USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 913 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 89 SER OG : rot -93:sc= 0.435 USER MOD Set 1.2: A 90 LYS NZ :NH3+ -124:sc= -0.73 (180deg=-4.28!) USER MOD Set 2.1: A 40 HIS :FLIP no HD1:sc= -3.56! C(o=-6.4!,f=-4.4!) USER MOD Set 2.2: A 74 SER OG : rot 105:sc= -0.865 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= -0.561 (180deg=-0.869) USER MOD Single : A 2 CYS SG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -105:sc= -1.49 (180deg=-3.73!) USER MOD Single : A 7 MET CE :methyl -150:sc= -2.88! (180deg=-5.68!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -0.0564 K(o=-0.056,f=-3!) USER MOD Single : A 19 LYS NZ :NH3+ 137:sc= 0.309 (180deg=-0.234) USER MOD Single : A 21 TYR OH : rot -160:sc= 0.0196 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -2.03! C(o=-6!,f=-2!) USER MOD Single : A 31 THR OG1 : rot -77:sc= 0.881 USER MOD Single : A 37 LYS NZ :NH3+ 150:sc= -1.06 (180deg=-2.2!) USER MOD Single : A 41 TYR OH : rot 173:sc= -2.41 USER MOD Single : A 45 CYS SG : rot 16:sc= -0.545 USER MOD Single : A 47 GLN :FLIP amide:sc= -3.09! C(o=-6.4!,f=-3.1!) USER MOD Single : A 57 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.236) USER MOD Single : A 62 ASN :FLIP amide:sc= -0.441! C(o=-11!,f=-0.44!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -2.15 K(o=-2.1,f=-3.3!) USER MOD Single : A 68 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-2.9) USER MOD Single : A 70 THR OG1 : rot 111:sc= -4.92! USER MOD Single : A 77 TYR OH : rot -140:sc= -0.271 USER MOD Single : A 80 HIS : no HD1:sc= -1.55 K(o=-1.6,f=-2.3!) USER MOD Single : A 82 SER OG : rot 150:sc= -0.321 USER MOD Single : A 83 CYS SG : rot -170:sc= -1.31 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 133:sc= 0.529 (180deg=-0.135) USER MOD Single : A 95 THR OG1 : rot 140:sc= -3.98! USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 102:sc= -0.349! USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.414! USER MOD Single : A 110 ASN :FLIP amide:sc= -17.1! C(o=-21!,f=-17!) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 167:sc= -0.87 (180deg=-1.19) USER MOD Single : A 118 GLN : amide:sc= -3.93! C(o=-3.9!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.825 -13.450 86.957 1.00 0.00 N ATOM 2 CA MET A 1 -11.220 -13.622 85.532 1.00 0.00 C ATOM 3 C MET A 1 -10.907 -12.338 84.763 1.00 0.00 C ATOM 4 O MET A 1 -11.111 -12.256 83.568 1.00 0.00 O ATOM 5 CB MET A 1 -12.721 -13.915 85.451 1.00 0.00 C ATOM 6 CG MET A 1 -13.007 -15.294 86.050 1.00 0.00 C ATOM 7 SD MET A 1 -14.788 -15.481 86.315 1.00 0.00 S ATOM 8 CE MET A 1 -14.853 -17.285 86.181 1.00 0.00 C ATOM 0 H1 MET A 1 -10.860 -14.370 87.440 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.858 -13.070 87.006 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.481 -12.790 87.422 1.00 0.00 H new ATOM 0 HA MET A 1 -10.665 -14.453 85.096 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.281 -13.150 85.989 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.053 -13.882 84.413 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.644 -16.075 85.381 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.474 -15.410 86.994 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.880 -17.623 86.315 1.00 0.00 H new ATOM 0 HE2 MET A 1 -14.497 -17.590 85.197 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.221 -17.730 86.950 1.00 0.00 H new ATOM 20 N CYS A 2 -10.413 -11.333 85.440 1.00 0.00 N ATOM 21 CA CYS A 2 -10.087 -10.049 84.750 1.00 0.00 C ATOM 22 C CYS A 2 -8.591 -9.743 84.895 1.00 0.00 C ATOM 23 O CYS A 2 -7.893 -10.339 85.695 1.00 0.00 O ATOM 24 CB CYS A 2 -10.900 -8.914 85.380 1.00 0.00 C ATOM 25 SG CYS A 2 -12.624 -9.434 85.563 1.00 0.00 S ATOM 0 H CYS A 2 -10.221 -11.346 86.442 1.00 0.00 H new ATOM 0 HA CYS A 2 -10.334 -10.137 83.692 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -10.484 -8.651 86.352 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -10.843 -8.022 84.756 1.00 0.00 H new ATOM 0 HG CYS A 2 -13.313 -8.471 86.100 1.00 0.00 H new ATOM 31 N ASP A 3 -8.096 -8.812 84.122 1.00 0.00 N ATOM 32 CA ASP A 3 -6.649 -8.457 84.202 1.00 0.00 C ATOM 33 C ASP A 3 -6.283 -8.130 85.647 1.00 0.00 C ATOM 34 O ASP A 3 -5.141 -8.225 86.049 1.00 0.00 O ATOM 35 CB ASP A 3 -6.373 -7.230 83.331 1.00 0.00 C ATOM 36 CG ASP A 3 -6.989 -7.429 81.946 1.00 0.00 C ATOM 37 OD1 ASP A 3 -8.206 -7.428 81.854 1.00 0.00 O ATOM 38 OD2 ASP A 3 -6.235 -7.575 80.998 1.00 0.00 O ATOM 0 H ASP A 3 -8.634 -8.281 83.437 1.00 0.00 H new ATOM 0 HA ASP A 3 -6.054 -9.300 83.851 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -6.790 -6.339 83.800 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -5.298 -7.070 83.242 1.00 0.00 H new ATOM 43 N LYS A 4 -7.244 -7.738 86.427 1.00 0.00 N ATOM 44 CA LYS A 4 -6.962 -7.396 87.846 1.00 0.00 C ATOM 45 C LYS A 4 -6.324 -8.601 88.546 1.00 0.00 C ATOM 46 O LYS A 4 -5.158 -8.583 88.891 1.00 0.00 O ATOM 47 CB LYS A 4 -8.276 -7.008 88.526 1.00 0.00 C ATOM 48 CG LYS A 4 -9.009 -5.984 87.646 1.00 0.00 C ATOM 49 CD LYS A 4 -10.006 -5.181 88.487 1.00 0.00 C ATOM 50 CE LYS A 4 -11.117 -6.106 88.990 1.00 0.00 C ATOM 51 NZ LYS A 4 -10.645 -6.825 90.205 1.00 0.00 N ATOM 0 H LYS A 4 -8.219 -7.639 86.143 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.267 -6.558 87.904 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.898 -7.891 88.675 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.080 -6.586 89.512 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.288 -5.311 87.182 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.533 -6.496 86.839 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.495 -4.718 89.331 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -10.433 -4.374 87.891 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -12.012 -5.527 89.220 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -11.391 -6.821 88.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.423 -7.811 89.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.792 -6.359 90.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.390 -6.808 90.930 1.00 0.00 H new ATOM 65 N GLU A 5 -7.070 -9.647 88.753 1.00 0.00 N ATOM 66 CA GLU A 5 -6.500 -10.852 89.428 1.00 0.00 C ATOM 67 C GLU A 5 -5.133 -11.198 88.818 1.00 0.00 C ATOM 68 O GLU A 5 -4.363 -11.950 89.384 1.00 0.00 O ATOM 69 CB GLU A 5 -7.457 -12.033 89.239 1.00 0.00 C ATOM 70 CG GLU A 5 -7.159 -13.114 90.280 1.00 0.00 C ATOM 71 CD GLU A 5 -8.186 -14.239 90.149 1.00 0.00 C ATOM 72 OE1 GLU A 5 -9.356 -13.931 89.996 1.00 0.00 O ATOM 73 OE2 GLU A 5 -7.785 -15.391 90.202 1.00 0.00 O ATOM 0 H GLU A 5 -8.051 -9.724 88.485 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.373 -10.645 90.490 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.489 -11.696 89.337 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -7.349 -12.443 88.235 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -6.152 -13.506 90.136 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.194 -12.689 91.283 1.00 0.00 H new ATOM 80 N PHE A 6 -4.832 -10.665 87.664 1.00 0.00 N ATOM 81 CA PHE A 6 -3.523 -10.973 87.009 1.00 0.00 C ATOM 82 C PHE A 6 -2.384 -10.243 87.743 1.00 0.00 C ATOM 83 O PHE A 6 -1.648 -10.838 88.503 1.00 0.00 O ATOM 84 CB PHE A 6 -3.574 -10.516 85.543 1.00 0.00 C ATOM 85 CG PHE A 6 -2.586 -11.289 84.687 1.00 0.00 C ATOM 86 CD1 PHE A 6 -1.464 -11.924 85.252 1.00 0.00 C ATOM 87 CD2 PHE A 6 -2.801 -11.366 83.305 1.00 0.00 C ATOM 88 CE1 PHE A 6 -0.572 -12.626 84.433 1.00 0.00 C ATOM 89 CE2 PHE A 6 -1.905 -12.068 82.491 1.00 0.00 C ATOM 90 CZ PHE A 6 -0.793 -12.699 83.056 1.00 0.00 C ATOM 0 H PHE A 6 -5.436 -10.028 87.144 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.338 -12.046 87.052 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -4.582 -10.654 85.152 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -3.353 -9.450 85.485 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -1.291 -11.870 86.317 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.661 -10.882 82.866 1.00 0.00 H new ATOM 0 HE1 PHE A 6 0.289 -13.112 84.867 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -2.073 -12.122 81.425 1.00 0.00 H new ATOM 0 HZ PHE A 6 -0.104 -13.243 82.427 1.00 0.00 H new ATOM 100 N MET A 7 -2.214 -8.964 87.511 1.00 0.00 N ATOM 101 CA MET A 7 -1.101 -8.236 88.192 1.00 0.00 C ATOM 102 C MET A 7 -1.298 -8.283 89.712 1.00 0.00 C ATOM 103 O MET A 7 -0.365 -8.115 90.469 1.00 0.00 O ATOM 104 CB MET A 7 -1.028 -6.782 87.695 1.00 0.00 C ATOM 105 CG MET A 7 -2.029 -5.895 88.440 1.00 0.00 C ATOM 106 SD MET A 7 -3.703 -6.510 88.161 1.00 0.00 S ATOM 107 CE MET A 7 -3.860 -5.979 86.437 1.00 0.00 C ATOM 0 H MET A 7 -2.791 -8.399 86.887 1.00 0.00 H new ATOM 0 HA MET A 7 -0.157 -8.724 87.949 1.00 0.00 H new ATOM 0 HB2 MET A 7 -0.019 -6.396 87.837 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.234 -6.749 86.625 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.805 -5.892 89.507 1.00 0.00 H new ATOM 0 HG3 MET A 7 -1.946 -4.865 88.094 1.00 0.00 H new ATOM 0 HE1 MET A 7 -4.905 -5.761 86.217 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.261 -5.083 86.276 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.509 -6.773 85.778 1.00 0.00 H new ATOM 117 N TRP A 8 -2.501 -8.521 90.163 1.00 0.00 N ATOM 118 CA TRP A 8 -2.744 -8.590 91.632 1.00 0.00 C ATOM 119 C TRP A 8 -1.851 -9.673 92.241 1.00 0.00 C ATOM 120 O TRP A 8 -1.515 -9.634 93.409 1.00 0.00 O ATOM 121 CB TRP A 8 -4.212 -8.934 91.887 1.00 0.00 C ATOM 122 CG TRP A 8 -4.564 -8.607 93.300 1.00 0.00 C ATOM 123 CD1 TRP A 8 -4.819 -9.518 94.266 1.00 0.00 C ATOM 124 CD2 TRP A 8 -4.704 -7.298 93.922 1.00 0.00 C ATOM 125 NE1 TRP A 8 -5.108 -8.852 95.442 1.00 0.00 N ATOM 126 CE2 TRP A 8 -5.049 -7.481 95.281 1.00 0.00 C ATOM 127 CE3 TRP A 8 -4.567 -5.983 93.442 1.00 0.00 C ATOM 128 CZ2 TRP A 8 -5.250 -6.397 96.135 1.00 0.00 C ATOM 129 CZ3 TRP A 8 -4.768 -4.890 94.300 1.00 0.00 C ATOM 130 CH2 TRP A 8 -5.109 -5.097 95.643 1.00 0.00 C ATOM 0 H TRP A 8 -3.324 -8.670 89.579 1.00 0.00 H new ATOM 0 HA TRP A 8 -2.512 -7.628 92.089 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -4.851 -8.375 91.204 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -4.387 -9.992 91.693 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -4.800 -10.590 94.139 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -5.337 -9.316 96.321 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.306 -5.813 92.