9.253 10.809 -6.850 1.00 0.00 O ATOM 0 H GLU A 82 7.080 5.448 -8.284 1.00 0.00 H new ATOM 0 HA GLU A 82 5.621 7.848 -8.540 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.486 7.590 -6.988 1.00 0.00 H new ATOM 0 HB3 GLU A 82 8.601 7.317 -8.312 1.00 0.00 H new ATOM 0 HG2 GLU A 82 7.828 9.641 -9.210 1.00 0.00 H new ATOM 0 HG3 GLU A 82 7.112 9.881 -7.629 1.00 0.00 H new ATOM 1347 N GLU A 83 7.700 7.138 -11.002 1.00 0.00 N ATOM 1348 CA GLU A 83 8.010 7.433 -12.390 1.00 0.00 C ATOM 1349 C GLU A 83 6.780 7.199 -13.270 1.00 0.00 C ATOM 1350 O GLU A 83 6.577 7.902 -14.259 1.00 0.00 O ATOM 1351 CB GLU A 83 9.198 6.599 -12.875 1.00 0.00 C ATOM 1352 CG GLU A 83 9.632 7.027 -14.279 1.00 0.00 C ATOM 1353 CD GLU A 83 11.002 7.708 -14.245 1.00 0.00 C ATOM 1354 OE1 GLU A 83 11.754 7.539 -13.274 1.00 0.00 O ATOM 1355 OE2 GLU A 83 11.275 8.434 -15.276 1.00 0.00 O ATOM 0 H GLU A 83 8.274 6.406 -10.583 1.00 0.00 H new ATOM 0 HA GLU A 83 8.291 8.484 -12.464 1.00 0.00 H new ATOM 0 HB2 GLU A 83 10.032 6.711 -12.183 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.928 5.543 -12.880 1.00 0.00 H new ATOM 0 HG2 GLU A 83 9.671 6.156 -14.933 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.893 7.709 -14.700 1.00 0.00 H new ATOM 1363 N ASN A 84 5.992 6.209 -12.879 1.00 0.00 N ATOM 1364 CA ASN A 84 4.788 5.873 -13.619 1.00 0.00 C ATOM 1365 C ASN A 84 3.711 6.922 -13.336 1.00 0.00 C ATOM 1366 O ASN A 84 2.947 7.290 -14.227 1.00 0.00 O ATOM 1367 CB ASN A 84 4.242 4.509 -13.195 1.00 0.00 C ATOM 1368 CG ASN A 84 4.681 3.414 -14.170 1.00 0.00 C ATOM 1369 OD1 ASN A 84 3.891 2.855 -14.912 1.00 0.00 O ATOM 1370 ND2 ASN A 84 5.982 3.142 -14.126 1.00 0.00 N ATOM 0 H ASN A 84 6.164 5.628 -12.058 1.00 0.00 H new ATOM 0 HA ASN A 84 5.041 5.846 -14.679 1.00 0.00 H new ATOM 0 HB2 ASN A 84 4.593 4.269 -12.191 1.00 0.00 H new ATOM 0 HB3 ASN A 84 3.154 4.547 -13.151 1.00 0.00 H new ATOM 0 HD21 ASN A 84 6.374 2.427 -14.738 1.00 0.00 H new ATOM 0 HD22 ASN A 84 6.587 3.649 -13.480 1.00 0.00 H new ATOM 1377 N ALA A 85 3.684 7.375 -12.091 1.00 0.00 N ATOM 1378 CA ALA A 85 2.713 8.374 -11.678 1.00 0.00 C ATOM 1379 C ALA A 85 3.105 9.732 -12.265 1.00 0.00 C ATOM 1380 O ALA A 85 2.245 10.573 -12.519 1.00 0.00 O ATOM 1381 CB ALA A 85 2.627 8.402 -10.151 1.00 0.00 C ATOM 0 H ALA A 85 4.319 7.068 -11.354 1.00 0.00 H new ATOM 0 HA ALA A 85 1.721 8.125 -12.056 1.00 0.00 H new ATOM 0 HB1 ALA A 85 1.899 9.151 -9.841 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.318 7.423 -9.786 1.00 0.00 H new ATOM 0 HB3 ALA A 85 3.603 8.652 -9.736 1.00 0.00 H new ATOM 1387 N ARG A 86 4.404 9.902 -12.464 1.00 0.00 N ATOM 1388 CA ARG A 86 4.920 11.143 -13.016 1.00 0.00 C ATOM 1389 C ARG A 86 4.467 11.306 -14.469 1.00 0.00 C ATOM 1390 O ARG A 86 4.178 12.417 -14.912 1.00 0.00 O ATOM 1391 CB ARG A 86 6.448 11.178 -12.959 1.00 0.00 C ATOM 1392 CG ARG A 86 6.938 11.408 -11.527 1.00 0.00 C ATOM 1393 CD ARG A 86 8.064 12.444 -11.493 1.00 0.00 C ATOM 1394 NE ARG A 86 7.522 13.790 -11.786 1.00 0.00 N ATOM 1395 CZ ARG A 86 8.240 14.930 -11.697 1.00 0.00 C ATOM 1396 NH1 ARG A 86 9.537 14.896 -11.322 1.00 0.00 N ATOM 1397 NH2 ARG A 86 7.655 16.078 -11.982 1.00 0.00 N ATOM 0 H ARG A 86 5.114 9.201 -12.253 1.00 0.00 H new ATOM 0 HA ARG A 86 4.527 11.962 -12.414 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.851 10.239 -13.339 1.00 0.00 H new ATOM 0 HB3 ARG A 86 6.822 11.971 -13.607 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.109 11.746 -10.905 1.00 0.00 H new ATOM 0 HG3 ARG A 86 7.291 10.468 -11.104 1.00 0.00 H new ATOM 0 HD2 ARG A 86 8.543 12.441 -10.514 1.00 0.00 H new ATOM 0 HD3 ARG A 86 8.830 12.185 -12.223 1.00 0.00 H new ATOM 0 HE ARG A 86 6.546 13.861 -12.073 1.00 0.00 H new ATOM 0 HH11 ARG A 86 9.981 14.004 -11.103 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.072 15.762 -11.257 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.675 16.095 -12.264 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.183 16.949 -11.920 1.00 0.00 H new ATOM 1410 N GLU A 87 4.419 10.183 -15.170 1.00 0.00 N ATOM 1411 CA GLU A 87 4.007 10.188 -16.563 1.00 0.00 C ATOM 1412 C GLU A 87 2.480 10.212 -16.665 1.00 0.00 C ATOM 1413 O GLU A 87 1.929 10.597 -17.694 1.00 0.00 O ATOM 1414 CB GLU A 87 4.587 8.985 -17.311 1.00 0.00 C ATOM 1415 CG GLU A 87 4.013 7.674 -16.770 1.00 0.00 C ATOM 1416 CD GLU A 87 4.020 6.587 -17.846 1.00 0.00 C ATOM 1417 OE1 GLU A 87 3.163 6.597 -18.742 1.00 0.00 O ATOM 1418 OE2 GLU A 87 4.959 5.711 -17.730 1.00 0.00 O ATOM 0 H GLU A 87 4.659 9.263 -14.799 1.00 0.00 H new ATOM 0 HA GLU A 87 4.398 11.090 -17.034 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.365 9.072 -18.375 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.672 8.979 -17.212 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.597 7.344 -15.911 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.994 7.837 -16.419 1.00 0.00 H new ATOM 1426 N PHE A 88 1.841 9.795 -15.582 1.00 0.00 N ATOM 1427 CA PHE A 88 0.389 9.764 -15.536 1.00 0.00 C ATOM 1428 C PHE A 88 -0.151 10.796 -14.544 1.00 0.00 C ATOM 1429 O PHE A 88 -1.327 10.763 -14.186 1.00 0.00 O ATOM 1430 CB PHE A 88 -0.014 8.364 -15.068 1.00 0.00 C ATOM 1431 CG PHE A 88 -1.235 7.793 -15.792 1.00 0.00 C ATOM 1432 CD1 PHE A 88 -1.085 7.172 -16.993 1.00 0.00 C ATOM 1433 CD2 PHE A 88 -2.471 7.907 -15.235 1.00 0.00 C ATOM 1434 CE1 PHE A 88 -2.219 6.643 -17.664 1.00 0.00 C ATOM 1435 CE2 PHE A 88 -3.604 7.377 -15.907 1.00 0.00 C ATOM 1436 CZ PHE A 88 -3.454 6.756 -17.107 1.00 0.00 C ATOM 0 H PHE A 88 2.302 9.476 -14.730 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.019 9.997 -16.519 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.829 7.688 -15.210 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.220 8.395 -13.998 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.104 7.081 -17.436 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -2.590 8.401 -14.282 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.100 6.150 -18.618 