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -5.513 -6.561 97.170 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -4.659 -3.884 93.923 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -5.263 -4.252 96.298 1.00 0.00 H new ATOM 141 N ALA A 9 -1.466 -10.639 91.453 1.00 0.00 N ATOM 142 CA ALA A 9 -0.594 -11.731 91.966 1.00 0.00 C ATOM 143 C ALA A 9 0.865 -11.297 91.854 1.00 0.00 C ATOM 144 O ALA A 9 1.590 -11.284 92.828 1.00 0.00 O ATOM 145 CB ALA A 9 -0.819 -13.005 91.151 1.00 0.00 C ATOM 0 H ALA A 9 -1.721 -10.718 90.468 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.838 -11.934 93.009 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.177 -13.799 91.533 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.862 -13.310 91.233 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.578 -12.815 90.105 1.00 0.00 H new ATOM 151 N LEU A 10 1.296 -10.913 90.682 1.00 0.00 N ATOM 152 CA LEU A 10 2.701 -10.445 90.528 1.00 0.00 C ATOM 153 C LEU A 10 2.922 -9.325 91.541 1.00 0.00 C ATOM 154 O LEU A 10 4.026 -8.869 91.776 1.00 0.00 O ATOM 155 CB LEU A 10 2.893 -9.882 89.115 1.00 0.00 C ATOM 156 CG LEU A 10 2.678 -10.987 88.059 1.00 0.00 C ATOM 157 CD1 LEU A 10 1.565 -10.574 87.088 1.00 0.00 C ATOM 158 CD2 LEU A 10 3.976 -11.203 87.275 1.00 0.00 C ATOM 0 H LEU A 10 0.737 -10.904 89.829 1.00 0.00 H new ATOM 0 HA LEU A 10 3.402 -11.264 90.689 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.191 -9.066 88.944 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.896 -9.466 89.016 1.00 0.00 H new ATOM 0 HG LEU A 10 2.393 -11.910 88.563 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.420 -11.359 86.346 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.638 -10.421 87.641 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.845 -9.648 86.586 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.825 -11.983 86.529 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.259 -10.275 86.778 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.769 -11.504 87.960 1.00 0.00 H new ATOM 170 N LYS A 11 1.842 -8.863 92.105 1.00 0.00 N ATOM 171 CA LYS A 11 1.878 -7.739 93.085 1.00 0.00 C ATOM 172 C LYS A 11 2.000 -8.242 94.536 1.00 0.00 C ATOM 173 O LYS A 11 3.002 -8.037 95.192 1.00 0.00 O ATOM 174 CB LYS A 11 0.566 -6.957 92.911 1.00 0.00 C ATOM 175 CG LYS A 11 0.274 -6.081 94.133 1.00 0.00 C ATOM 176 CD LYS A 11 1.450 -5.149 94.398 1.00 0.00 C ATOM 177 CE LYS A 11 1.068 -4.206 95.530 1.00 0.00 C ATOM 178 NZ LYS A 11 2.289 -3.576 96.097 1.00 0.00 N ATOM 0 H LYS A 11 0.907 -9.228 91.922 1.00 0.00 H new ATOM 0 HA LYS A 11 2.751 -7.114 92.897 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.628 -6.333 92.020 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.257 -7.654 92.755 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -0.632 -5.498 93.965 1.00 0.00 H new ATOM 0 HG3 LYS A 11 0.092 -6.708 95.006 1.00 0.00 H new ATOM 0 HD2 LYS A 11 2.337 -5.724 94.666 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.696 -4.583 93.499 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.389 -3.437 95.161 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.536 -4.754 96.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 2.021 -2.933 96.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.922 -4.315 96.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 2.779 -3.039 95.354 1.00 0.00 H new ATOM 192 N ASN A 12 0.966 -8.849 95.055 1.00 0.00 N ATOM 193 CA ASN A 12 0.986 -9.306 96.473 1.00 0.00 C ATOM 194 C ASN A 12 1.740 -10.628 96.621 1.00 0.00 C ATOM 195 O ASN A 12 1.736 -11.232 97.674 1.00 0.00 O ATOM 196 CB ASN A 12 -0.459 -9.502 96.934 1.00 0.00 C ATOM 197 CG ASN A 12 -0.917 -8.282 97.731 1.00 0.00 C ATOM 198 OD1 ASN A 12 -0.986 -7.188 97.204 1.00 0.00 O ATOM 199 ND2 ASN A 12 -1.234 -8.424 98.987 1.00 0.00 N ATOM 0 H ASN A 12 0.102 -9.049 94.552 1.00 0.00 H new ATOM 0 HA ASN A 12 1.495 -8.556 97.078 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -1.109 -9.649 96.071 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -0.536 -10.399 97.548 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -1.541 -7.617 99.530 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -1.175 -9.342 99.427 1.00 0.00 H new ATOM 206 N GLY A 13 2.398 -11.081 95.599 1.00 0.00 N ATOM 207 CA GLY A 13 3.149 -12.351 95.721 1.00 0.00 C ATOM 208 C GLY A 13 2.199 -13.545 95.672 1.00 0.00 C ATOM 209 O GLY A 13 2.562 -14.638 96.055 1.00 0.00 O ATOM 0 H GLY A 13 2.448 -10.628 94.687 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.879 -12.427 94.915 1.00 0.00 H new ATOM 0 HA3 GLY A 13 3.706 -12.361 96.658 1.00 0.00 H new ATOM 213 N ASP A 14 1.000 -13.367 95.187 1.00 0.00 N ATOM 214 CA ASP A 14 0.080 -14.527 95.103 1.00 0.00 C ATOM 215 C ASP A 14 0.647 -15.470 94.057 1.00 0.00 C ATOM 216 O ASP A 14 0.004 -15.850 93.097 1.00 0.00 O ATOM 217 CB ASP A 14 -1.317 -14.076 94.705 1.00 0.00 C ATOM 218 CG ASP A 14 -1.638 -12.732 95.369 1.00 0.00 C ATOM 219 OD1 ASP A 14 -0.796 -11.850 95.321 1.00 0.00 O ATOM 220 OD2 ASP A 14 -2.722 -12.609 95.914 1.00 0.00 O ATOM 0 H ASP A 14 0.625 -12.480 94.851 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.002 -15.022 96.071 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.384 -13.982 93.621 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.050 -14.825 95.005 1.00 0.00 H new ATOM 225 N LEU A 15 1.874 -15.815 94.257 1.00 0.00 N ATOM 226 CA LEU A 15 2.606 -16.710 93.335 1.00 0.00 C ATOM 227 C LEU A 15 1.728 -17.910 92.959 1.00 0.00 C ATOM 228 O LEU A 15 1.888 -18.516 91.916 1.00 0.00 O ATOM 229 CB LEU A 15 3.879 -17.147 94.079 1.00 0.00 C ATOM 230 CG LEU A 15 4.754 -18.071 93.228 1.00 0.00 C ATOM 231 CD1 LEU A 15 4.185 -19.493 93.240 1.00 0.00 C ATOM 232 CD2 LEU A 15 4.842 -17.555 91.785 1.00 0.00 C ATOM 0 H LEU A 15 2.425 -15.501 95.056 1.00 0.00 H new ATOM 0 HA LEU A 15 2.866 -16.210 92.402 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.453 -16.265 94.363 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.602 -17.658 95.001 1.00 0.00 H new ATOM 0 HG LEU A 15 5.757 -18.084 93.654 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.815 -20.142 92.632 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.161 -19.867 94.264 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.174 -19.484 92.833 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.468 -18.225 91.196 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.843 -17.517 91.351 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.277 -16.556 91.782 1.00 0.00 H new ATOM 244 N ASP A 16 0.793 -18.247 93.795 1.00 0.00 N ATOM 245 CA ASP A 16 -0.108 -19.388 93.495 1.00 0.00 C ATOM 246 C ASP A 16 -1.017 -19.036 92.311 1.00 0.00 C ATOM 247 O ASP A 16 -1.423 -19.889 91.546 1.00 0.00 O ATOM 248 CB ASP A 16 -0.967 -19.664 94.727 1.00 0.00 C ATOM 249 CG ASP A 16 -0.108 -20.305 95.819 1.00 0.00 C ATOM 250 OD1 ASP A 16 0.727 -19.609 96.374 1.00 0.00 O ATOM 251 OD2 ASP A 16 -0.298 -21.482 96.082 1.00 0.00 O ATOM 0 H ASP A 16 0.612 -17.777 94.682 1.00 0.00 H new ATOM 0 HA ASP A 16 0.482 -20.268 93.240 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.405 -18.735 95.093 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.794 -20.325 94.466 1.00 0.00 H new ATOM 256 N GLU A 17 -1.355 -17.782 92.174 1.00 0.00 N ATOM 257 CA GLU A 17 -2.262 -17.356 91.065 1.00 0.00 C ATOM 258 C GLU A 17 -1.505 -17.291 89.731 1.00 0.00 C ATOM 259 O GLU A 17 -1.978 -17.779 88.720 1.00 0.00 O ATOM 260 CB GLU A 17 -2.836 -15.977 91.396 1.00 0.00 C ATOM 261 CG GLU A 17 -4.005 -16.130 92.371 1.00 0.00 C ATOM 262 CD GLU A 17 -4.445 -14.749 92.860 1.00 0.00 C ATOM 263 OE1 GLU A 17 -4.792 -13.930 92.026 1.00 0.00 O ATOM 264 OE2 GLU A 17 -4.428 -14.535 94.062 1.00 0.00 O ATOM 0 H GLU A 17 -1.041 -17.029 92.786 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.065 -18.086 90.966 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.063 -15.346 91.835 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.172 -15.483 90.484 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.837 -16.636 91.881 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.708 -16.750 93.217 1.00 0.00 H new ATOM 271 N VAL A 18 -0.337 -16.709 89.704 1.00 0.00 N ATOM 272 CA VAL A 18 0.416 -16.644 88.414 1.00 0.00 C ATOM 273 C VAL A 18 0.769 -18.068 88.010 1.00 0.00 C ATOM 274 O VAL A 18 0.716 -18.437 86.852 1.00 0.00 O ATOM 275 CB VAL A 18 1.721 -15.853 88.599 1.00 0.00 C ATOM 276 CG1 VAL A 18 1.586 -14.453 88.005 1.00 0.00 C ATOM 277 CG2 VAL A 18 2.048 -15.761 90.088 1.00 0.00 C ATOM 0 H VAL A 18 0.125 -16.281 90.506 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.194 -16.153 87.656 1.00 0.00 H new ATOM 0 HB VAL A 18 2.528 -16.369 88.079 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.519 -13.907 88.145 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.366 -14.529 86.940 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.776 -13.922 88.505 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.973 -15.201 90.223 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.236 -15.252 90.608 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.168 -16.764 90.497 1.00 0.00 H new ATOM 287 N LYS A 19 1.120 -18.863 88.976 1.00 0.00 N ATOM 288 CA LYS A 19 1.481 -20.275 88.708 1.00 0.00 C ATOM 289 C LYS A 19 0.371 -20.937 87.898 1.00 0.00 C ATOM 290 O LYS A 19 0.607 -21.853 87.136 1.00 0.00 O ATOM 291 CB LYS A 19 1.648 -20.992 90.053 1.00 0.00 C ATOM 292 CG LYS A 19 2.237 -22.393 89.853 1.00 0.00 C ATOM 293 CD LYS A 19 2.940 -22.838 91.145 1.00 0.00 C ATOM 294 CE LYS A 19 4.370 -22.280 91.179 1.00 0.00 C ATOM 295 NZ LYS A 19 5.323 -23.343 90.755 1.00 0.00 N ATOM 0 H LYS A 19 1.172 -18.588 89.957 1.00 0.00 H new ATOM 0 HA LYS A 19 2.410 -20.330 88.140 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.299 -20.408 90.703 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.682 -21.066 90.553 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.447 -23.098 89.594 1.00 0.00 H new ATOM 0 HG3 LYS A 19 2.944 -22.388 89.024 1.00 0.00 H new ATOM 0 HD2 LYS A 19 2.382 -22.486 92.013 1.00 0.00 H new ATOM 0 HD3 LYS A 19 2.963 -23.926 91.201 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.452 -21.417 90.518 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.615 -21.936 92.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.030 -22.938 90.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 5.802 -23.734 91.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 4.803 -24.101 90.268 1.00 0.00 H new ATOM 309 N ASP A 20 -0.839 -20.480 88.064 1.00 0.00 N ATOM 310 CA ASP A 20 -1.983 -21.073 87.316 1.00 0.00 C ATOM 311 C ASP A 20 -1.899 -20.711 85.828 1.00 0.00 C ATOM 312 O ASP A 20 -1.995 -21.564 84.964 1.00 0.00 O ATOM 313 CB ASP A 20 -3.298 -20.534 87.886 1.00 0.00 C ATOM 314 CG ASP A 20 -4.474 -21.198 87.166 1.00 0.00 C ATOM 315 OD1 ASP A 20 -4.883 -22.264 87.597 1.00 0.00 O ATOM 316 OD2 ASP A 20 -4.947 -20.630 86.194 1.00 0.00 O ATOM 0 H ASP A 20 -1.086 -19.715 88.691 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.943 -22.157 87.421 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.353 -20.734 88.956 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.345 -19.452 87.761 1.00 0.00 H new ATOM 321 N TYR A 21 -1.744 -19.452 85.517 1.00 0.00 N ATOM 322 CA TYR A 21 -1.686 -19.043 84.081 1.00 0.00 C ATOM 323 C TYR A 21 -0.534 -19.758 83.361 1.00 0.00 C ATOM 324 O TYR A 21 -0.732 -20.377 82.334 1.00 0.00 O ATOM 325 CB TYR A 21 -1.488 -17.524 83.980 1.00 0.00 C ATOM 326 CG TYR A 21 -2.238 -16.819 85.090 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.446 -17.339 85.577 1.00 0.00 C ATOM 328 CD2 TYR A 21 -1.721 -15.634 85.633 1.00 0.00 C ATOM 329 CE1 TYR A 21 -4.133 -16.675 86.600 1.00 0.00 C ATOM 330 CE2 TYR A 21 -2.410 -14.971 86.657 1.00 0.00 C ATOM 331 CZ TYR A 21 -3.615 -15.493 87.141 1.00 0.00 C ATOM 332 OH TYR A 21 -4.295 -14.841 88.149 1.00 0.00 O ATOM 0 H TYR A 21 -1.655 -18.691 86.191 1.00 0.00 H new ATOM 0 HA TYR A 21 -2.626 -19.322 83.605 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -0.426 -17.284 84.041 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.840 -17.169 83.012 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -3.846 -18.252 85.162 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -0.790 -15.232 85.261 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -5.064 -17.076 86.972 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -2.011 -14.057 87.073 1.00 0.00 H new ATOM 0 HH TYR A 21 -3.996 -13.909 88.196 1.00 0.00 H new ATOM 342 N VAL A 22 0.664 -19.675 83.873 1.00 0.00 N ATOM 343 CA VAL A 22 1.805 -20.348 83.189 1.00 0.00 C ATOM 344 C VAL A 22 1.629 -21.869 83.255 1.00 0.00 C ATOM 345 O VAL A 22 2.212 -22.598 82.476 1.00 0.00 O ATOM 346 CB VAL A 22 3.131 -19.935 83.837 1.00 0.00 C ATOM 347 CG1 VAL A 22 3.142 -20.335 85.310 1.00 0.00 C ATOM 348 CG2 VAL A 22 4.290 -20.623 83.108 1.00 0.00 C ATOM 0 H VAL A 22 0.901 -19.174 84.729 1.00 0.00 H new ATOM 0 HA VAL A 22 1.822 -20.041 82.143 1.00 0.00 H new ATOM 0 HB VAL A 22 3.243 -18.853 83.764 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.089 -20.037 85.761 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.321 -19.839 85.828 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.024 -21.415 85.395 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.234 -20.330 83.568 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.173 -21.704 83.177 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.289 -20.324 82.060 1.00 0.00 H new ATOM 358 N ALA A 23 0.813 -22.362 84.153 1.00 0.00 N ATOM 359 CA ALA A 23 0.607 -23.835 84.213 1.00 0.00 C ATOM 360 C ALA A 23 0.069 -24.269 82.856 1.00 0.00 C ATOM 361 O ALA A 23 0.199 -25.405 82.445 1.00 0.00 O ATOM 362 CB ALA A 23 -0.421 -24.189 85.292 1.00 0.00 C ATOM 0 H ALA A 23 0.289 -21.815 84.836 1.00 0.00 H new ATOM 0 HA ALA A 23 1.545 -24.336 84.453 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.559 -25.270 85.322 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.065 -23.842 86.262 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.371 -23.708 85.061 1.00 0.00 H new ATOM 368 N LYS A 24 -0.528 -23.345 82.158 1.00 0.00 N ATOM 369 CA LYS A 24 -1.085 -23.645 80.815 1.00 0.00 C ATOM 370 C LYS A 24 0.024 -24.165 79.897 1.00 0.00 C ATOM 371 O LYS A 24 0.214 -25.356 79.751 1.00 0.00 O ATOM 372 CB LYS A 24 -1.673 -22.359 80.229 1.00 0.00 C ATOM 373 CG LYS A 24 -2.900 -21.941 81.042 1.00 0.00 C ATOM 374 CD LYS A 24 -4.140 -22.673 80.514 1.00 0.00 C ATOM 375 CE LYS A 24 -5.116 -22.935 81.665 1.00 0.00 C ATOM 376 NZ LYS A 24 -6.503 -23.006 81.136 1.00 0.00 N ATOM 0 H LYS A 24 -0.654 -22.381 82.468 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.860 -24.406 80.899 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -0.926 -21.565 80.244 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.951 -22.516 79.187 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.748 -22.175 82.096 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.045 -20.863 80.973 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.625 -22.076 79.742 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.848 -23.615 80.051 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.859 -23.868 82.168 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.040 -22.141 82.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.164 -23.184 81.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.746 -22.105 80.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.571 -23.778 80.443 1.00 0.00 H new ATOM 390 N GLY A 25 0.754 -23.283 79.275 1.00 0.00 N ATOM 391 CA GLY A 25 1.844 -23.740 78.364 1.00 0.00 C ATOM 392 C GLY A 25 2.873 -22.631 78.139 1.00 0.00 C ATOM 393 O GLY A 25 2.852 -21.945 77.139 1.00 0.00 O ATOM 0 H GLY A 25 0.646 -22.272 79.356 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.335 -24.615 78.789 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.419 -24.046 77.408 1.00 0.00 H new ATOM 397 N GLU A 26 3.781 -22.475 79.062 1.00 0.00 N ATOM 398 CA GLU A 26 4.855 -21.438 78.936 1.00 0.00 C ATOM 399 C GLU A 26 4.355 -20.194 78.191 1.00 0.00 C ATOM 400 O GLU A 26 4.291 -20.161 76.977 1.00 0.00 O ATOM 401 CB GLU A 26 6.072 -22.019 78.206 1.00 0.00 C ATOM 402 CG GLU A 26 5.624 -22.880 77.024 1.00 0.00 C ATOM 403 CD GLU A 26 6.857 -23.334 76.242 1.00 0.00 C ATOM 404 OE1 GLU A 26 7.790 -23.810 76.870 1.00 0.00 O ATOM 405 OE2 GLU A 26 6.851 -23.194 75.031 1.00 0.00 O ATOM 0 H GLU A 26 3.828 -23.031 79.916 1.00 0.00 H new ATOM 0 HA GLU A 26 5.141 -21.139 79.944 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.712 -21.211 77.853 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.666 -22.618 78.896 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.064 -23.745 77.379 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.956 -22.312 76.377 1.00 0.00 H new ATOM 412 N ASP A 27 4.037 -19.162 78.918 1.00 0.00 N ATOM 413 CA ASP A 27 3.577 -17.893 78.287 1.00 0.00 C ATOM 414 C ASP A 27 4.055 -16.743 79.168 1.00 0.00 C ATOM 415 O ASP A 27 3.468 -15.680 79.206 1.00 0.00 O ATOM 416 CB ASP A 27 2.047 -17.873 78.192 1.00 0.00 C ATOM 417 CG ASP A 27 1.620 -16.978 77.025 1.00 0.00 C ATOM 418 OD1 ASP A 27 2.245 -15.947 76.837 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.679 -17.340 76.339 1.00 0.00 O ATOM 0 H ASP A 27 4.076 -19.142 79.937 1.00 0.00 H new ATOM 0 HA ASP A 27 3.981 -17.802 77.279 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.668 -18.884 78.046 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.619 -17.503 79.124 1.00 0.00 H new ATOM 424 N VAL A 28 5.117 -16.969 79.891 1.00 0.00 N ATOM 425 CA VAL A 28 5.654 -15.923 80.800 1.00 0.00 C ATOM 426 C VAL A 28 6.203 -14.752 79.985 1.00 0.00 C ATOM 427 O VAL A 28 7.398 -14.561 79.865 1.00 0.00 O ATOM 428 CB VAL A 28 6.763 -16.536 81.654 1.00 0.00 C ATOM 429 CG1 VAL A 28 6.137 -17.480 82.685 1.00 0.00 C ATOM 430 CG2 VAL A 28 7.725 -17.326 80.760 1.00 0.00 C ATOM 0 H VAL A 28 5.640 -17.845 79.889 1.00 0.00 H new ATOM 0 HA VAL A 28 4.858 -15.550 81.445 1.00 0.00 H new ATOM 0 HB VAL A 28 7.312 -15.744 82.163 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.923 -17.921 83.298 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.451 -16.921 83.321 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.591 -18.271 82.170 1.00 0.00 H new ATOM 0 HG21 VAL A 28 8.515 -17.762 81.372 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.179 -18.121 80.251 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.166 -16.658 80.020 1.00 0.00 H new ATOM 440 N ASN A 29 5.330 -13.966 79.430 1.00 0.00 N ATOM 441 CA ASN A 29 5.765 -12.801 78.626 1.00 0.00 C ATOM 442 C ASN A 29 4.518 -12.047 78.159 1.00 0.00 C ATOM 443 O ASN A 29 4.461 -11.541 77.056 1.00 0.00 O ATOM 444 CB ASN A 29 6.567 -13.287 77.419 1.00 0.00 C ATOM 445 CG ASN A 29 5.960 -14.583 76.885 1.00 0.00 C ATOM 446 OD1 ASN A 29 6.234 -15.709 77.480 1.00 0.00 O flip ATOM 447 ND2 ASN A 29 5.230 -14.571 75.914 1.00 0.00 N flip ATOM 0 H ASN A 29 4.319 -14.085 79.501 1.00 0.00 H new ATOM 0 HA ASN A 29 6.395 -12.141 79.222 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.566 -12.525 76.639 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.606 -13.451 77.703 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.015 -13.689 75.448 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.832 -15.443 75.565 1.00 0.00 H new ATOM 454 N ARG A 30 3.514 -11.980 78.995 1.00 0.00 N ATOM 455 CA ARG A 30 2.257 -11.271 78.614 1.00 0.00 C ATOM 456 C ARG A 30 2.185 -9.919 79.324 1.00 0.00 C ATOM 457 O ARG A 30 2.046 -9.844 80.529 1.00 0.00 O ATOM 458 CB ARG A 30 1.047 -12.118 79.022 1.00 0.00 C ATOM 459 CG ARG A 30 1.375 -13.604 78.845 1.00 0.00 C ATOM 460 CD ARG A 30 0.082 -14.401 78.618 1.00 0.00 C ATOM 461 NE ARG A 30 -1.068 -13.688 79.247 1.00 0.00 N ATOM 462 CZ ARG A 30 -2.291 -14.029 78.938 1.00 0.00 C ATOM 463 NH1 ARG A 30 -2.504 -15.001 78.093 1.00 0.00 N ATOM 464 NH2 ARG A 30 -3.302 -13.401 79.475 1.00 0.00 N ATOM 0 H ARG A 30 3.512 -12.388 79.930 1.00 0.00 H new ATOM 0 HA ARG A 30 2.251 -11.114 77.535 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.782 -11.915 80.060 1.00 0.00 H new ATOM 0 HB3 ARG A 30 0.182 -11.851 78.414 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.049 -13.738 77.999 1.00 0.00 H new ATOM 0 HG3 ARG A 30 1.893 -13.979 79.728 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -0.096 -14.526 77.550 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.180 -15.399 79.044 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.900 -12.937 79.916 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.716 -15.494 77.674 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.459 -15.267 77.852 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.138 -12.643 80.137 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.256 -13.669 79.232 1.00 0.00 H new ATOM 478 N THR A 31 2.265 -8.850 78.584 1.00 0.00 N ATOM 479 CA THR A 31 2.187 -7.499 79.207 1.00 0.00 C ATOM 480 C THR A 31 0.845 -7.346 79.929 1.00 0.00 C ATOM 481 O THR A 31 -0.175 -7.121 79.310 1.00 0.00 O ATOM 482 CB THR A 31 2.288 -6.438 78.111 1.00 0.00 C ATOM 483 OG1 THR A 31 3.510 -6.601 77.404 1.00 0.00 O ATOM 484 CG2 THR A 31 2.237 -5.046 78.735 1.00 0.00 C ATOM 0 H THR A 31 2.381 -8.853 77.571 1.00 0.00 H new ATOM 0 HA THR A 31 3.002 -7.378 79.921 1.00 0.00 H new ATOM 0 HB THR A 31 1.452 -6.552 77.420 1.00 0.00 H new ATOM 0 HG1 THR A 31 4.249 -6.248 77.942 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.309 -4.293 77.950 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.296 -4.922 79.272 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.069 -4.928 79.429 1.00 0.00 H new ATOM 492 N LEU A 32 0.825 -7.471 81.229 1.00 0.00 N ATOM 493 CA LEU A 32 -0.477 -7.333 81.949 1.00 0.00 C ATOM 494 C LEU A 32 -0.872 -5.854 82.052 1.00 0.00 C ATOM 495 O LEU A 32 -2.035 -5.529 82.188 1.00 0.00 O ATOM 496 CB LEU A 32 -0.439 -8.009 83.345 1.00 0.00 C ATOM 497 CG LEU A 32 0.639 -7.428 84.289 1.00 0.00 C ATOM 498 CD1 LEU A 32 2.030 -7.528 83.664 