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.585 7.467 -15.465 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.316 6.352 -17.618 1.00 0.00 H new ATOM 1446 N ASN A 89 0.735 11.688 -14.127 1.00 0.00 N ATOM 1447 CA ASN A 89 0.363 12.728 -13.182 1.00 0.00 C ATOM 1448 C ASN A 89 -0.568 12.137 -12.121 1.00 0.00 C ATOM 1449 O ASN A 89 -1.420 12.839 -11.578 1.00 0.00 O ATOM 1450 CB ASN A 89 -0.381 13.867 -13.882 1.00 0.00 C ATOM 1451 CG ASN A 89 -0.161 15.195 -13.154 1.00 0.00 C ATOM 1452 OD1 ASN A 89 0.352 16.156 -13.703 1.00 0.00 O ATOM 1453 ND2 ASN A 89 -0.576 15.194 -11.891 1.00 0.00 N ATOM 0 H ASN A 89 1.710 11.712 -14.426 1.00 0.00 H new ATOM 0 HA ASN A 89 1.276 13.117 -12.731 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -0.037 13.952 -14.913 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -1.447 13.641 -13.920 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -0.473 16.033 -11.320 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -0.997 14.355 -11.493 1.00 0.00 H new ATOM 1460 N ASN A 90 -0.372 10.854 -11.857 1.00 0.00 N ATOM 1461 CA ASN A 90 -1.183 10.161 -10.870 1.00 0.00 C ATOM 1462 C ASN A 90 -0.716 10.552 -9.467 1.00 0.00 C ATOM 1463 O ASN A 90 0.307 11.217 -9.312 1.00 0.00 O ATOM 1464 CB ASN A 90 -1.044 8.644 -11.010 1.00 0.00 C ATOM 1465 CG ASN A 90 -2.201 7.921 -10.316 1.00 0.00 C ATOM 1466 OD1 ASN A 90 -3.367 8.201 -10.542 1.00 0.00 O ATOM 1467 ND2 ASN A 90 -1.815 6.978 -9.462 1.00 0.00 N ATOM 0 H ASN A 90 0.336 10.276 -12.309 1.00 0.00 H new ATOM 0 HA ASN A 90 -2.224 10.444 -11.030 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -1.022 8.373 -12.066 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -0.097 8.321 -10.578 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.512 6.438 -8.949 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -0.822 6.794 -9.320 1.00 0.00 H new ATOM 1474 N THR A 91 -1.487 10.121 -8.479 1.00 0.00 N ATOM 1475 CA THR A 91 -1.165 10.418 -7.094 1.00 0.00 C ATOM 1476 C THR A 91 -0.208 9.364 -6.532 1.00 0.00 C ATOM 1477 O THR A 91 -0.637 8.286 -6.123 1.00 0.00 O ATOM 1478 CB THR A 91 -2.477 10.524 -6.315 1.00 0.00 C ATOM 1479 OG1 THR A 91 -3.323 9.554 -6.926 1.00 0.00 O ATOM 1480 CG2 THR A 91 -3.197 11.852 -6.559 1.00 0.00 C ATOM 0 H THR A 91 -2.334 9.568 -8.611 1.00 0.00 H new ATOM 0 HA THR A 91 -0.640 11.369 -7.005 1.00 0.00 H new ATOM 0 HB THR A 91 -2.277 10.410 -5.250 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.259 9.759 -6.719 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.122 11.876 -5.983 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.555 12.676 -6.249 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.428 11.951 -7.620 1.00 0.00 H new ATOM 1488 N PHE A 92 1.070 9.713 -6.529 1.00 0.00 N ATOM 1489 CA PHE A 92 2.091 8.810 -6.024 1.00 0.00 C ATOM 1490 C PHE A 92 1.694 8.243 -4.659 1.00 0.00 C ATOM 1491 O PHE A 92 2.060 7.119 -4.320 1.00 0.00 O ATOM 1492 CB PHE A 92 3.374 9.628 -5.869 1.00 0.00 C ATOM 1493 CG PHE A 92 4.408 8.994 -4.937 1.00 0.00 C ATOM 1494 CD1 PHE A 92 4.212 9.011 -3.592 1.00 0.00 C ATOM 1495 CD2 PHE A 92 5.524 8.413 -5.454 1.00 0.00 C ATOM 1496 CE1 PHE A 92 5.172 8.422 -2.726 1.00 0.00 C ATOM 1497 CE2 PHE A 92 6.484 7.824 -4.589 1.00 0.00 C ATOM 1498 CZ PHE A 92 6.287 7.841 -3.244 1.00 0.00 C ATOM 0 H PHE A 92 1.422 10.608 -6.868 1.00 0.00 H new ATOM 0 HA PHE A 92 2.222 7.974 -6.711 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.824 9.769 -6.852 1.00 0.00 H new ATOM 0 HB3 PHE A 92 3.118 10.618 -5.491 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.326 9.472 -3.181 1.00 0.00 H new ATOM 0 HD2 PHE A 92 5.680 8.400 -6.523 1.00 0.00 H new ATOM 0 HE1 PHE A 92 5.016 8.436 -1.657 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.370 7.363 -4.999 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.017 7.393 -2.586 1.00 0.00 H new ATOM 1508 N GLU A 93 0.951 9.047 -3.913 1.00 0.00 N ATOM 1509 CA GLU A 93 0.501 8.640 -2.593 1.00 0.00 C ATOM 1510 C GLU A 93 -0.662 7.653 -2.710 1.00 0.00 C ATOM 1511 O GLU A 93 -0.755 6.702 -1.935 1.00 0.00 O ATOM 1512 CB GLU A 93 0.108 9.854 -1.749 1.00 0.00 C ATOM 1513 CG GLU A 93 -0.786 10.808 -2.543 1.00 0.00 C ATOM 1514 CD GLU A 93 -0.066 12.129 -2.821 1.00 0.00 C ATOM 1515 OE1 GLU A 93 0.027 12.984 -1.928 1.00 0.00 O ATOM 1516 OE2 GLU A 93 0.407 12.251 -4.015 1.00 0.00 O ATOM 0 H GLU A 93 0.649 9.979 -4.198 1.00 0.00 H new ATOM 0 HA GLU A 93 1.327 8.140 -2.087 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -0.414 9.523 -0.851 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.005 10.379 -1.421 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.075 10.342 -3.485 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.704 11.000 -1.987 1.00 0.00 H new ATOM 1524 N LYS A 94 -1.521 7.913 -3.684 1.00 0.00 N ATOM 1525 CA LYS A 94 -2.675 7.060 -3.913 1.00 0.00 C ATOM 1526 C LYS A 94 -2.202 5.692 -4.409 1.00 0.00 C ATOM 1527 O LYS A 94 -2.589 4.661 -3.862 1.00 0.00 O ATOM 1528 CB LYS A 94 -3.670 7.744 -4.852 1.00 0.00 C ATOM 1529 CG LYS A 94 -5.072 7.154 -4.689 1.00 0.00 C ATOM 1530 CD LYS A 94 -5.369 6.133 -5.790 1.00 0.00 C ATOM 1531 CE LYS A 94 -5.329 6.790 -7.171 1.00 0.00 C ATOM 1532 NZ LYS A 94 -6.380 6.222 -8.045 1.00 0.00 N ATOM 0 H LYS A 94 -1.441 8.703 -4.324 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.215 6.893 -2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.695 8.814 -4.644 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.340 7.628 -5.884 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.158 6.677 -3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -5.813 7.953 -4.720 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.640 5.324 -5.747 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.350 5.688 -5.623 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.472 7.866 -7.073 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.349 6.638 -7.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.205 6.509 -9.