1.00 0.00 C ATOM 499 CD2 LEU A 32 0.335 -5.966 84.632 1.00 0.00 C ATOM 0 H LEU A 32 1.637 -7.659 81.816 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.240 -7.854 81.370 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.416 -7.904 83.816 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.260 -9.077 83.217 1.00 0.00 H new ATOM 0 HG LEU A 32 0.622 -8.019 85.205 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.768 -7.112 84.350 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.266 -8.574 83.468 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.049 -6.970 82.728 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.108 -5.580 85.297 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.315 -5.374 83.717 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.634 -5.902 85.126 1.00 0.00 H new ATOM 511 N GLU A 33 0.070 -4.950 81.960 1.00 0.00 N ATOM 512 CA GLU A 33 -0.289 -3.501 82.022 1.00 0.00 C ATOM 513 C GLU A 33 -0.655 -3.005 80.619 1.00 0.00 C ATOM 514 O GLU A 33 -1.796 -3.069 80.207 1.00 0.00 O ATOM 515 CB GLU A 33 0.886 -2.689 82.561 1.00 0.00 C ATOM 516 CG GLU A 33 0.529 -1.200 82.512 1.00 0.00 C ATOM 517 CD GLU A 33 1.433 -0.422 83.467 1.00 0.00 C ATOM 518 OE1 GLU A 33 1.805 -0.979 84.486 1.00 0.00 O ATOM 519 OE2 GLU A 33 1.737 0.719 83.164 1.00 0.00 O ATOM 0 H GLU A 33 1.064 -5.150 81.846 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.141 -3.375 82.690 1.00 0.00 H new ATOM 0 HB2 GLU A 33 1.112 -2.988 83.584 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.780 -2.881 81.968 1.00 0.00 H new ATOM 0 HG2 GLU A 33 0.645 -0.822 81.496 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.516 -1.057 82.788 1.00 0.00 H new ATOM 526 N GLY A 34 0.307 -2.506 79.882 1.00 0.00 N ATOM 527 CA GLY A 34 0.016 -2.003 78.507 1.00 0.00 C ATOM 528 C GLY A 34 1.285 -2.046 77.653 1.00 0.00 C ATOM 529 O GLY A 34 1.227 -2.135 76.443 1.00 0.00 O ATOM 0 H GLY A 34 1.281 -2.426 80.175 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.763 -2.611 78.046 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.364 -0.983 78.557 1.00 0.00 H new ATOM 533 N GLY A 35 2.430 -1.985 78.272 1.00 0.00 N ATOM 534 CA GLY A 35 3.705 -2.025 77.495 1.00 0.00 C ATOM 535 C GLY A 35 4.819 -2.633 78.354 1.00 0.00 C ATOM 536 O GLY A 35 5.989 -2.435 78.094 1.00 0.00 O ATOM 0 H GLY A 35 2.541 -1.909 79.283 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.570 -2.614 76.588 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.983 -1.018 77.183 1.00 0.00 H new ATOM 540 N ARG A 36 4.465 -3.364 79.380 1.00 0.00 N ATOM 541 CA ARG A 36 5.501 -3.980 80.266 1.00 0.00 C ATOM 542 C ARG A 36 5.409 -5.518 80.211 1.00 0.00 C ATOM 543 O ARG A 36 4.826 -6.082 79.306 1.00 0.00 O ATOM 544 CB ARG A 36 5.270 -3.487 81.695 1.00 0.00 C ATOM 545 CG ARG A 36 4.857 -2.008 81.654 1.00 0.00 C ATOM 546 CD ARG A 36 4.939 -1.394 83.060 1.00 0.00 C ATOM 547 NE ARG A 36 5.767 -0.146 83.024 1.00 0.00 N ATOM 548 CZ ARG A 36 6.969 -0.143 82.505 1.00 0.00 C ATOM 549 NH1 ARG A 36 7.500 -1.250 82.062 1.00 0.00 N ATOM 550 NH2 ARG A 36 7.644 0.972 82.439 1.00 0.00 N ATOM 0 H ARG A 36 3.500 -3.562 79.644 1.00 0.00 H new ATOM 0 HA ARG A 36 6.496 -3.690 79.928 1.00 0.00 H new ATOM 0 HB2 ARG A 36 4.494 -4.081 82.177 1.00 0.00 H new ATOM 0 HB3 ARG A 36 6.178 -3.608 82.286 1.00 0.00 H new ATOM 0 HG2 ARG A 36 5.507 -1.460 80.972 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.842 -1.917 81.268 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.938 -1.166 83.426 1.00 0.00 H new ATOM 0 HD3 ARG A 36 5.376 -2.111 83.755 1.00 0.00 H new ATOM 0 HE ARG A 36 5.387 0.718 83.411 1.00 0.00 H new ATOM 0 HH11 ARG A 36 6.978 -2.124 82.119 1.00 0.00 H new ATOM 0 HH12 ARG A 36 8.437 -1.241 81.659 1.00 0.00 H new ATOM 0 HH21 ARG A 36 7.235 1.837 82.791 1.00 0.00 H new ATOM 0 HH22 ARG A 36 8.581 0.978 82.035 1.00 0.00 H new ATOM 564 N LYS A 37 5.998 -6.193 81.171 1.00 0.00 N ATOM 565 CA LYS A 37 5.969 -7.694 81.195 1.00 0.00 C ATOM 566 C LYS A 37 5.675 -8.158 82.642 1.00 0.00 C ATOM 567 O LYS A 37 5.789 -7.372 83.557 1.00 0.00 O ATOM 568 CB LYS A 37 7.331 -8.221 80.717 1.00 0.00 C ATOM 569 CG LYS A 37 8.386 -8.032 81.811 1.00 0.00 C ATOM 570 CD LYS A 37 8.442 -6.558 82.232 1.00 0.00 C ATOM 571 CE LYS A 37 9.745 -6.285 82.986 1.00 0.00 C ATOM 572 NZ LYS A 37 10.046 -4.827 82.938 1.00 0.00 N ATOM 0 H LYS A 37 6.503 -5.765 81.947 1.00 0.00 H new ATOM 0 HA LYS A 37 5.192 -8.081 80.535 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.250 -9.277 80.459 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.636 -7.694 79.813 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.146 -8.656 82.672 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.362 -8.353 81.447 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.378 -5.916 81.353 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.588 -6.318 82.865 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.656 -6.616 84.021 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.562 -6.852 82.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.569 -4.552 83.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.623 -4.619 82.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.157 -4.290 82.888 1.00 0.00 H new ATOM 586 N PRO A 38 5.286 -9.408 82.823 1.00 0.00 N ATOM 587 CA PRO A 38 4.961 -9.935 84.170 1.00 0.00 C ATOM 588 C PRO A 38 6.226 -10.140 85.025 1.00 0.00 C ATOM 589 O PRO A 38 6.287 -11.052 85.828 1.00 0.00 O ATOM 590 CB PRO A 38 4.283 -11.291 83.901 1.00 0.00 C ATOM 591 CG PRO A 38 4.393 -11.577 82.380 1.00 0.00 C ATOM 592 CD PRO A 38 5.124 -10.387 81.730 1.00 0.00 C ATOM 0 HA PRO A 38 4.329 -9.242 84.726 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.766 -12.081 84.475 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.238 -11.265 84.211 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.939 -12.504 82.204 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.403 -11.703 81.942 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.089 -10.689 81.322 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.546 -9.969 80.906 1.00 0.00 H new ATOM 600 N LEU A 39 7.230 -9.312 84.864 1.00 0.00 N ATOM 601 CA LEU A 39 8.482 -9.487 85.671 1.00 0.00 C ATOM 602 C LEU A 39 8.800 -8.195 86.442 1.00 0.00 C ATOM 603 O LEU A 39 9.505 -8.210 87.433 1.00 0.00 O ATOM 604 CB LEU A 39 9.635 -9.816 84.703 1.00 0.00 C ATOM 605 CG LEU A 39 10.886 -10.393 85.420 1.00 0.00 C ATOM 606 CD1 LEU A 39 10.538 -11.055 86.759 1.00 0.00 C ATOM 607 CD2 LEU A 39 11.542 -11.436 84.506 1.00 0.00 C ATOM 0 H LEU A 39 7.239 -8.527 84.213 1.00 0.00 H new ATOM 0 HA LEU A 39 8.352 -10.294 86.392 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.285 -10.534 83.961 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.917 -8.912 84.163 1.00 0.00 H new ATOM 0 HG LEU A 39 11.563 -9.564 85.627 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.446 -11.442 87.220 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.080 -10.319 87.420 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.840 -11.874 86.589 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.422 -11.849 84.998 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.832 -12.237 84.300 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.838 -10.964 83.569 1.00 0.00 H new ATOM 619 N HIS A 40 8.292 -7.075 86.001 1.00 0.00 N ATOM 620 CA HIS A 40 8.586 -5.791 86.713 1.00 0.00 C ATOM 621 C HIS A 40 7.803 -5.722 88.025 1.00 0.00 C ATOM 622 O HIS A 40 8.342 -5.388 89.062 1.00 0.00 O ATOM 623 CB HIS A 40 8.177 -4.609 85.830 1.00 0.00 C ATOM 624 CG HIS A 40 8.474 -3.323 86.552 1.00 0.00 C ATOM 625 ND1 HIS A 40 9.403 -2.337 86.326 1.00 0.00 N flip ATOM 626 CD2 HIS A 40 7.769 -2.927 87.677 1.00 0.00 C flip ATOM 627 CE1 HIS A 40 9.278 -1.345 87.295 1.00 0.00 C flip ATOM 628 NE2 HIS A 40 8.280 -1.750 88.083 1.00 0.00 N flip ATOM 0 H HIS A 40 7.689 -6.991 85.183 1.00 0.00 H new ATOM 0 HA HIS A 40 9.654 -5.747 86.926 1.00 0.00 H new ATOM 0 HB2 HIS A 40 8.718 -4.642 84.885 1.00 0.00 H new ATOM 0 HB3 HIS A 40 7.115 -4.669 85.591 1.00 0.00 H new ATOM 0 HD2 HIS A 40 6.957 -3.465 88.143 1.00 0.00 H new ATOM 0 HE1 HIS A 40 9.863 -0.442 87.389 1.00 0.00 H new ATOM 0 HE2 HIS A 40 7.945 -1.231 88.894 1.00 0.00 H new ATOM 636 N TYR A 41 6.541 -6.034 87.993 1.00 0.00 N ATOM 637 CA TYR A 41 5.733 -5.986 89.242 1.00 0.00 C ATOM 638 C TYR A 41 6.206 -7.099 90.168 1.00 0.00 C ATOM 639 O TYR A 41 6.315 -6.928 91.366 1.00 0.00 O ATOM 640 CB TYR A 41 4.262 -6.182 88.888 1.00 0.00 C ATOM 641 CG TYR A 41 3.984 -5.424 87.617 1.00 0.00 C ATOM 642 CD1 TYR A 41 4.282 -6.001 86.378 1.00 0.00 C ATOM 643 CD2 TYR A 41 3.452 -4.134 87.682 1.00 0.00 C ATOM 644 CE1 TYR A 41 4.047 -5.283 85.200 1.00 0.00 C ATOM 645 CE2 TYR A 41 3.213 -3.418 86.507 1.00 0.00 C ATOM 646 CZ TYR A 41 3.513 -3.991 85.264 1.00 0.00 C ATOM 647 OH TYR A 41 3.288 -3.281 84.103 1.00 0.00 O ATOM 0 H TYR A 41 6.032 -6.320 87.157 1.00 0.00 H new ATOM 0 HA TYR A 41 5.852 -5.025 89.742 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.040 -7.241 88.757 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.624 -5.820 89.695 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.693 -6.999 86.331 1.00 0.00 H new ATOM 0 HD2 TYR A 41 3.226 -3.691 88.640 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.278 -5.726 84.242 1.00 0.00 H new ATOM 0 HE2 TYR A 41 2.797 -2.423 86.556 1.00 0.00 H new ATOM 0 HH TYR A 41 2.814 -2.450 84.315 1.00 0.00 H new ATOM 657 N ALA A 42 6.516 -8.235 89.611 1.00 0.00 N ATOM 658 CA ALA A 42 7.017 -9.361 90.443 1.00 0.00 C ATOM 659 C ALA A 42 8.397 -8.983 90.964 1.00 0.00 C ATOM 660 O ALA A 42 8.673 -9.046 92.144 1.00 0.00 O ATOM 661 CB ALA A 42 7.120 -10.622 89.582 1.00 0.00 C ATOM 0 H ALA A 42 6.444 -8.432 88.613 1.00 0.00 H new ATOM 0 HA ALA A 42 6.339 -9.554 91.274 1.00 0.00 H new ATOM 0 HB1 ALA A 42 7.487 -11.449 90.190 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.136 -10.873 89.185 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.810 -10.444 88.757 1.00 0.00 H new ATOM 667 N ALA A 43 9.260 -8.572 90.085 1.00 0.00 N ATOM 668 CA ALA A 43 10.619 -8.178 90.520 1.00 0.00 C ATOM 669 C ALA A 43 10.508 -7.109 91.611 1.00 0.00 C ATOM 670 O ALA A 43 10.967 -7.290 92.722 1.00 0.00 O ATOM 671 CB ALA A 43 11.375 -7.594 89.321 1.00 0.00 C ATOM 0 H ALA A 43 9.082 -8.492 89.084 1.00 0.00 H new ATOM 0 HA ALA A 43 11.151 -9.047 90.909 1.00 0.00 H new ATOM 0 HB1 ALA A 43 12.378 -7.300 89.631 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.444 -8.345 88.534 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.842 -6.721 88.945 1.00 0.00 H new ATOM 677 N ASP A 44 9.920 -5.989 91.286 1.00 0.00 N ATOM 678 CA ASP A 44 9.793 -4.873 92.270 1.00 0.00 C ATOM 679 C ASP A 44 9.008 -5.282 93.525 1.00 0.00 C ATOM 680 O ASP A 44 9.224 -4.740 94.588 1.00 0.00 O ATOM 681 CB ASP A 44 9.083 -3.693 91.603 1.00 0.00 C ATOM 682 CG ASP A 44 10.080 -2.930 90.730 1.00 0.00 C ATOM 683 OD1 ASP A 44 11.144 -3.469 90.473 1.00 0.00 O ATOM 684 OD2 ASP A 44 9.764 -1.820 90.335 1.00 0.00 O ATOM 0 H ASP A 44 9.517 -5.797 90.369 1.00 0.00 H new ATOM 0 HA ASP A 44 10.800 -4.599 92.584 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.251 -4.050 90.997 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.664 -3.031 92.361 1.00 0.00 H new ATOM 689 N CYS A 45 8.093 -6.206 93.430 1.00 0.00 N ATOM 690 CA CYS A 45 7.311 -6.582 94.650 1.00 0.00 C ATOM 691 C CYS A 45 6.682 -7.957 94.460 1.00 0.00 C ATOM 692 O CYS A 45 5.483 -8.121 94.560 1.00 0.00 O ATOM 693 CB CYS A 45 6.192 -5.559 94.880 1.00 0.00 C ATOM 694 SG CYS A 45 6.891 -4.026 95.536 1.00 0.00 S ATOM 0 H CYS A 45 7.852 -6.712 92.578 1.00 0.00 H new ATOM 0 HA CYS A 45 7.984 -6.599 95.507 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.670 -5.360 93.944 1.00 0.00 H new ATOM 0 HB3 CYS A 45 5.456 -5.961 95.576 1.00 0.00 H new ATOM 0 HG CYS A 45 8.178 -4.023 95.353 1.00 0.00 H new ATOM 700 N GLY A 46 7.484 -8.947 94.193 1.00 0.00 N ATOM 701 CA GLY A 46 6.939 -10.325 94.002 1.00 0.00 C ATOM 702 C GLY A 46 7.433 -11.230 95.129 1.00 0.00 C ATOM 703 O GLY A 46 7.709 -12.394 94.920 1.00 0.00 O ATOM 0 H GLY A 46 8.496 -8.865 94.098 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.849 -10.299 93.994 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.255 -10.722 93.037 1.00 0.00 H new ATOM 707 N GLN A 47 7.571 -10.709 96.318 1.00 0.00 N ATOM 708 CA GLN A 47 8.076 -11.559 97.430 1.00 0.00 C ATOM 709 C GLN A 47 9.366 -12.230 96.949 1.00 0.00 C ATOM 710 O GLN A 47 9.832 -13.206 97.503 1.00 0.00 O ATOM 711 CB GLN A 47 7.016 -12.604 97.798 1.00 0.00 C ATOM 712 CG GLN A 47 5.958 -11.964 98.703 1.00 0.00 C ATOM 713 CD GLN A 47 5.550 -10.595 98.149 1.00 0.00 C ATOM 714 OE1 GLN A 47 5.185 -10.489 96.901 1.00 0.00 O flip ATOM 715 NE2 GLN A 47 5.561 -9.611 98.863 1.00 0.00 N flip ATOM 0 H GLN A 47 7.358 -9.742 96.565 1.00 0.00 H new ATOM 0 HA GLN A 47 8.280 -10.964 98.320 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.548 -12.996 96.895 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.483 -13.447 98.307 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.085 -12.613 98.770 1.00 0.00 H new ATOM 0 HG3 GLN A 47 6.351 -11.854 99.714 1.00 0.00 H new ATOM 0 HE21 GLN A 47 5.846 -9.692 99.839 1.00 0.00 H new ATOM 0 HE22 GLN A 47 5.285 -8.704 98.486 1.00 0.00 H new ATOM 724 N LEU A 48 9.942 -11.673 95.917 1.00 0.00 N ATOM 725 CA LEU A 48 11.221 -12.194 95.342 1.00 0.00 C ATOM 726 C LEU A 48 11.078 -13.639 94.868 1.00 0.00 C ATOM 727 O LEU A 48 12.026 -14.245 94.415 1.00 0.00 O ATOM 728 CB LEU A 48 12.326 -12.117 96.392 1.00 0.00 C ATOM 729 CG LEU A 48 12.779 -10.656 96.642 1.00 0.00 C ATOM 730 CD1 LEU A 48 12.125 -9.668 95.666 1.00 0.00 C ATOM 731 CD2 LEU A 48 12.423 -10.241 98.073 1.00 0.00 C ATOM 0 H LEU A 48 9.570 -10.855 95.434 1.00 0.00 H new ATOM 0 HA LEU A 48 11.475 -11.576 94.481 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.971 -12.553 97.326 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.179 -12.712 96.066 1.00 0.00 H new ATOM 0 HG LEU A 48 13.857 -10.624 96.487 1.00 0.00 H new ATOM 0 HD11 LEU A 48 12.474 -8.658 95.882 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.394 -9.934 94.644 1.00 0.00 H new ATOM 0 HD13 LEU A 48 11.042 -9.709 95.778 1.00 0.00 H new ATOM 0 HD21 LEU A 48 12.743 -9.213 98.244 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.345 -10.313 98.215 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.927 -10.901 98.779 1.00 0.00 H new ATOM 743 N GLU A 49 9.914 -14.189 94.965 1.00 0.00 N ATOM 744 CA GLU A 49 9.707 -15.593 94.501 1.00 0.00 C ATOM 745 C GLU A 49 9.068 -15.585 93.115 1.00 0.00 C ATOM 746 O GLU A 49 9.370 -16.408 92.274 1.00 0.00 O ATOM 747 CB GLU A 49 8.791 -16.334 95.475 1.00 0.00 C ATOM 748 CG GLU A 49 7.684 -15.392 95.936 1.00 0.00 C ATOM 749 CD GLU A 49 6.656 -16.167 96.766 1.00 0.00 C ATOM 750 OE1 GLU A 49 6.955 -17.285 97.155 1.00 0.00 O ATOM 751 OE2 GLU A 49 5.587 -15.628 96.999 1.00 0.00 O ATOM 0 H GLU A 49 9.086 -13.732 95.347 1.00 0.00 H new ATOM 0 HA GLU A 49 10.672 -16.099 94.457 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.361 -17.212 94.992 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.363 -16.690 96.332 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.107 -14.581 96.529 1.00 0.00 H new ATOM 0 HG3 GLU A 49 7.199 -14.936 95.073 1.00 0.00 H new ATOM 758 N ILE A 50 8.160 -14.679 92.883 1.00 0.00 N ATOM 759 CA ILE A 50 7.470 -14.633 91.565 1.00 0.00 C ATOM 760 C ILE A 50 8.447 -14.315 90.445 1.00 0.00 C ATOM 761 O ILE A 50 8.306 -14.803 89.340 1.00 0.00 O ATOM 762 CB ILE A 50 6.387 -13.554 91.583 1.00 0.00 C ATOM 763 CG1 ILE A 50 5.532 -13.706 92.866 1.00 0.00 C ATOM 764 CG2 ILE A 50 5.531 -13.697 90.315 1.00 0.00 C ATOM 765 CD1 ILE A 50 4.035 -13.627 92.550 1.00 0.00 C ATOM 0 H ILE A 50 7.866 -13.967 93.551 1.00 0.00 H new ATOM 0 HA ILE A 50 7.029 -15.614 91.387 1.00 0.00 H new ATOM 0 HB ILE A 50 6.831 -12.559 91.593 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.755 -14.660 93.343 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.797 -12.924 93.577 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.753 -12.933 90.313 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.162 -13.575 89.434 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.070 -14.685 90.297 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.462 -13.737 93.471 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.809 -12.662 92.096 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.767 -14.425 91.858 1.00 0.00 H new ATOM 777 N LEU A 51 9.414 -13.482 90.691 1.00 0.00 N ATOM 778 CA LEU A 51 10.345 -13.138 89.591 1.00 0.00 C ATOM 779 C LEU A 51 11.118 -14.385 89.134 1.00 0.00 C ATOM 780 O LEU A 51 11.015 -14.785 87.995 1.00 0.00 O ATOM 781 CB LEU A 51 11.321 -11.986 89.960 1.00 0.00 C ATOM 782 CG LEU A 51 11.530 -11.779 91.471 1.00 0.00 C ATOM 783 CD1 LEU A 51 10.222 -11.411 92.185 1.00 0.00 C ATOM 784 CD2 LEU A 51 12.144 -13.026 92.097 1.00 0.00 C ATOM 0 H LEU A 51 9.597 -13.033 91.588 1.00 0.00 H new ATOM 0 HA LEU A 51 9.736 -12.772 88.764 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.288 -12.185 89.497 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.946 -11.058 89.528 1.00 0.00 H new ATOM 0 HG LEU A 51 12.217 -10.942 91.595 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.414 -11.274 93.249 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.826 -10.486 91.766 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.495 -12.211 92.048 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.286 -12.865 93.166 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.478 -13.875 91.944 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.107 -13.231 91.630 1.00 0.00 H new ATOM 796 N GLU A 52 11.892 -15.008 89.983 1.00 0.00 N ATOM 797 CA GLU A 52 12.644 -16.214 89.523 1.00 0.00 C ATOM 798 C GLU A 52 11.667 -17.315 89.088 1.00 0.00 C ATOM 799 O GLU A 52 12.023 -18.213 88.351 1.00 0.00 O ATOM 800 CB GLU A 52 13.579 -16.738 90.623 1.00 0.00 C ATOM 801 CG GLU A 52 12.815 -16.970 91.918 1.00 0.00 C ATOM 802 CD GLU A 52 11.925 -18.207 91.774 1.00 0.00 C ATOM 803 OE1 GLU A 52 12.318 -19.116 91.060 1.00 0.00 O ATOM 804 OE2 GLU A 52 10.865 -18.222 92.375 1.00 0.00 O ATOM 0 H GLU A 52 12.035 -14.742 90.957 1.00 0.00 H new ATOM 0 HA GLU A 52 13.256 -15.924 88.669 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.044 -17.669 90.298 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.384 -16.023 90.794 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.513 -17.106 92.744 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.206 -16.097 92.155 1.00 0.00 H new ATOM 811 N PHE A 53 10.445 -17.268 89.552 1.00 0.00 N ATOM 812 CA PHE A 53 9.465 -18.329 89.178 1.00 0.00 C ATOM 813 C PHE A 53 9.195 -18.339 87.674 1.00 0.00 C ATOM 814 O PHE A 53 9.676 -19.188 86.951 1.00 0.00 O ATOM 815 CB PHE A 53 8.137 -18.086 89.894 1.00 0.00 C ATOM 816 CG PHE A 53 7.076 -18.970 89.277 1.00 0.00 C ATOM 817 CD1 PHE A 53 7.255 -20.360 89.249 1.00 0.00 C ATOM 818 CD2 PHE A 53 5.924 -18.401 88.722 1.00 0.00 C ATOM 819 CE1 PHE A 53 6.282 -21.178 88.669 1.00 0.00 C ATOM 820 CE2 PHE A 53 4.950 -19.220 88.144 1.00 0.00 C ATOM 821 CZ PHE A 53 5.129 -20.610 88.117 1.00 0.00 C ATOM 0 H PHE A 53 10.085 -16.543 90.172 1.00 0.00 H new ATOM 0 HA PHE A 53 9.896 -19.286 89.472 1.00 0.00 H new ATOM 0 HB2 PHE A 53 8.237 -18.304 90.957 1.00 0.00 H new ATOM 0 HB3 PHE A 53 7.850 -17.038 89.809 1.00 0.00 H new ATOM 0 HD1 PHE A 53 8.145 -20.799 89.676 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.788 -17.330 88.740 1.00 0.00 H new ATOM 0 HE1 PHE A 53 6.420 -22.249 88.647 1.00 0.00 H new ATOM 0 HE2 PHE A 53 4.059 -18.782 87.718 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.376 -21.243 87.670 1.00 0.00 H new ATOM 831 N LEU A 54 8.392 -17.425 87.204 1.00 0.00 N ATOM 832 CA LEU A 54 8.061 -17.412 85.754 1.00 0.00 C ATOM 833 C LEU A 54 9.344 -17.249 84.938 1.00 0.00 C ATOM 834 O LEU A 54 9.404 -17.608 83.780 1.00 0.00 O ATOM 835 CB LEU A 54 7.076 -16.275 85.426 1.00 0.00 C ATOM 836 CG LEU A 54 7.067 -15.208 86.520 1.00 0.00 C ATOM 837 CD1 LEU A 54 8.446 -14.567 86.633 1.00 0.00 C ATOM 838 CD2 LEU A 54 6.035 -14.136 86.160 1.00 0.00 C ATOM 0 H LEU A 54 7.953 -16.690 87.759 1.00 0.00 H new ATOM 0 HA LEU A 54 7.584 -18.358 85.496 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.349 -15.819 84.474 1.00 0.00 H new ATOM 0 HB3 LEU A 54 6.073 -16.684 85.307 1.00 0.00 H new ATOM 0 HG LEU A 54 6.810 -15.668 87.474 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.431 -13.808 87.415 1.00 0.00 H new ATOM 0 HD12 LEU A 54 9.183 -15.331 86.883 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.711 -14.104 85.682 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.021 -13.370 86.935 1.00 0.00 H new ATOM 0 HD22 LEU A 54 6.300 -13.682 85.205 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.048 -14.592 86.083 1.00 0.00 H new ATOM 850 N LEU A 55 10.372 -16.725 85.534 1.00 0.00 N ATOM 851 CA LEU A 55 11.654 -16.555 84.792 1.00 0.00 C ATOM 852 C LEU A 55 12.247 -17.938 84.497 1.00 0.00 C ATOM 853 O LEU A 55 12.817 -18.169 83.449 1.00 0.00 O ATOM 854 CB LEU A 55 12.629 -15.736 85.651 1.00 0.00 C ATOM 855 CG LEU A 55 13.731 -15.105 84.789 1.00 0.00 C ATOM 856 CD1 LEU A 55 14.561 -14.160 85.665 1.00 0.00 C ATOM 857 CD2 LEU A 55 14.649 -16.192 84.218 1.00 0.00 C ATOM 0 H LEU A 55 10.384 -16.406 86.503 1.00 0.00 H new ATOM 0 HA LEU A 55 11.478 -16.031 83.853 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.084 -14.954 86.179 1.00 0.00 H new ATOM 0 HB3 LEU A 55 13.079 -16.378 86.408 1.00 0.00 H new ATOM 0 HG LEU A 55 13.273 -14.559 83.964 