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.363 5.184 -7.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.311 6.573 -7.742 1.00 0.00 H new ATOM 1545 N GLU A 95 -1.371 5.728 -5.441 1.00 0.00 N ATOM 1546 CA GLU A 95 -0.842 4.504 -6.018 1.00 0.00 C ATOM 1547 C GLU A 95 -0.178 3.651 -4.935 1.00 0.00 C ATOM 1548 O GLU A 95 -0.360 2.435 -4.899 1.00 0.00 O ATOM 1549 CB GLU A 95 0.139 4.811 -7.151 1.00 0.00 C ATOM 1550 CG GLU A 95 -0.402 4.315 -8.494 1.00 0.00 C ATOM 1551 CD GLU A 95 -0.388 2.786 -8.559 1.00 0.00 C ATOM 1552 OE1 GLU A 95 0.338 2.139 -7.790 1.00 0.00 O ATOM 1553 OE2 GLU A 95 -1.169 2.272 -9.448 1.00 0.00 O ATOM 0 H GLU A 95 -1.051 6.585 -5.892 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.671 3.938 -6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.318 5.885 -7.201 1.00 0.00 H new ATOM 0 HB3 GLU A 95 1.099 4.338 -6.944 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.419 4.679 -8.638 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.200 4.723 -9.306 1.00 0.00 H new ATOM 1561 N LEU A 96 0.578 4.322 -4.078 1.00 0.00 N ATOM 1562 CA LEU A 96 1.270 3.641 -2.997 1.00 0.00 C ATOM 1563 C LEU A 96 0.256 3.225 -1.931 1.00 0.00 C ATOM 1564 O LEU A 96 0.445 2.219 -1.247 1.00 0.00 O ATOM 1565 CB LEU A 96 2.408 4.510 -2.458 1.00 0.00 C ATOM 1566 CG LEU A 96 2.912 4.160 -1.056 1.00 0.00 C ATOM 1567 CD1 LEU A 96 1.945 4.666 0.016 1.00 0.00 C ATOM 1568 CD2 LEU A 96 3.177 2.659 -0.927 1.00 0.00 C ATOM 0 H LEU A 96 0.726 5.331 -4.111 1.00 0.00 H new ATOM 0 HA LEU A 96 1.742 2.729 -3.362 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.247 4.446 -3.151 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.076 5.548 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 96 3.863 4.669 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.327 4.404 1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.851 5.749 -0.061 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.968 4.206 -0.129 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.534 2.438 0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.254 2.109 -1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.932 2.359 -1.654 1.00 0.00 H new ATOM 1580 N LEU A 97 -0.799 4.019 -1.821 1.00 0.00 N ATOM 1581 CA LEU A 97 -1.844 3.745 -0.849 1.00 0.00 C ATOM 1582 C LEU A 97 -2.528 2.422 -1.200 1.00 0.00 C ATOM 1583 O LEU A 97 -2.899 1.656 -0.312 1.00 0.00 O ATOM 1584 CB LEU A 97 -2.809 4.929 -0.752 1.00 0.00 C ATOM 1585 CG LEU A 97 -2.735 5.751 0.536 1.00 0.00 C ATOM 1586 CD1 LEU A 97 -1.956 7.049 0.314 1.00 0.00 C ATOM 1587 CD2 LEU A 97 -4.133 6.010 1.102 1.00 0.00 C ATOM 0 H LEU A 97 -0.953 4.852 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.416 3.629 0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.622 5.594 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.826 4.553 -0.862 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.189 5.172 1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.918 7.615 1.245 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.942 6.814 -0.009 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.452 7.645 -0.452 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.052 6.596 2.017 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.726 6.559 0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -4.618 5.059 1.322 1.00 0.00 H new ATOM 1599 N GLU A 98 -2.673 2.193 -2.497 1.00 0.00 N ATOM 1600 CA GLU A 98 -3.305 0.976 -2.976 1.00 0.00 C ATOM 1601 C GLU A 98 -2.548 -0.252 -2.465 1.00 0.00 C ATOM 1602 O GLU A 98 -3.131 -1.121 -1.820 1.00 0.00 O ATOM 1603 CB GLU A 98 -3.394 0.968 -4.503 1.00 0.00 C ATOM 1604 CG GLU A 98 -4.562 1.829 -4.989 1.00 0.00 C ATOM 1605 CD GLU A 98 -4.650 1.822 -6.516 1.00 0.00 C ATOM 1606 OE1 GLU A 98 -3.614 1.827 -7.197 1.00 0.00 O ATOM 1607 OE2 GLU A 98 -5.849 1.811 -6.993 1.00 0.00 O ATOM 0 H GLU A 98 -2.363 2.830 -3.231 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.322 0.941 -2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.462 1.341 -4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.519 -0.055 -4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.494 1.456 -4.566 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.437 2.852 -4.633 1.00 0.00 H new ATOM 1615 N VAL A 99 -1.259 -0.284 -2.773 1.00 0.00 N ATOM 1616 CA VAL A 99 -0.417 -1.390 -2.353 1.00 0.00 C ATOM 1617 C VAL A 99 -0.438 -1.491 -0.826 1.00 0.00 C ATOM 1618 O VAL A 99 -0.168 -2.552 -0.267 1.00 0.00 O ATOM 1619 CB VAL A 99 0.994 -1.219 -2.921 1.00 0.00 C ATOM 1620 CG1 VAL A 99 0.972 -1.224 -4.451 1.00 0.00 C ATOM 1621 CG2 VAL A 99 1.649 0.055 -2.387 1.00 0.00 C ATOM 0 H VAL A 99 -0.778 0.439 -3.309 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.800 -2.332 -2.746 1.00 0.00 H new ATOM 0 HB VAL A 99 1.594 -2.067 -2.591 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.987 -1.101 -4.830 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.564 -2.171 -4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.349 -0.404 -4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.650 0.152 -2.806 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.050 0.920 -2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.714 0.003 -1.300 1.00 0.00 H new ATOM 1631 N VAL A 100 -0.761 -0.371 -0.196 1.00 0.00 N ATOM 1632 CA VAL A 100 -0.820 -0.320 1.255 1.00 0.00 C ATOM 1633 C VAL A 100 -2.102 -1.006 1.733 1.00 0.00 C ATOM 1634 O VAL A 100 -2.048 -1.959 2.508 1.00 0.00 O ATOM 1635 CB VAL A 100 -0.704 1.129 1.733 1.00 0.00 C ATOM 1636 CG1 VAL A 100 -1.485 1.343 3.031 1.00 0.00 C ATOM 1637 CG2 VAL A 100 0.762 1.534 1.902 1.00 0.00 C ATOM 0 H VAL A 100 -0.984 0.508 -0.663 1.00 0.00 H new ATOM 0 HA VAL A 100 0.020 -0.860 1.691 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.143 1.770 0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.386 2.381 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.537 1.114 2.864 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -1.089 0.687 3.806 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.817 2.568 2.242 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.237 0.884 2.637 1.00 0.00 H new ATOM 0 HG23 VAL A 100 1.278 1.439 0.947 1.00 0.00 H new ATOM 1647 N ILE A 101 -3.225 -0.493 1.251 1.00 0.00 N ATOM 1648 CA ILE A 101 -4.518 -1.044 1.619 1.00 0.00 C ATOM 1649 C ILE A 101 -4.667 -2.437 1.005 1.00 0.00 C ATOM 1650 O ILE A 101 -5.505 -3.225 1.442 1.00 0.00 O ATOM 1651 CB ILE A 101 -5.640 -0.078 1.235 1.00 0.00 C ATOM 1652 CG1 ILE A 101 -5.696 0.122 -0.281 1.00 0.00 C ATOM 1653 CG2 ILE A 101 -5.503 1.249 1.984 1.00 0.00 C ATOM 1654 CD1 ILE A 101 -6.947 0.905 -0.685 1.00 0.00 C ATOM 0 H ILE A 101 -3.266 0.298 0.609 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.588 -1.163 2.700 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.589 -0.520 1.537 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -4.806 0.655 -0.614 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -5.692 -0.847 -0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.313 1.917 1.692 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.551 1.067 3.058 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -4.546 1.709 1.737 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.962 1.033 -1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -7.836 0.357 -0.372 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -6.935 1.883 -0.204 1.00 0.00 H new ATOM 1666 N HIS A 102 -3.842 -2.698 0.002 1.00 0.00 N ATOM 1667 CA HIS A 102 -3.872 -3.983 -0.677 1.00 0.00 C ATOM 1668 C HIS A 102 -3.677 -5.106 0.343 1.00 0.00 C ATOM 1669 O HIS A 102 -4.371 -6.121 0.294 1.00 0.00 O ATOM 1670 CB HIS A 102 -2.843 -4.024 -1.808 1.00 0.00 C ATOM 1671 CG HIS A 102 -3.449 -4.130 -3.187 1.00 0.00 C ATOM 1672 ND1 HIS A 102 -2.740 -3.852 -4.342 1.00 0.00 N ATOM 1673 CD2 HIS A 102 -4.705 -4.488 -3.583 1.00 0.00 C ATOM 1674 CE1 HIS A 102 -3.542 -4.036 -5.380 1.00 0.00 C ATOM 1675 NE2 HIS A 102 -4.759 -4.430 -4.908 1.00 0.00 N ATOM 0 H HIS A 102 -3.149 -2.042 -0.357 1.00 0.00 H new ATOM 0 HA HIS A 102 -4.846 -4.129 -1.145 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.230 -3.124 -1.760 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -2.177 -4.872 -1.649 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -5.517 -4.770 -2.929 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -3.278 -3.898 -6.418 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -5.576 -4.645 -5.479 1.00 0.00 H new ATOM 1683 N GLY A 103 -2.729 -4.888 1.243 1.00 0.00 N ATOM 1684 CA GLY A 103 -2.434 -5.870 2.273 1.00 0.00 C ATOM 1685 C GLY A 103 -3.644 -6.089 3.184 1.00 0.00 C ATOM 1686 O GLY A 103 -4.007 -7.227 3.476 1.00 0.00 O ATOM 0 H GLY A 103 -2.155 -4.046 1.280 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.148 -6.814 1.809 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -1.583 -5.535 2.867 1.00 0.00 H new ATOM 1690 N ILE A 104 -4.233 -4.980 3.608 1.00 0.00 N ATOM 1691 CA ILE A 104 -5.394 -5.037 4.480 1.00 0.00 C ATOM 1692 C ILE A 104 -6.589 -5.582 3.696 1.00 0.00 C ATOM 1693 O ILE A 104 -7.357 -6.392 4.213 1.00 0.00 O ATOM 1694 CB ILE A 104 -5.650 -3.671 5.120 1.00 0.00 C ATOM 1695 CG1 ILE A 104 -4.631 -3.384 6.225 1.00 0.00 C ATOM 1696 CG2 ILE A 104 -7.090 -3.563 5.626 1.00 0.00 C ATOM 1697 CD1 ILE A 104 -4.710 -1.924 6.678 1.00 0.00 C ATOM 0 H ILE A 104 -3.928 -4.038 3.364 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.216 -5.723 5.308 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.520 -2.906 4.355 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -4.815 -4.042 7.074 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.626 -3.603 5.864 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.245 -2.582 6.076 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -7.779 -3.692 4.792 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.273 -4.337 6.371 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.976 -1.747 7.464 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.502 -1.269 5.832 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.709 -1.715 7.061 1.00 0.00 H new ATOM 1709 N LEU A 105 -6.709 -5.116 2.462 1.00 0.00 N ATOM 1710 CA LEU A 105 -7.798 -5.548 1.602 1.00 0.00 C ATOM 1711 C LEU A 105 -7.879 -7.075 1.615 1.00 0.00 C ATOM 1712 O LEU A 105 -8.970 -7.643 1.631 1.00 0.00 O ATOM 1713 CB LEU A 105 -7.642 -4.952 0.201 1.00 0.00 C ATOM 1714 CG LEU A 105 -8.336 -3.610 -0.038 1.00 0.00 C ATOM 1715 CD1 LEU A 105 -7.351 -2.573 -0.582 1.00 0.00 C ATOM 1716 CD2 LEU A 105 -9.554 -3.776 -0.949 1.00 0.00 C ATOM 0 H LEU A 105 -6.070 -4.444 2.037 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.751 -5.176 1.978 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.578 -4.830 -0.004 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -8.026 -5.671 -0.523 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.699 -3.238 0.920 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -7.870 -1.628 -0.743 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -6.544 -2.426 0.136 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.937 -2.925 -1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -10.028 -2.807 -1.102 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -9.237 -4.181 -1.910 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.265 -4.459 -0.484 1.00 0.00 H new ATOM 1728 N HIS A 106 -6.709 -7.698 1.609 1.00 0.00 N ATOM 1729 CA HIS A 106 -6.633 -9.149 1.620 1.00 0.00 C ATOM 1730 C HIS A 106 -7.438 -9.695 2.801 1.00 0.00 C ATOM 1731 O HIS A 106 -8.449 -10.369 2.609 1.00 0.00 O ATOM 1732 CB HIS A 106 -5.177 -9.617 1.628 1.00 0.00 C ATOM 1733 CG HIS A 106 -4.497 -9.530 0.282 1.00 0.00 C ATOM 1734 ND1 HIS A 106 -3.374 -10.273 -0.039 1.00 0.00 N ATOM 1735 CD2 HIS A 106 -4.792 -8.782 -0.819 1.00 0.00 C ATOM 1736 CE1 HIS A 106 -3.018 -9.976 -1.281 1.00 0.00 C ATOM 1737 NE2 HIS A 106 -3.898 -9.052 -1.762 1.00 0.00 N ATOM 0 H HIS A 106 -5.806 -7.224 1.597 1.00 0.00 H new ATOM 0 HA HIS A 106 -7.076 -9.547 