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.348 -13.705 85.064 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.917 -13.380 86.071 1.00 0.00 H new ATOM 0 HD13 LEU A 55 15.009 -14.723 86.484 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.426 -15.729 83.609 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.111 -16.745 85.036 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.064 -16.876 83.603 1.00 0.00 H new ATOM 869 N LEU A 56 12.116 -18.861 85.417 1.00 0.00 N ATOM 870 CA LEU A 56 12.673 -20.225 85.189 1.00 0.00 C ATOM 871 C LEU A 56 11.969 -20.867 83.991 1.00 0.00 C ATOM 872 O LEU A 56 12.585 -21.547 83.193 1.00 0.00 O ATOM 873 CB LEU A 56 12.556 -21.075 86.475 1.00 0.00 C ATOM 874 CG LEU A 56 11.252 -21.887 86.518 1.00 0.00 C ATOM 875 CD1 LEU A 56 11.463 -23.254 85.854 1.00 0.00 C ATOM 876 CD2 LEU A 56 10.854 -22.110 87.981 1.00 0.00 C ATOM 0 H LEU A 56 11.648 -18.727 86.313 1.00 0.00 H new ATOM 0 HA LEU A 56 13.735 -20.162 84.953 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.407 -21.754 86.539 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.604 -20.421 87.346 1.00 0.00 H new ATOM 0 HG LEU A 56 10.472 -21.341 85.987 1.00 0.00 H new ATOM 0 HD11 LEU A 56 10.534 -23.823 85.889 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.763 -23.112 84.816 1.00 0.00 H new ATOM 0 HD13 LEU A 56 12.243 -23.800 86.385 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.929 -22.686 88.023 1.00 0.00 H new ATOM 0 HD22 LEU A 56 11.645 -22.657 88.494 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.704 -21.147 88.468 1.00 0.00 H new ATOM 888 N LYS A 57 10.701 -20.619 83.821 1.00 0.00 N ATOM 889 CA LYS A 57 10.008 -21.177 82.630 1.00 0.00 C ATOM 890 C LYS A 57 10.603 -20.463 81.412 1.00 0.00 C ATOM 891 O LYS A 57 11.680 -20.797 80.958 1.00 0.00 O ATOM 892 CB LYS A 57 8.493 -20.915 82.719 1.00 0.00 C ATOM 893 CG LYS A 57 7.762 -22.202 83.112 1.00 0.00 C ATOM 894 CD LYS A 57 8.097 -22.567 84.559 1.00 0.00 C ATOM 895 CE LYS A 57 7.209 -23.729 85.015 1.00 0.00 C ATOM 896 NZ LYS A 57 7.814 -24.377 86.213 1.00 0.00 N ATOM 0 H LYS A 57 10.121 -20.061 84.447 1.00 0.00 H new ATOM 0 HA LYS A 57 10.146 -22.256 82.562 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.293 -20.135 83.453 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.121 -20.554 81.760 1.00 0.00 H new ATOM 0 HG2 LYS A 57 6.686 -22.068 83.001 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.053 -23.014 82.446 1.00 0.00 H new ATOM 0 HD2 LYS A 57 9.148 -22.845 84.640 1.00 0.00 H new ATOM 0 HD3 LYS A 57 7.945 -21.704 85.207 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.209 -23.365 85.251 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.102 -24.456 84.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.118 -25.012 86.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 8.650 -24.925 85.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 8.097 -23.647 86.897 1.00 0.00 H new ATOM 910 N GLY A 58 9.943 -19.450 80.912 1.00 0.00 N ATOM 911 CA GLY A 58 10.511 -18.691 79.767 1.00 0.00 C ATOM 912 C GLY A 58 11.617 -17.798 80.329 1.00 0.00 C ATOM 913 O GLY A 58 12.415 -18.247 81.126 1.00 0.00 O ATOM 0 H GLY A 58 9.039 -19.119 81.248 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.909 -19.370 79.013 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.741 -18.092 79.281 1.00 0.00 H new ATOM 917 N ALA A 59 11.668 -16.540 79.967 1.00 0.00 N ATOM 918 CA ALA A 59 12.730 -15.662 80.544 1.00 0.00 C ATOM 919 C ALA A 59 12.680 -14.251 79.942 1.00 0.00 C ATOM 920 O ALA A 59 13.464 -13.899 79.083 1.00 0.00 O ATOM 921 CB ALA A 59 14.114 -16.275 80.300 1.00 0.00 C ATOM 0 H ALA A 59 11.032 -16.090 79.309 1.00 0.00 H new ATOM 0 HA ALA A 59 12.548 -15.584 81.616 1.00 0.00 H new ATOM 0 HB1 ALA A 59 14.880 -15.626 80.725 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.166 -17.256 80.773 1.00 0.00 H new ATOM 0 HB3 ALA A 59 14.282 -16.380 79.228 1.00 0.00 H new ATOM 927 N ASP A 60 11.793 -13.426 80.428 1.00 0.00 N ATOM 928 CA ASP A 60 11.727 -12.023 79.936 1.00 0.00 C ATOM 929 C ASP A 60 12.896 -11.281 80.580 1.00 0.00 C ATOM 930 O ASP A 60 13.063 -10.084 80.445 1.00 0.00 O ATOM 931 CB ASP A 60 10.398 -11.392 80.367 1.00 0.00 C ATOM 932 CG ASP A 60 10.155 -10.099 79.586 1.00 0.00 C ATOM 933 OD1 ASP A 60 10.858 -9.135 79.841 1.00 0.00 O ATOM 934 OD2 ASP A 60 9.270 -10.096 78.747 1.00 0.00 O ATOM 0 H ASP A 60 11.110 -13.665 81.147 1.00 0.00 H new ATOM 0 HA ASP A 60 11.787 -11.975 78.849 1.00 0.00 H new ATOM 0 HB2 ASP A 60 9.580 -12.091 80.192 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.415 -11.183 81.437 1.00 0.00 H new ATOM 939 N ILE A 61 13.695 -12.019 81.299 1.00 0.00 N ATOM 940 CA ILE A 61 14.873 -11.446 82.006 1.00 0.00 C ATOM 941 C ILE A 61 15.749 -10.655 81.043 1.00 0.00 C ATOM 942 O ILE A 61 16.463 -9.755 81.439 1.00 0.00 O ATOM 943 CB ILE A 61 15.691 -12.601 82.577 1.00 0.00 C ATOM 944 CG1 ILE A 61 16.743 -12.067 83.550 1.00 0.00 C ATOM 945 CG2 ILE A 61 16.384 -13.336 81.430 1.00 0.00 C ATOM 946 CD1 ILE A 61 17.757 -13.171 83.879 1.00 0.00 C ATOM 0 H ILE A 61 13.576 -13.024 81.429 1.00 0.00 H new ATOM 0 HA ILE A 61 14.529 -10.776 82.794 1.00 0.00 H new ATOM 0 HB ILE A 61 15.030 -13.284 83.110 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.255 -11.210 83.112 1.00 0.00 H new ATOM 0 HG13 ILE A 61 16.262 -11.718 84.464 1.00 0.00 H new ATOM 0 HG21 ILE A 61 16.971 -14.163 81.830 1.00 0.00 H new ATOM 0 HG22 ILE A 61 15.634 -13.723 80.740 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.042 -12.647 80.901 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.504 -12.784 84.573 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.240 -14.015 84.336 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.248 -13.499 82.963 1.00 0.00 H new ATOM 958 N ASN A 62 15.722 -10.999 79.791 1.00 0.00 N ATOM 959 CA ASN A 62 16.584 -10.281 78.808 1.00 0.00 C ATOM 960 C ASN A 62 15.793 -9.941 77.542 1.00 0.00 C ATOM 961 O ASN A 62 15.961 -8.892 76.960 1.00 0.00 O ATOM 962 CB ASN A 62 17.778 -11.174 78.448 1.00 0.00 C ATOM 963 CG ASN A 62 17.281 -12.530 77.931 1.00 0.00 C ATOM 964 OD1 ASN A 62 16.107 -12.968 78.300 1.00 0.00 O flip ATOM 965 ND2 ASN A 62 17.970 -13.195 77.184 1.00 0.00 N flip ATOM 0 H ASN A 62 15.144 -11.744 79.402 1.00 0.00 H new ATOM 0 HA ASN A 62 16.934 -9.350 79.254 1.00 0.00 H new ATOM 0 HB2 ASN A 62 18.390 -10.688 77.688 1.00 0.00 H new ATOM 0 HB3 ASN A 62 18.411 -11.319 79.323 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.887 -12.853 76.896 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.632 -14.096 76.845 1.00 0.00 H new ATOM 972 N ALA A 63 14.930 -10.825 77.133 1.00 0.00 N ATOM 973 CA ALA A 63 14.081 -10.618 75.907 1.00 0.00 C ATOM 974 C ALA A 63 13.893 -9.134 75.519 1.00 0.00 C ATOM 975 O ALA A 63 14.163 -8.782 74.388 1.00 0.00 O ATOM 976 CB ALA A 63 12.716 -11.262 76.144 1.00 0.00 C ATOM 0 H ALA A 63 14.766 -11.713 77.606 1.00 0.00 H new ATOM 0 HA ALA A 63 14.605 -11.084 75.073 1.00 0.00 H new ATOM 0 HB1 ALA A 63 12.089 -11.120 75.264 1.00 0.00 H new ATOM 0 HB2 ALA A 63 12.844 -12.328 76.330 1.00 0.00 H new ATOM 0 HB3 ALA A 63 12.240 -10.798 77.007 1.00 0.00 H new ATOM 982 N PRO A 64 13.441 -8.308 76.438 1.00 0.00 N ATOM 983 CA PRO A 64 13.210 -6.874 76.201 1.00 0.00 C ATOM 984 C PRO A 64 13.920 -6.327 74.955 1.00 0.00 C ATOM 985 O PRO A 64 15.094 -6.550 74.725 1.00 0.00 O ATOM 986 CB PRO A 64 13.714 -6.268 77.509 1.00 0.00 C ATOM 987 CG PRO A 64 13.499 -7.378 78.590 1.00 0.00 C ATOM 988 CD PRO A 64 13.142 -8.675 77.828 1.00 0.00 C ATOM 0 HA PRO A 64 12.171 -6.632 75.976 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.765 -5.991 77.434 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.163 -5.362 77.761 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.400 -7.516 79.188 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.700 -7.100 79.277 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.740 -9.522 78.163 1.00 0.00 H new ATOM 0 HD3 PRO A 64 12.096 -8.951 77.961 1.00 0.00 H new ATOM 996 N ASP A 65 13.164 -5.606 74.159 1.00 0.00 N ATOM 997 CA ASP A 65 13.684 -4.998 72.902 1.00 0.00 C ATOM 998 C ASP A 65 13.159 -3.560 72.801 1.00 0.00 C ATOM 999 O ASP A 65 13.896 -2.630 72.540 1.00 0.00 O ATOM 1000 CB ASP A 65 13.164 -5.802 71.707 1.00 0.00 C ATOM 1001 CG ASP A 65 13.984 -7.083 71.548 1.00 0.00 C ATOM 1002 OD1 ASP A 65 15.196 -6.981 71.452 1.00 0.00 O ATOM 1003 OD2 ASP A 65 13.384 -8.145 71.527 1.00 0.00 O ATOM 0 H ASP A 65 12.179 -5.411 74.339 1.00 0.00 H new ATOM 0 HA ASP A 65 14.774 -5.002 72.905 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.112 -6.048 71.853 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.228 -5.203 70.799 1.00 0.00 H new ATOM 1008 N LYS A 66 11.875 -3.376 73.016 1.00 0.00 N ATOM 1009 CA LYS A 66 11.277 -2.017 72.949 1.00 0.00 C ATOM 1010 C LYS A 66 11.402 -1.354 74.321 1.00 0.00 C ATOM 1011 O LYS A 66 11.461 -0.145 74.441 1.00 0.00 O ATOM 1012 CB LYS A 66 9.809 -2.151 72.572 1.00 0.00 C ATOM 1013 CG LYS A 66 9.226 -0.772 72.315 1.00 0.00 C ATOM 1014 CD LYS A 66 9.731 -0.220 70.975 1.00 0.00 C ATOM 1015 CE LYS A 66 8.751 0.836 70.451 1.00 0.00 C ATOM 1016 NZ LYS A 66 7.668 0.168 69.675 1.00 0.00 N ATOM 0 H LYS A 66 11.216 -4.122 73.237 1.00 0.00 H new ATOM 0 HA LYS A 66 11.791 -1.408 72.205 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.706 -2.773 71.683 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.260 -2.646 73.373 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.137 -0.826 72.306 1.00 0.00 H new ATOM 0 HG3 LYS A 66 9.505 -0.096 73.123 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.721 0.219 71.101 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.831 -1.029 70.251 1.00 0.00 H new ATOM 0 HE2 LYS A 66 8.324 1.396 71.283 1.00 0.00 H new ATOM 0 HE3 LYS A 66 9.276 1.553 69.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 7.003 0.884 69.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.083 -0.348 68.