0.707 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.617 -9.018 2.346 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -5.140 -10.649 1.977 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -5.614 -8.087 -0.909 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.178 -10.393 -1.818 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -3.873 -8.637 -2.693 1.00 0.00 H new ATOM 1745 N LEU A 107 -6.959 -9.385 3.997 1.00 0.00 N ATOM 1746 CA LEU A 107 -7.621 -9.837 5.209 1.00 0.00 C ATOM 1747 C LEU A 107 -9.026 -9.237 5.271 1.00 0.00 C ATOM 1748 O LEU A 107 -9.935 -9.834 5.846 1.00 0.00 O ATOM 1749 CB LEU A 107 -6.763 -9.524 6.436 1.00 0.00 C ATOM 1750 CG LEU A 107 -6.382 -8.055 6.631 1.00 0.00 C ATOM 1751 CD1 LEU A 107 -7.512 -7.281 7.313 1.00 0.00 C ATOM 1752 CD2 LEU A 107 -5.060 -7.927 7.390 1.00 0.00 C ATOM 0 H LEU A 107 -6.120 -8.826 4.153 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.737 -10.921 5.199 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.298 -9.861 7.324 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.847 -10.111 6.373 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.233 -7.608 5.648 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.215 -6.240 7.440 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.410 -7.330 6.697 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.717 -7.721 8.289 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -4.813 -6.873 7.515 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.156 -8.396 8.369 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.268 -8.421 6.827 1.00 0.00 H new ATOM 1764 N ALA A 108 -9.161 -8.063 4.671 1.00 0.00 N ATOM 1765 CA ALA A 108 -10.441 -7.375 4.651 1.00 0.00 C ATOM 1766 C ALA A 108 -11.488 -8.275 3.992 1.00 0.00 C ATOM 1767 O ALA A 108 -12.688 -8.060 4.156 1.00 0.00 O ATOM 1768 CB ALA A 108 -10.289 -6.034 3.931 1.00 0.00 C ATOM 0 H ALA A 108 -8.405 -7.571 4.195 1.00 0.00 H new ATOM 0 HA ALA A 108 -10.779 -7.164 5.665 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -11.249 -5.518 3.916 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -9.556 -5.421 4.455 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -9.954 -6.206 2.908 1.00 0.00 H new ATOM 1774 N GLY A 109 -10.996 -9.265 3.261 1.00 0.00 N ATOM 1775 CA GLY A 109 -11.875 -10.198 2.577 1.00 0.00 C ATOM 1776 C GLY A 109 -12.138 -9.750 1.138 1.00 0.00 C ATOM 1777 O GLY A 109 -12.461 -8.588 0.896 1.00 0.00 O ATOM 0 H GLY A 109 -10.000 -9.441 3.128 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.427 -11.191 2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.819 -10.275 3.116 1.00 0.00 H new ATOM 1997 N PHE A 123 -11.282 -2.957 -7.234 1.00 0.00 N ATOM 1998 CA PHE A 123 -10.939 -1.554 -7.387 1.00 0.00 C ATOM 1999 C PHE A 123 -11.856 -0.669 -6.539 1.00 0.00 C ATOM 2000 O PHE A 123 -11.399 0.291 -5.921 1.00 0.00 O ATOM 2001 CB PHE A 123 -11.137 -1.204 -8.864 1.00 0.00 C ATOM 2002 CG PHE A 123 -10.741 0.229 -9.222 1.00 0.00 C ATOM 2003 CD1 PHE A 123 -11.541 1.267 -8.858 1.00 0.00 C ATOM 2004 CD2 PHE A 123 -9.589 0.466 -9.905 1.00 0.00 C ATOM 2005 CE1 PHE A 123 -11.174 2.598 -9.191 1.00 0.00 C ATOM 2006 CE2 PHE A 123 -9.222 1.797 -10.238 1.00 0.00 C ATOM 2007 CZ PHE A 123 -10.022 2.835 -9.873 1.00 0.00 C ATOM 0 HA PHE A 123 -9.913 -1.385 -7.062 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -10.552 -1.894 -9.472 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -12.184 -1.357 -9.126 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -12.456 1.079 -8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.953 -0.358 -10.194 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -11.810 3.422 -8.902 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.308 1.985 -10.781 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.742 3.847 -10.125 1.00 0.00 H new ATOM 2017 N GLU A 124 -13.132 -1.024 -6.538 1.00 0.00 N ATOM 2018 CA GLU A 124 -14.116 -0.275 -5.776 1.00 0.00 C ATOM 2019 C GLU A 124 -13.801 -0.351 -4.281 1.00 0.00 C ATOM 2020 O GLU A 124 -13.603 0.674 -3.631 1.00 0.00 O ATOM 2021 CB GLU A 124 -15.532 -0.778 -6.064 1.00 0.00 C ATOM 2022 CG GLU A 124 -15.998 -0.339 -7.454 1.00 0.00 C ATOM 2023 CD GLU A 124 -17.437 0.179 -7.411 1.00 0.00 C ATOM 2024 OE1 GLU A 124 -17.686 1.274 -6.886 1.00 0.00 O ATOM 2025 OE2 GLU A 124 -18.313 -0.600 -7.949 1.00 0.00 O ATOM 0 H GLU A 124 -13.507 -1.821 -7.053 1.00 0.00 H new ATOM 0 HA GLU A 124 -14.067 0.769 -6.085 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -15.556 -1.866 -5.995 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -16.218 -0.395 -5.309 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -15.338 0.441 -7.833 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -15.930 -1.178 -8.146 1.00 0.00 H new ATOM 2033 N LYS A 125 -13.764 -1.577 -3.778 1.00 0.00 N ATOM 2034 CA LYS A 125 -13.476 -1.800 -2.372 1.00 0.00 C ATOM 2035 C LYS A 125 -12.082 -1.258 -2.049 1.00 0.00 C ATOM 2036 O LYS A 125 -11.799 -0.906 -0.905 1.00 0.00 O ATOM 2037 CB LYS A 125 -13.659 -3.277 -2.016 1.00 0.00 C ATOM 2038 CG LYS A 125 -13.872 -3.455 -0.511 1.00 0.00 C ATOM 2039 CD LYS A 125 -15.131 -4.279 -0.230 1.00 0.00 C ATOM 2040 CE LYS A 125 -14.803 -5.771 -0.149 1.00 0.00 C ATOM 2041 NZ LYS A 125 -16.045 -6.576 -0.147 1.00 0.00 N ATOM 0 H LYS A 125 -13.929 -2.426 -4.320 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.183 -1.255 -1.747 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -14.513 -3.683 -2.558 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -12.783 -3.843 -2.332 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -13.004 -3.949 -0.073 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -13.958 -2.479 -0.034 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -15.583 -3.951 0.706 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -15.866 -4.107 -1.016 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -14.178 -6.058 -0.995 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -14.229 -5.975 0.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -15.804 -7.586 -0.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -16.627 -6.314 0.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -16.578 -6.395 -1.022 1.00 0.00 H new ATOM 2054 N GLN A 126 -11.248 -1.208 -3.077 1.00 0.00 N ATOM 2055 CA GLN A 126 -9.891 -0.715 -2.917 1.00 0.00 C ATOM 2056 C GLN A 126 -9.882 0.815 -2.893 1.00 0.00 C ATOM 2057 O GLN A 126 -9.053 1.424 -2.219 1.00 0.00 O ATOM 2058 CB GLN A 126 -8.978 -1.251 -4.022 1.00 0.00 C ATOM 2059 CG GLN A 126 -7.712 -0.401 -4.148 1.00 0.00 C ATOM 2060 CD GLN A 126 -6.629 -1.145 -4.932 1.00 0.00 C ATOM 2061 OE1 GLN A 126 -5.839 -1.898 -4.388 1.00 0.00 O ATOM 2062 NE2 GLN A 126 -6.637 -0.892 -6.238 1.00 0.00 N ATOM 0 H GLN A 126 -11.486 -1.501 -4.025 1.00 0.00 H new ATOM 0 HA GLN A 126 -9.504 -1.077 -1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -8.707 -2.284 -3.805 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -9.514 -1.255 -4.971 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -7.948 0.538 -4.648 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.339 -0.148 -3.156 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -7.327 -0.250 -6.629 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -5.953 -1.340 -6.848 1.00 0.00 H new ATOM 2071 N LYS A 127 -10.813 1.393 -3.638 1.00 0.00 N ATOM 2072 CA LYS A 127 -10.923 2.840 -3.711 1.00 0.00 C ATOM 2073 C LYS A 127 -11.628 3.357 -2.456 1.00 0.00 C ATOM 2074 O LYS A 127 -11.557 4.545 -2.145 1.00 0.00 O ATOM 2075 CB LYS A 127 -11.601 3.261 -5.016 1.00 0.00 C ATOM 2076 CG LYS A 127 -10.619 3.993 -5.933 1.00 0.00 C ATOM 2077 CD LYS A 127 -10.831 5.507 -5.865 1.00 0.00 C ATOM 2078 CE LYS A 127 -9.567 6.257 -6.289 1.00 0.00 C ATOM 2079 NZ LYS A 127 -9.345 7.433 -5.419 1.00 0.00 N ATOM 0 H LYS A 127 -11.499 0.885 -4.197 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.934 3.297 -3.732 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -11.994 2.381 -5.526 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -12.450 3.908 -4.796 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.596 3.752 -5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.749 3.650 -6.959 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.661 5.791 -6.512 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -11.105 5.794 -4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.706 5.590 -6.236 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.658 6.577 -7.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -8.483 7.930 -5.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.159 8.076 -5.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -9.237 7.120 -4.433 1.00 0.00 H new ATOM 2092 N LYS A 128 -12.294 2.440 -1.769 1.00 0.00 N ATOM 2093 CA LYS A 128 -13.012 2.789 -0.555 1.00 0.00 C ATOM 2094 C LYS A 128 -12.008 3.187 0.529 1.00 0.00 C ATOM 2095 O LYS A 128 -12.042 4.310 1.029 1.00 0.00 O ATOM 2096 CB LYS A 128 -13.947 1.651 -0.140 1.00 0.00 C ATOM 2097 CG LYS A 128 -15.175 2.192 0.596 1.00 0.00 C ATOM 2098 CD LYS A 128 -16.347 1.214 0.497 1.00 0.00 C ATOM 2099 CE LYS A 128 -17.486 1.806 -0.335 1.00 0.00 C ATOM 2100 NZ LYS A 128 -17.828 0.906 -1.459 1.00 0.00 N ATOM 0 H LYS A 128 -12.351 1.456 -2.030 1.00 0.00 H new ATOM 0 HA LYS A 128 -13.655 3.652 -0.727 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -14.263 1.095 -1.023 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -13.412 0.952 0.503 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -14.929 2.365 1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -15.463 3.154 0.173 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.009 0.281 0.046 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.709 0.973 1.496 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.362 1.960 0.295 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -17.194 2.783 -0.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -18.603 1.322 -2.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -16.995 0.780 -2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.127 -0.017 -1.086 1.00 0.00 H new ATOM 2113 N TYR A 129 -11.140 2.243 0.862 1.00 0.00 N ATOM 2114 CA TYR A 129 -10.129 2.481 1.878 1.00 0.00 C ATOM 2115 C TYR A 129 -9.113 3.525 1.407 1.00 0.00 C ATOM 2116 O TYR A 129 -8.587 4.291 2.213 1.00 0.00 O ATOM 2117 CB TYR A 129 -9.412 1.145 2.080 1.00 0.00 C ATOM 2118 CG TYR A 129 -10.352 -0.058 2.177 1.00 0.00 C ATOM 2119 CD1 TYR A 129 -11.515 0.033 2.915 1.00 0.00 C ATOM 2120 CD2 TYR A 129 -10.038 -1.233 1.525 1.00 0.00 C ATOM 2121 CE1 TYR A 129 -12.400 -1.099 3.005 1.00 0.00 C ATOM 2122 CE2 TYR A 129 -10.924 -2.365 1.616 1.00 0.00 C ATOM 2123 CZ TYR A 129 -12.061 -2.242 2.351 1.00 0.00 C ATOM 2124 OH TYR A 129 -12.897 -3.311 2.436 1.00 0.00 O ATOM 0 H TYR A 129 -11.116 1.312 0.446 1.00 0.00 H new ATOM 0 HA TYR A 129 -10.586 2.853 2.795 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -8.721 0.987 1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -8.814 1.200 2.989 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.761 0.953 3.425 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -9.129 -1.304 0.947 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.313 -1.042 3.579 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.690 -3.291 1.112 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.819 -2.997 2.548 1.00 0.00 H new ATOM 2134 N VAL A 130 -8.869 3.521 0.105 1.00 0.00 N ATOM 2135 CA VAL A 130 -7.927 4.458 -0.482 1.00 0.00 C ATOM 2136 C VAL A 130 -8.363 5.887 -0.154 1.00 0.00 C ATOM 2137 O VAL A 130 -7.580 6.672 0.379 1.00 0.00 O ATOM 2138 CB VAL A 130 -7.802 4.202 -1.986 1.00 0.00 C ATOM 2139 CG1 VAL A 130 -7.905 5.508 -2.775 1.00 0.00 C ATOM 2140 CG2 VAL A 130 -6.500 3.466 -2.310 1.00 0.00 C ATOM 0 H VAL A 130 -9.307 2.884 -0.560 1.00 0.00 H new ATOM 0 HA VAL A 130 -6.933 4.316 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.632 3.563 -2.287 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.813 5.298 -3.841 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.870 5.976 -2.580 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.106 6.183 -2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.436 3.296 -3.385 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.651 4.068 -1.986 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.484 2.508 -1.790 1.00 0.00 H new ATOM 2150 N GLU A 131 -9.612 6.182 -0.485 1.00 0.00 N ATOM 2151 CA GLU A 131 -10.161 7.503 -0.232 1.00 0.00 C ATOM 2152 C GLU A 131 -10.215 7.776 1.272 1.00 0.00 C ATOM 2153 O GLU A 131 -10.046 8.914 1.706 1.00 0.00 O ATOM 2154 CB GLU A 131 -11.546 7.651 -0.866 1.00 0.00 C ATOM 2155 CG GLU A 131 -11.448 7.698 -2.392 1.00 0.00 C ATOM 2156 CD GLU A 131 -11.881 9.064 -2.928 1.00 0.00 C ATOM 2157 OE1 GLU A 131 -11.052 9.807 -3.474 1.00 0.00 O ATOM 2158 OE2 GLU A 131 -13.129 9.344 -2.762 1.00 0.00 O ATOM 0 H GLU A 131 -10.259 5.529 -0.926 1.00 0.00 H new ATOM 0 HA GLU A 131 -9.505 8.242 -0.692 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -12.179 6.817 -0.564 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -12.022 8.561 -0.500 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -10.423 7.491 -2.701 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -12.075 6.918 -2.824 1.00 0.00 H new ATOM 2166 N GLU A 132 -10.450 6.712 2.027 1.00 0.00 N ATOM 2167 CA GLU A 132 -10.528 6.823 3.473 1.00 0.00 C ATOM 2168 C GLU A 132 -9.143 7.100 4.060 1.00 0.00 C ATOM 2169 O GLU A 132 -8.971 8.034 4.841 1.00 0.00 O ATOM 2170 CB GLU A 132 -11.142 5.563 4.087 1.00 0.00 C ATOM 2171 CG GLU A 132 -12.493 5.872 4.737 1.00 0.00 C ATOM 2172 CD GLU A 132 -13.529 4.805 4.380 1.00 0.00 C ATOM 2173 OE1 GLU A 132 -13.889 4.659 3.202 1.00 0.00 O ATOM 2174 OE2 GLU A 132 -13.964 4.112 5.377 1.00 0.00 O ATOM 0 H GLU A 132 -10.589 5.769 1.664 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.179 7.662 3.719 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.271 4.804 3.316 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -10.462 5.149 4.832 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.377 5.923 5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.844 6.850 4.407 1.00 0.00 H new ATOM 2182 N VAL A 133 -8.190 6.271 3.660 1.00 0.00 N ATOM 2183 CA VAL A 133 -6.825 6.414 4.137 1.00 0.00 C ATOM 2184 C VAL A 133 -6.195 7.656 3.501 1.00 0.00 C ATOM 2185 O VAL A 133 -5.376 8.329 4.125 1.00 0.00 O ATOM 2186 CB VAL A 133 -6.035 5.134 3.856 1.00 0.00 C ATOM 2187 CG1 VAL A 133 -4.569 5.293 4.266 1.00 0.00 C ATOM 2188 CG2 VAL A 133 -6.673 3.932 4.556 1.00 0.00 C ATOM 0 H VAL A 133 -8.336 5.498 3.011 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.811 6.558 5.217 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.064 4.951 2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.030 4.369 4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.120 6.111 3.703 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.511 5.512 5.332 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -6.092 3.035 4.340 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -6.689 4.104 5.632 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.693 3.800 4.195 1.00 0.00 H new ATOM 2198 N TRP A 134 -6.603 7.922 2.269 1.00 0.00 N ATOM 2199 CA TRP A 134 -6.089 9.071 1.543 1.00 0.00 C ATOM 2200 C TRP A 134 -6.800 10.319 2.070 1.00 0.00 C ATOM 2201 O TRP A 134 -6.370 11.441 1.804 1.00 0.00 O ATOM 2202 CB TRP A 134 -6.252 8.883 0.033 1.00 0.00 C ATOM 2203 CG TRP A 134 -5.712 10.046 -0.801 1.00 0.00 C ATOM 2204 CD1 TRP A 134 -4.921 11.051 -0.401 1.00 0.00 C ATOM 2205 CD2 TRP A 134 -5.958 10.286 -2.203 1.00 0.00 C ATOM 2206 NE1 TRP A 134 -4.640 11.917 -1.438 1.00 0.00 N ATOM 2207 CE2 TRP A 134 -5.291 11.437 -2.568 1.00 0.00 C ATOM 2208 CE3 TRP A 134 -6.720 9.555 -3.131 1.00 0.00 C ATOM 2209 CZ2 TRP A 134 -5.317 11.959 -3.867 1.00 0.00 C ATOM 2210 CZ3 TRP A 134 -6.736 10.090 -4.425 1.00 0.00 C ATOM 2211 CH2 TRP A 134 -6.070 11.247 -4.809 1.00 0.00 C ATOM 0 H TRP A 134 -7.283 7.362 1.755 1.00 0.00 H new ATOM 0 HA TRP A 134 -5.018 9.184 1.708 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -5.742 7.967 -0.266 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -7.309 8.747 -0.194 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -4.550 11.168 0.606 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -4.061 12.755 -1.385 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -7.251 8.652 -2.867 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -4.785 12.862 -4.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -7.306 9.566 -5.178 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -6.133 11.596 -5.829 1.00 0.00 H new ATOM 2222 N GLY A 135 -7.875 10.083 2.806 1.00 0.00 N ATOM 2223 CA GLY A 135 -8.649 11.174 3.373 1.00 0.00 C ATOM 2224 C GLY A 135 -7.746 12.153 4.126 1.00 0.00 C ATOM 2225 O GLY A 135 -8.089 13.324 4.283 1.00 0.00 O ATOM 0 H GLY A 135 -8.229 9.151 3.023 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -9.179 11.700 2.579 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -9.404 10.775 4.051 1.00 0.00 H new ATOM 2229 N GLU A 136 -6.610 11.638 4.572 1.00 0.00 N ATOM 2230 CA GLU A 136 -5.656 12.452 5.305 1.00 0.00 C ATOM 2231 C GLU A 136 -4.708 13.161 4.336 1.00 0.00 C ATOM 2232 O GLU A 136 -4.697 14.388 4.258 1.00 0.00 O ATOM 2233 CB GLU A 136 -4.877 11.608 6.315 1.00 0.00 C ATOM 2234 CG GLU A 136 -4.229 12.490 7.384 1.00 0.00 C ATOM 2235 CD GLU A 136 -3.424 11.649 8.376 1.00 0.00 C ATOM 2236 OE1 GLU A 136 -3.681 10.444 8.519 1.00 0.00 O ATOM 2237 OE2 GLU A 136 -2.502 12.289 9.011 1.00 0.00 O ATOM 0 H GLU A 136 -6.329 10.667 4.440 1.00 0.00 H new ATOM 0 HA GLU A 136 -6.207 13.209 5.863 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -5.547 10.890 6.788 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.108 11.033 5.798 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.576 13.222 6.909 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -5.000 13.048 7.916 1.00 0.00 H new ATOM 2245 N TRP A 137 -3.935 12.357 3.621 1.00 0.00 N ATOM 2246 CA TRP A 137 -2.985 12.891 2.660 1.00 0.00 C ATOM 2247 C TRP A 137 -3.754 13.777 1.678 1.00 0.00 C ATOM 2248 O TRP A 137 -3.174 14.658 1.045 1.00 0.00 O ATOM 2249 CB TRP A 137 -2.211 11.766 1.970 1.00 0.00 C ATOM 2250 CG TRP A 137 -0.964 11.311 2.731 1.00 0.00 C ATOM 2251 CD1 TRP A 137 -0.847 11.047 4.039 1.00 0.00 C ATOM 2252 CD2 TRP A 137 0.346 11.075 2.173 1.00 0.00 C ATOM 2253 NE1 TRP A 137 0.438 10.661 4.364 1.00 0.00 N ATOM 2254 CE2 TRP A 137 1.186 10.678 3.193 1.00 0.00 C ATOM 2255 CE3 TRP A 137 0.806 11.194 0.849 1.00 0.00 C ATOM 2256 CZ2 TRP A 137 2.537 10.367 2.997 1.00 0.00 C ATOM 2257 CZ3 TRP A 137 2.158 10.879 0.670 1.00 0.00 C ATOM 2258 CH2 TRP A 137 3.017 10.478 1.686 1.00 0.00 C ATOM 0 H TRP A 137 -3.947 11.339 3.688 1.00 0.00 H new ATOM 0 HA TRP A 137 -2.231 13.498 3.160 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -2.874 10.912 1.836 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -1.916 12.099 0.975 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -1.656 11.126 4.750 1.00 0.00 H new ATOM 0 HE1 TRP A 137 0.776 10.410 5.293 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.167 11.504 0.035 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 3.174 10.058 3.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 2.562 10.953 -0.329 1.00 0.00 H new ATOM 0 HH2 TRP A 137 4.050 10.253 1.466 1.00 0.00 H new ATOM 2269 N ARG A 138 -5.049 13.513 1.581 1.00 0.00 N ATOM 2270 CA ARG A 138 -5.904 14.275 0.687 1.00 0.00 C ATOM 2271 C ARG A 138 -5.642 15.774 0.851 1.00 0.00 C ATOM 2272 O ARG A 138 -5.574 16.507 -0.134 1.00 0.00 O ATOM 2273 CB ARG A 138 -7.382 13.990 0.961 1.00 0.00 C ATOM 2274 CG ARG A 138 -8.003 13.175 -0.174 1.00 0.00 C ATOM 2275 CD ARG A 138 -8.257 14.051 -1.403 1.00 0.00 C ATOM 2276 NE ARG A 138 -9.678 13.958 -1.806 1.00 0.00 N ATOM 2277 CZ ARG A 138 -10.306 14.868 -2.581 1.00 0.00 C ATOM 2278 NH1 ARG A 138 -9.643 15.949 -3.043 1.00 0.00 N ATOM 2279 NH2 ARG A 138 -11.579 14.685 -2.879 1.00 0.00 N ATOM 0 H ARG A 138 -5.527 12.782 2.107 1.00 0.00 H new ATOM 0 HA ARG A 138 -5.670 13.971 -0.333 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -7.483 13.447 1.901 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -7.922 14.930 1.076 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -7.340 12.352 -0.440 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.941 12.733 0.162 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -8.001 15.087 -1.181 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -7.616 13.733 -2.225 1.00 0.00 H new ATOM 0 HE ARG A 138 -10.217 13.156 -1.478 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -8.660 16.083 -2.807 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.125 16.631 -3.628 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -12.073 13.866 -2.525 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -12.069 15.363 -3.463 1.00 0.00 H new ATOM 2292 N SER A 139 -5.501 16.184 2.103 1.00 0.00 N ATOM 2293 CA SER A 139 -5.248 17.581 2.409 1.00 0.00 C ATOM 2294 C SER A 139 -4.060 18.089 1.590 1.00 0.00 C ATOM 2295 O SER A 139 -3.905 19.294 1.395 1.00 0.00 O ATOM 2296 CB SER A 139 -4.985 17.779 3.903 1.00 0.00 C ATOM 2297 OG SER A 139 -6.186 17.719 4.668 1.00 0.00 O ATOM 0 H SER A 139 -5.557 15.573 2.917 1.00 0.00 H new ATOM 0 HA SER A 139 -6.136 18.155 2.145 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.293 17.014 4.254 1.00 0.00 H new ATOM 0 HB3 SER A 139 -4.502 18.743 4.062 1.00 0.00 H new ATOM 0 HG SER A 139 -5.976 17.848 5.617 1.00 0.00 H new ATOM 2303 N ASN A 140 -3.251 17.145 1.131 1.00 0.00 N ATOM 2304 CA ASN A 140 -2.081 17.482 0.338 1.00 0.00 C ATOM 2305 C ASN A 140 -2.243 16.905 -1.070 1.00 0.00 C ATOM 2306 O ASN A 140 -1.850 15.769 -1.328 1.00 0.00 O ATOM 2307 CB ASN A 140 -0.811 16.888 0.949 1.00 0.00 C ATOM 2308 CG ASN A 140 -0.875 16.912 2.477 1.00 0.00 C ATOM 2309 OD1 ASN A 140 -1.581 15.917 3.005 1.00 0.00 O flip ATOM 2310 ND2 ASN A 140 -0.319 17.777 3.134 1.00 0.00 N flip ATOM 0 H ASN A 140 -3.383 16.147 1.293 1.00 0.00 H new ATOM 0 HA ASN A 140 -1.993 18.568 0.311 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -0.682 15.862 0.603 1.00 0.00 H new ATOM 0 HB3 ASN A 140 0.058 17.451 0.609 1.00 0.00 H new ATOM 0 HD21 ASN A 140 0.208 18.514 2.665 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -0.381 17.763 4.152 1.00 0.00 H new ATOM 2317 N PRO A 141 -2.837 17.737 -1.967 1.00 0.00 N ATOM 2318 CA PRO A 141 -3.055 17.322 -3.343 1.00 0.00 C ATOM 2319 C PRO A 141 -1.747 17.344 -4.136 1.00 0.00 C ATOM 2320 O PRO A 141 -0.664 17.342 -3.554 1.00 0.00 O ATOM 2321 CB PRO A 141 -4.095 18.288 -3.885 1.00 0.00 C ATOM 2322 CG PRO A 141 -4.079 19.487 -2.950 1.00 0.00 C ATOM 2323 CD PRO A 141 -3.315 19.090 -1.697 1.00 0.00 C ATOM 0 HA PRO A 141 -3.407 16.294 -3.422 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -3.857 18.586 -4.906 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -5.082 17.826 -3.910 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -3.604 20.341 -3.432 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -5.096 19.788 -2.698 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -2.486 19.772 -1.506 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -3.958 19.115 -0.817 1.00 0.00 H new ATOM 2331 N SER A 142 -1.891 17.364 -5.453 1.00 0.00 N ATOM 2332 CA SER A 142 -0.735 17.387 -6.332 1.00 0.00 C ATOM 2333 C SER A 142 0.386 18.215 -5.701 1.00 0.00 C ATOM 2334 O SER A 142 1.226 17.680 -4.979 1.00 0.00 O ATOM 2335 CB SER A 142 -1.100 17.949 -7.708 1.00 0.00 C ATOM 2336 OG SER A 142 0.037 18.473 -8.389 1.00 0.00 O ATOM 0 H SER A 142 -2.791 17.365 -5.932 1.00 0.00 H new ATOM 0 HA SER A 142 -0.389 16.362 -6.468 1.00 0.00 H new ATOM 0 HB2 SER A 142 -1.554 17.163 -8.312 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.847 18.734 -7.592 1.00 0.00 H new ATOM 0 HG SER A 142 -0.237 18.820 -9.263 1.00 0.00 H new