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.161 -0.500 70.291 1.00 0.00 H new ATOM 1030 N HIS A 67 11.456 -2.148 75.350 1.00 0.00 N ATOM 1031 CA HIS A 67 11.592 -1.607 76.723 1.00 0.00 C ATOM 1032 C HIS A 67 13.054 -1.254 76.960 1.00 0.00 C ATOM 1033 O HIS A 67 13.412 -0.692 77.975 1.00 0.00 O ATOM 1034 CB HIS A 67 11.168 -2.687 77.713 1.00 0.00 C ATOM 1035 CG HIS A 67 9.793 -3.179 77.366 1.00 0.00 C ATOM 1036 ND1 HIS A 67 9.291 -4.370 77.863 1.00 0.00 N ATOM 1037 CD2 HIS A 67 8.805 -2.659 76.567 1.00 0.00 C ATOM 1038 CE1 HIS A 67 8.053 -4.528 77.362 1.00 0.00 C ATOM 1039 NE2 HIS A 67 7.706 -3.512 76.566 1.00 0.00 N ATOM 0 H HIS A 67 11.411 -3.165 75.294 1.00 0.00 H new ATOM 0 HA HIS A 67 10.970 -0.721 76.851 1.00 0.00 H new ATOM 0 HB2 HIS A 67 11.877 -3.514 77.690 1.00 0.00 H new ATOM 0 HB3 HIS A 67 11.177 -2.288 78.727 1.00 0.00 H new ATOM 0 HD2 HIS A 67 8.871 -1.729 76.022 1.00 0.00 H new ATOM 0 HE1 HIS A 67 7.416 -5.373 77.577 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.826 -3.389 76.066 1.00 0.00 H new ATOM 1047 N HIS A 68 13.896 -1.581 76.021 1.00 0.00 N ATOM 1048 CA HIS A 68 15.341 -1.276 76.165 1.00 0.00 C ATOM 1049 C HIS A 68 15.795 -1.550 77.594 1.00 0.00 C ATOM 1050 O HIS A 68 16.751 -0.963 78.065 1.00 0.00 O ATOM 1051 CB HIS A 68 15.588 0.196 75.837 1.00 0.00 C ATOM 1052 CG HIS A 68 17.069 0.451 75.768 1.00 0.00 C ATOM 1053 ND1 HIS A 68 17.993 -0.577 75.663 1.00 0.00 N ATOM 1054 CD2 HIS A 68 17.801 1.612 75.787 1.00 0.00 C ATOM 1055 CE1 HIS A 68 19.217 -0.020 75.623 1.00 0.00 C ATOM 1056 NE2 HIS A 68 19.157 1.312 75.695 1.00 0.00 N ATOM 0 H HIS A 68 13.640 -2.051 75.153 1.00 0.00 H new ATOM 0 HA HIS A 68 15.904 -1.909 75.479 1.00 0.00 H new ATOM 0 HB2 HIS A 68 15.119 0.452 74.887 1.00 0.00 H new ATOM 0 HB3 HIS A 68 15.134 0.831 76.598 1.00 0.00 H new ATOM 0 HD2 HIS A 68 17.388 2.607 75.862 1.00 0.00 H new ATOM 0 HE1 HIS A 68 20.136 -0.582 75.542 1.00 0.00 H new ATOM 0 HE2 HIS A 68 19.937 1.969 75.685 1.00 0.00 H new ATOM 1064 N ILE A 69 15.144 -2.432 78.301 1.00 0.00 N ATOM 1065 CA ILE A 69 15.606 -2.690 79.684 1.00 0.00 C ATOM 1066 C ILE A 69 15.211 -4.076 80.169 1.00 0.00 C ATOM 1067 O ILE A 69 14.199 -4.647 79.791 1.00 0.00 O ATOM 1068 CB ILE A 69 15.033 -1.626 80.629 1.00 0.00 C ATOM 1069 CG1 ILE A 69 16.184 -0.946 81.379 1.00 0.00 C ATOM 1070 CG2 ILE A 69 14.068 -2.274 81.639 1.00 0.00 C ATOM 1071 CD1 ILE A 69 16.965 -1.974 82.204 1.00 0.00 C ATOM 0 H ILE A 69 14.335 -2.969 77.989 1.00 0.00 H new ATOM 0 HA ILE A 69 16.695 -2.640 79.683 1.00 0.00 H new ATOM 0 HB ILE A 69 14.484 -0.887 80.046 1.00 0.00 H new ATOM 0 HG12 ILE A 69 16.851 -0.458 80.669 1.00 0.00 H new ATOM 0 HG13 ILE A 69 15.791 -0.168 82.033 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.669 -1.508 82.304 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.248 -2.753 81.103 1.00 0.00 H new ATOM 0 HG23 ILE A 69 14.603 -3.020 82.226 1.00 0.00 H new ATOM 0 HD11 ILE A 69 17.779 -1.475 82.731 1.00 0.00 H new ATOM 0 HD12 ILE A 69 16.298 -2.442 82.928 1.00 0.00 H new ATOM 0 HD13 ILE A 69 17.375 -2.737 81.542 1.00 0.00 H new ATOM 1083 N THR A 70 16.028 -4.590 81.042 1.00 0.00 N ATOM 1084 CA THR A 70 15.792 -5.915 81.649 1.00 0.00 C ATOM 1085 C THR A 70 15.295 -5.667 83.091 1.00 0.00 C ATOM 1086 O THR A 70 15.448 -4.574 83.600 1.00 0.00 O ATOM 1087 CB THR A 70 17.115 -6.693 81.599 1.00 0.00 C ATOM 1088 OG1 THR A 70 17.145 -7.655 82.632 1.00 0.00 O ATOM 1089 CG2 THR A 70 18.278 -5.706 81.741 1.00 0.00 C ATOM 0 H THR A 70 16.876 -4.126 81.367 1.00 0.00 H new ATOM 0 HA THR A 70 15.042 -6.506 81.124 1.00 0.00 H new ATOM 0 HB THR A 70 17.205 -7.215 80.646 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.095 -8.553 82.244 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.222 -6.249 81.707 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.245 -4.984 80.925 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.196 -5.181 82.693 1.00 0.00 H new ATOM 1097 N PRO A 71 14.647 -6.632 83.689 1.00 0.00 N ATOM 1098 CA PRO A 71 14.059 -6.448 85.033 1.00 0.00 C ATOM 1099 C PRO A 71 15.097 -6.320 86.169 1.00 0.00 C ATOM 1100 O PRO A 71 14.756 -5.862 87.238 1.00 0.00 O ATOM 1101 CB PRO A 71 13.168 -7.692 85.218 1.00 0.00 C ATOM 1102 CG PRO A 71 13.205 -8.475 83.883 1.00 0.00 C ATOM 1103 CD PRO A 71 14.425 -7.966 83.114 1.00 0.00 C ATOM 0 HA PRO A 71 13.513 -5.506 85.092 1.00 0.00 H new ATOM 0 HB2 PRO A 71 13.533 -8.310 86.038 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.147 -7.402 85.467 1.00 0.00 H new ATOM 0 HG2 PRO A 71 13.280 -9.547 84.064 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.291 -8.312 83.312 1.00 0.00 H new ATOM 0 HD2 PRO A 71 15.290 -8.615 83.254 1.00 0.00 H new ATOM 0 HD3 PRO A 71 14.234 -7.917 82.042 1.00 0.00 H new ATOM 1111 N LEU A 72 16.344 -6.710 86.004 1.00 0.00 N ATOM 1112 CA LEU A 72 17.267 -6.558 87.173 1.00 0.00 C ATOM 1113 C LEU A 72 17.239 -5.103 87.629 1.00 0.00 C ATOM 1114 O LEU A 72 17.242 -4.827 88.811 1.00 0.00 O ATOM 1115 CB LEU A 72 18.744 -6.953 86.889 1.00 0.00 C ATOM 1116 CG LEU A 72 18.928 -7.870 85.671 1.00 0.00 C ATOM 1117 CD1 LEU A 72 17.843 -8.955 85.601 1.00 0.00 C ATOM 1118 CD2 LEU A 72 18.938 -7.042 84.388 1.00 0.00 C ATOM 0 H LEU A 72 16.745 -7.107 85.154 1.00 0.00 H new ATOM 0 HA LEU A 72 16.905 -7.246 87.937 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.328 -6.045 86.738 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.151 -7.451 87.769 1.00 0.00 H new ATOM 0 HG LEU A 72 19.887 -8.377 85.779 1.00 0.00 H new ATOM 0 HD11 LEU A 72 18.011 -9.581 84.725 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.885 -9.570 86.500 1.00 0.00 H new ATOM 0 HD13 LEU A 72 16.862 -8.485 85.528 1.00 0.00 H new ATOM 0 HD21 LEU A 72 19.069 -7.702 83.530 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.993 -6.507 84.293 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.759 -6.326 84.424 1.00 0.00 H new ATOM 1130 N LEU A 73 17.211 -4.164 86.714 1.00 0.00 N ATOM 1131 CA LEU A 73 17.189 -2.733 87.142 1.00 0.00 C ATOM 1132 C LEU A 73 15.825 -2.406 87.743 1.00 0.00 C ATOM 1133 O LEU A 73 15.676 -1.481 88.520 1.00 0.00 O ATOM 1134 CB LEU A 73 17.479 -1.805 85.958 1.00 0.00 C ATOM 1135 CG LEU A 73 18.852 -2.152 85.358 1.00 0.00 C ATOM 1136 CD1 LEU A 73 18.713 -3.302 84.353 1.00 0.00 C ATOM 1137 CD2 LEU A 73 19.431 -0.924 84.643 1.00 0.00 C ATOM 0 H LEU A 73 17.203 -4.323 85.707 1.00 0.00 H new ATOM 0 HA LEU A 73 17.965 -2.578 87.891 1.00 0.00 H new ATOM 0 HB2 LEU A 73 16.702 -1.911 85.201 1.00 0.00 H new ATOM 0 HB3 LEU A 73 17.466 -0.765 86.285 1.00 0.00 H new ATOM 0 HG LEU A 73 19.520 -2.456 86.164 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.691 -3.539 83.934 1.00 0.00 H new ATOM 0 HD12 LEU A 73 18.312 -4.180 84.858 1.00 0.00 H new ATOM 0 HD13 LEU A 73 18.037 -3.005 83.551 1.00 0.00 H new ATOM 0 HD21 LEU A 73 20.404 -1.175 84.220 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.756 -0.616 83.844 1.00 0.00 H new ATOM 0 HD23 LEU A 73 19.545 -0.108 85.356 1.00 0.00 H new ATOM 1149 N SER A 74 14.824 -3.159 87.401 1.00 0.00 N ATOM 1150 CA SER A 74 13.483 -2.891 87.978 1.00 0.00 C ATOM 1151 C SER A 74 13.577 -2.980 89.507 1.00 0.00 C ATOM 1152 O SER A 74 13.107 -2.118 90.231 1.00 0.00 O ATOM 1153 CB SER A 74 12.486 -3.923 87.440 1.00 0.00 C ATOM 1154 OG SER A 74 11.181 -3.615 87.910 1.00 0.00 O ATOM 0 H SER A 74 14.874 -3.944 86.751 1.00 0.00 H new ATOM 0 HA SER A 74 13.140 -1.895 87.698 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.500 -3.923 86.350 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.773 -4.924 87.763 1.00 0.00 H new ATOM 0 HG SER A 74 10.654 -3.226 87.181 1.00 0.00 H new ATOM 1160 N ALA A 75 14.194 -4.016 90.006 1.00 0.00 N ATOM 1161 CA ALA A 75 14.330 -4.167 91.487 1.00 0.00 C ATOM 1162 C ALA A 75 15.345 -3.153 92.023 1.00 0.00 C ATOM 1163 O ALA A 75 15.217 -2.654 93.123 1.00 0.00 O ATOM 1164 CB ALA A 75 14.796 -5.586 91.811 1.00 0.00 C ATOM 0 H ALA A 75 14.611 -4.766 89.454 1.00 0.00 H new ATOM 0 HA ALA A 75 13.365 -3.985 91.959 1.00 0.00 H new ATOM 0 HB1 ALA A 75 14.896 -5.699 92.891 1.00 0.00 H new ATOM 0 HB2 ALA A 75 14.065 -6.303 91.438 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.760 -5.770 91.336 1.00 0.00 H new ATOM 1170 N VAL A 76 16.357 -2.856 91.257 1.00 0.00 N ATOM 1171 CA VAL A 76 17.392 -1.889 91.715 1.00 0.00 C ATOM 1172 C VAL A 76 16.720 -0.687 92.404 1.00 0.00 C ATOM 1173 O VAL A 76 16.865 -0.493 93.597 1.00 0.00 O ATOM 1174 CB VAL A 76 18.212 -1.452 90.489 1.00 0.00 C ATOM 1175 CG1 VAL A 76 19.022 -0.188 90.791 1.00 0.00 C ATOM 1176 CG2 VAL A 76 19.169 -2.595 90.105 1.00 0.00 C ATOM 0 H VAL A 76 16.512 -3.245 90.327 1.00 0.00 H new ATOM 0 HA VAL A 76 18.057 -2.350 92.445 1.00 0.00 H new ATOM 0 HB VAL A 76 17.531 -1.230 89.668 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.592 0.099 89.907 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.345 0.621 91.064 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.706 -0.383 91.617 1.00 0.00 H new ATOM 0 HG21 VAL A 76 19.758 -2.300 89.236 1.00 0.00 H new ATOM 0 HG22 VAL A 76 19.836 -2.807 90.941 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.592 -3.488 89.866 1.00 0.00 H new ATOM 1186 N TYR A 77 15.987 0.115 91.679 1.00 0.00 N ATOM 1187 CA TYR A 77 15.310 1.290 92.310 1.00 0.00 C ATOM 1188 C TYR A 77 14.088 0.804 93.103 1.00 0.00 C ATOM 1189 O TYR A 77 13.016 1.367 93.015 1.00 0.00 O ATOM 1190 CB TYR A 77 14.861 2.263 91.213 1.00 0.00 C ATOM 1191 CG TYR A 77 15.722 2.067 89.985 1.00 0.00 C ATOM 1192 CD1 TYR A 77 16.950 2.728 89.874 1.00 0.00 C ATOM 1193 CD2 TYR A 77 15.285 1.228 88.952 1.00 0.00 C ATOM 1194 CE1 TYR A 77 17.741 2.549 88.732 1.00 0.00 C ATOM 1195 CE2 TYR A 77 16.075 1.051 87.809 1.00 0.00 C ATOM 1196 CZ TYR A 77 17.303 1.713 87.698 1.00 0.00 C ATOM 1197 OH TYR A 77 18.084 1.543 86.571 1.00 0.00 O ATOM 0 H TYR A 77 15.827 0.009 90.677 1.00 0.00 H new ATOM 0 HA TYR A 77 16.000 1.798 92.984 1.00 0.00 H new ATOM 0 HB2 TYR A 77 13.813 2.092 90.967 1.00 0.00 H new ATOM 0 HB3 TYR A 77 14.942 3.291 91.567 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.288 3.376 90.669 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.337 0.717 89.037 1.00 0.00 H new ATOM 0 HE1 TYR A 77 18.691 3.057 88.649 1.00 0.00 H new ATOM 0 HE2 TYR A 77 15.737 0.404 87.013 1.00 0.00 H new ATOM 0 HH TYR A 77 17.511 1.525 85.776 1.00 0.00 H new ATOM 1207 N GLU A 78 14.244 -0.239 93.875 1.00 0.00 N ATOM 1208 CA GLU A 78 13.097 -0.769 94.671 1.00 0.00 C ATOM 1209 C GLU A 78 13.516 -0.908 96.135 1.00 0.00 C ATOM 1210 O GLU A 78 12.717 -0.777 97.038 1.00 0.00 O ATOM 1211 CB GLU A 78 12.716 -2.158 94.133 1.00 0.00 C ATOM 1212 CG GLU A 78 11.256 -2.506 94.482 1.00 0.00 C ATOM 1213 CD GLU A 78 10.831 -1.839 95.794 1.00 0.00 C ATOM 1214 OE1 GLU A 78 10.371 -0.710 95.741 1.00 0.00 O ATOM 1215 OE2 GLU A 78 10.983 -2.466 96.828 1.00 0.00 O ATOM 0 H GLU A 78 15.120 -0.749 93.989 1.00 0.00 H new ATOM 0 HA GLU A 78 12.250 -0.087 94.592 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.850 -2.182 93.052 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.383 -2.910 94.554 1.00 0.00 H new ATOM 0 HG2 GLU A 78 10.598 -2.182 93.675 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.147 -3.587 94.567 1.00 0.00 H new ATOM 1222 N GLY A 79 14.763 -1.203 96.374 1.00 0.00 N ATOM 1223 CA GLY A 79 15.225 -1.389 97.775 1.00 0.00 C ATOM 1224 C GLY A 79 15.116 -2.874 98.093 1.00 0.00 C ATOM 1225 O GLY A 79 15.563 -3.343 99.123 1.00 0.00 O ATOM 0 H GLY A 79 15.481 -1.323 95.660 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.253 -1.046 97.890 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.615 -0.803 98.462 1.00 0.00 H new ATOM 1229 N HIS A 80 14.542 -3.620 97.190 1.00 0.00 N ATOM 1230 CA HIS A 80 14.413 -5.083 97.402 1.00 0.00 C ATOM 1231 C HIS A 80 15.750 -5.722 97.064 1.00 0.00 C ATOM 1232 O HIS A 80 16.394 -6.317 97.904 1.00 0.00 O ATOM 1233 CB HIS A 80 13.321 -5.628 96.466 1.00 0.00 C ATOM 1234 CG HIS A 80 12.005 -5.681 97.197 1.00 0.00 C ATOM 1235 ND1 HIS A 80 11.093 -6.711 97.019 1.00 0.00 N ATOM 1236 CD2 HIS A 80 11.434 -4.832 98.109 1.00 0.00 C ATOM 1237 CE1 HIS A 80 10.032 -6.456 97.806 1.00 0.00 C ATOM 1238 NE2 HIS A 80 10.191 -5.322 98.496 1.00 0.00 N ATOM 0 H HIS A 80 14.156 -3.274 96.311 1.00 0.00 H new ATOM 0 HA HIS A 80 14.141 -5.307 98.434 1.00 0.00 H new ATOM 0 HB2 HIS A 80 13.233 -4.992 95.585 1.00 0.00 H new ATOM 0 HB3 HIS A 80 13.593 -6.623 96.115 1.00 0.00 H new ATOM 0 HD2 HIS A 80 11.882 -3.919 98.473 1.00 0.00 H new ATOM 0 HE1 HIS A 80 9.160 -7.089 97.872 1.00 0.00 H new ATOM 0 HE2 HIS A 80 9.541 -4.906 99.163 1.00 0.00 H new ATOM 1246 N VAL A 81 16.171 -5.585 95.834 1.00 0.00 N ATOM 1247 CA VAL A 81 17.470 -6.166 95.393 1.00 0.00 C ATOM 1248 C VAL A 81 17.723 -7.513 96.068 1.00 0.00 C ATOM 1249 O VAL A 81 18.804 -8.068 96.001 1.00 0.00 O ATOM 1250 CB VAL A 81 18.604 -5.165 95.639 1.00 0.00 C ATOM 1251 CG1 VAL A 81 18.679 -4.209 94.437 1.00 0.00 C ATOM 1252 CG2 VAL A 81 18.318 -4.347 96.908 1.00 0.00 C ATOM 0 H VAL A 81 15.660 -5.086 95.106 1.00 0.00 H new ATOM 0 HA VAL A 81 17.430 -6.359 94.321 1.00 0.00 H new ATOM 0 HB VAL A 81 19.544 -5.702 95.764 1.00 0.00 H new ATOM 0 HG11 VAL A 81 19.482 -3.489 94.595 1.00 0.00 H new ATOM 0 HG12 VAL A 81 18.877 -4.780 93.530 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.732 -3.680 94.333 1.00 0.00 H new ATOM 0 HG21 VAL A 81 19.129 -3.638 97.075 1.00 0.00 H new ATOM 0 HG22 VAL A 81 17.381 -3.804 96.787 1.00 0.00 H new ATOM 0 HG23 VAL A 81 18.241 -5.018 97.764 1.00 0.00 H new ATOM 1262 N SER A 82 16.706 -8.085 96.636 1.00 0.00 N ATOM 1263 CA SER A 82 16.851 -9.439 97.216 1.00 0.00 C ATOM 1264 C SER A 82 16.741 -10.375 96.021 1.00 0.00 C ATOM 1265 O SER A 82 17.152 -11.518 96.042 1.00 0.00 O ATOM 1266 CB SER A 82 15.724 -9.702 98.225 1.00 0.00 C ATOM 1267 OG SER A 82 15.402 -11.086 98.230 1.00 0.00 O ATOM 0 H SER A 82 15.778 -7.671 96.723 1.00 0.00 H new ATOM 0 HA SER A 82 17.789 -9.572 97.755 1.00 0.00 H new ATOM 0 HB2 SER A 82 16.033 -9.387 99.221 1.00 0.00 H new ATOM 0 HB3 SER A 82 14.844 -9.114 97.964 1.00 0.00 H new ATOM 0 HG SER A 82 15.084 -11.345 99.120 1.00 0.00 H new ATOM 1273 N CYS A 83 16.189 -9.839 94.962 1.00 0.00 N ATOM 1274 CA CYS A 83 16.016 -10.591 93.697 1.00 0.00 C ATOM 1275 C CYS A 83 17.302 -10.486 92.879 1.00 0.00 C ATOM 1276 O CYS A 83 17.924 -11.483 92.574 1.00 0.00 O ATOM 1277 CB CYS A 83 14.847 -9.982 92.914 1.00 0.00 C ATOM 1278 SG CYS A 83 14.538 -8.299 93.506 1.00 0.00 S ATOM 0 H CYS A 83 15.843 -8.880 94.929 1.00 0.00 H new ATOM 0 HA CYS A 83 15.805 -11.640 93.904 1.00 0.00 H new ATOM 0 HB2 CYS A 83 15.077 -9.968 91.849 1.00 0.00 H new ATOM 0 HB3 CYS A 83 13.953 -10.593 93.039 1.00 0.00 H new ATOM 0 HG CYS A 83 13.426 -7.858 92.998 1.00 0.00 H new ATOM 1284 N VAL A 84 17.718 -9.284 92.530 1.00 0.00 N ATOM 1285 CA VAL A 84 18.978 -9.134 91.737 1.00 0.00 C ATOM 1286 C VAL A 84 19.959 -10.202 92.199 1.00 0.00 C ATOM 1287 O VAL A 84 20.662 -10.806 91.415 1.00 0.00 O ATOM 1288 CB VAL A 84 19.609 -7.763 91.975 1.00 0.00 C ATOM 1289 CG1 VAL A 84 18.671 -6.658 91.489 1.00 0.00 C ATOM 1290 CG2 VAL A 84 19.878 -7.591 93.463 1.00 0.00 C ATOM 0 H VAL A 84 17.241 -8.412 92.760 1.00 0.00 H new ATOM 0 HA VAL A 84 18.747 -9.236 90.677 1.00 0.00 H new ATOM 0 HB VAL A 84 20.545 -7.695 91.420 1.00 0.00 H new ATOM 0 HG11 VAL A 84 19.132 -5.686 91.664 1.00 0.00 H new ATOM 0 HG12 VAL A 84 18.483 -6.783 90.423 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.728 -6.716 92.033 1.00 0.00 H new ATOM 0 HG21 VAL A 84 20.329 -6.615 93.641 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.940 -7.663 94.013 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.559 -8.372 93.802 1.00 0.00 H new ATOM 1300 N LYS A 85 19.993 -10.444 93.476 1.00 0.00 N ATOM 1301 CA LYS A 85 20.905 -11.477 94.015 1.00 0.00 C ATOM 1302 C LYS A 85 20.535 -12.846 93.411 1.00 0.00 C ATOM 1303 O LYS A 85 21.276 -13.418 92.629 1.00 0.00 O ATOM 1304 CB LYS A 85 20.760 -11.490 95.543 1.00 0.00 C ATOM 1305 CG LYS A 85 21.456 -10.252 96.142 1.00 0.00 C ATOM 1306 CD LYS A 85 22.121 -10.616 97.475 1.00 0.00 C ATOM 1307 CE LYS A 85 23.507 -11.217 97.215 1.00 0.00 C ATOM 1308 NZ LYS A 85 23.921 -12.040 98.386 1.00 0.00 N ATOM 0 H LYS A 85 19.422 -9.965 94.173 1.00 0.00 H new ATOM 0 HA LYS A 85 21.941 -11.261 93.754 1.00 0.00 H new ATOM 0 HB2 LYS A 85 19.705 -11.495 95.818 1.00 0.00 H new ATOM 0 HB3 LYS A 85 21.200 -12.400 95.952 1.00 0.00 H new ATOM 0 HG2 LYS A 85 22.203 -9.872 95.445 1.00 0.00 H new ATOM 0 HG3 LYS A 85 20.729 -9.455 96.295 1.00 0.00 H new ATOM 0 HD2 LYS A 85 22.211 -9.729 98.102 1.00 0.00 H new ATOM 0 HD3 LYS A 85 21.501 -11.329 98.019 1.00 0.00 H new ATOM 0 HE2 LYS A 85 23.485 -11.831 96.315 1.00 0.00 H new ATOM 0 HE3 LYS A 85 24.233 -10.422 97.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 24.861 -12.447 98.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 23.957 -11.441 99.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 23.234 -12.807 98.532 1.00 0.00 H new ATOM 1322 N LEU A 86 19.381 -13.357 93.753 1.00 0.00 N ATOM 1323 CA LEU A 86 18.920 -14.665 93.202 1.00 0.00 C ATOM 1324 C LEU A 86 18.717 -14.523 91.684 1.00 0.00 C ATOM 1325 O LEU A 86 18.462 -15.475 90.977 1.00 0.00 O ATOM 1326 CB LEU A 86 17.626 -15.048 93.964 1.00 0.00 C ATOM 1327 CG LEU A 86 16.439 -15.390 93.042 1.00 0.00 C ATOM 1328 CD1 LEU A 86 16.085 -14.216 92.114 1.00 0.00 C ATOM 1329 CD2 LEU A 86 16.739 -16.651 92.216 1.00 0.00 C ATOM 0 H LEU A 86 18.729 -12.916 94.401 1.00 0.00 H new ATOM 0 HA LEU A 86 19.648 -15.464 93.342 1.00 0.00 H new ATOM 0 HB2 LEU A 86 17.834 -15.904 94.606 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.341 -14.222 94.616 1.00 0.00 H new ATOM 0 HG LEU A 86 15.576 -15.584 93.679 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.244 -14.495 91.479 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.815 -13.347 92.714 1.00 0.00 H new ATOM 0 HD13 LEU A 86 16.945 -13.973 91.490 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.889 -16.875 91.572 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.624 -16.482 91.603 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.917 -17.491 92.887 1.00 0.00 H new ATOM 1341 N LEU A 87 18.832 -13.328 91.176 1.00 0.00 N ATOM 1342 CA LEU A 87 18.633 -13.116 89.715 1.00 0.00 C ATOM 1343 C LEU A 87 19.887 -13.489 88.909 1.00 0.00 C ATOM 1344 O LEU A 87 19.829 -14.359 88.060 1.00 0.00 O ATOM 1345 CB LEU A 87 18.286 -11.645 89.467 1.00 0.00 C ATOM 1346 CG LEU A 87 17.017 -11.548 88.622 1.00 0.00 C ATOM 1347 CD1 LEU A 87 16.609 -10.079 88.478 1.00 0.00 C ATOM 1348 CD2 LEU A 87 17.276 -12.148 87.241 1.00 0.00 C ATOM 0 H LEU A 87 19.055 -12.488 91.710 1.00 0.00 H new ATOM 0 HA LEU A 87 17.820 -13.763 89.384 1.00 0.00 H new ATOM 0 HB2 LEU A 87 18.141 -11.131 90.417 1.00 0.00 H new ATOM 0 HB3 LEU A 87 19.112 -11.148 88.958 1.00 0.00 H new ATOM 0 HG LEU A 87 16.213 -12.099 89.109 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.704 -10.010 87.875 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.421 -9.655 89.464 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.412 -9.524 87.992 1.00 0.00 H new ATOM 0 HD21 LEU A 87 16.370 -12.079 86.638 1.00 0.00 H new ATOM 0 HD22 LEU A 87 18.081 -11.600 86.751 1.00 0.00 H new ATOM 0 HD23 LEU A 87 17.562 -13.194 87.347 1.00 0.00 H new ATOM 1360 N LEU A 88 21.008 -12.829 89.118 1.00 0.00 N ATOM 1361 CA LEU A 88 22.203 -13.176 88.292 1.00 0.00 C ATOM 1362 C LEU A 88 22.542 -14.648 88.475 1.00 0.00 C ATOM 1363 O LEU A 88 23.301 -15.219 87.716 1.00 0.00 O ATOM 1364 CB LEU A 88 23.424 -12.269 88.584 1.00 0.00 C ATOM 1365 CG LEU A 88 24.197 -12.680 89.850 1.00 0.00 C ATOM 1366 CD1 LEU A 88 23.234 -12.896 91.013 1.00 0.00 C ATOM 1367 CD2 LEU A 88 25.013 -13.961 89.592 1.00 0.00 C ATOM 0 H LEU A 88 21.141 -12.087 89.805 1.00 0.00 H new ATOM 0 HA LEU A 88 21.947 -12.995 87.248 1.00 0.00 H new ATOM 0 HB2 LEU A 88 24.100 -12.295 87.729 1.00 0.00 H new ATOM 0 HB3 LEU A 88 23.085 -11.239 88.692 1.00 0.00 H new ATOM 0 HG LEU A 88 24.885 -11.875 90.109 1.00 0.00 H new ATOM 0 HD11 LEU A 88 23.795 -13.186 91.901 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.691 -11.972 91.213 1.00 0.00 H new ATOM 0 HD13 LEU A 88 22.526 -13.684 90.758 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.553 -14.237 90.498 1.00 0.00 H new ATOM 0 HD22 LEU A 88 24.340 -14.771 89.310 1.00 0.00 H new ATOM 0 HD23 LEU A 88 25.724 -13.783 88.785 1.00 0.00 H new ATOM 1379 N SER A 89 21.947 -15.282 89.442 1.00 0.00 N ATOM 1380 CA SER A 89 22.200 -16.734 89.624 1.00 0.00 C ATOM 1381 C SER A 89 21.842 -17.413 88.302 1.00 0.00 C ATOM 1382 O SER A 89 22.258 -18.517 88.010 1.00 0.00 O ATOM 1383 CB SER A 89 21.306 -17.277 90.742 1.00 0.00 C ATOM 1384 OG SER A 89 20.081 -17.733 90.182 1.00 0.00 O ATOM 0 H SER A 89 21.301 -14.861 90.110 1.00 0.00 H new ATOM 0 HA SER A 89 23.239 -16.922 89.894 1.00 0.00 H new ATOM 0 HB2 SER A 89 21.808 -18.093 91.261 1.00 0.00 H new ATOM 0 HB3 SER A 89 21.114 -16.499 91.481 1.00 0.00 H new ATOM 0 HG SER A 89 19.418 -17.012 90.214 1.00 0.00 H new ATOM 1390 N LYS A 90 21.073 -16.725 87.497 1.00 0.00 N ATOM 1391 CA LYS A 90 20.665 -17.260 86.171 1.00 0.00 C ATOM 1392 C LYS A 90 21.486 -16.555 85.091 1.00 0.00 C ATOM 1393 O LYS A 90 21.524 -16.971 83.950 1.00 0.00 O ATOM 1394 CB LYS A 90 19.180 -16.953 85.950 1.00 0.00 C ATOM 1395 CG LYS A 90 18.330 -17.984 86.687 1.00 0.00 C ATOM 1396 CD LYS A 90 16.872 -17.501 86.771 1.00 0.00 C ATOM 1397 CE LYS A 90 16.612 -16.869 88.141 1.00 0.00 C ATOM 1398 NZ LYS A 90 16.906 -17.861 89.216 1.00 0.00 N ATOM 0 H LYS A 90 20.706 -15.798 87.711 1.00 0.00 H new ATOM 0 HA LYS A 90 20.831 -18.336 86.128 1.00 0.00 H new ATOM 0 HB2 LYS A 90 18.948 -15.951 86.310 1.00 0.00 H new ATOM 0 HB3 LYS A 90 18.949 -16.971 84.885 1.00 0.00 H new ATOM 0 HG2 LYS A 90 18.375 -18.942 86.169 1.00 0.00 H new ATOM 0 HG3 LYS A 90 18.727 -18.145 87.689 1.00 0.00 H new ATOM 0 HD2 LYS A 90 16.674 -16.775 85.982 1.00 0.00 H new ATOM 0 HD3 LYS A 90 16.192 -18.338 86.612 1.00 0.00 H new ATOM 0 HE2 LYS A 90 17.236 -15.984 88.269 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.575 -16.540 88.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.067 -17.979 89.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.155 -18.775 88.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.702 -17.522 89.793 1.00 0.00 H new ATOM 1412 N GLY A 91 22.140 -15.484 85.456 1.00 0.00 N ATOM 1413 CA GLY A 91 22.966 -14.720 84.478 1.00 0.00 C ATOM 1414 C GLY A 91 22.476 -13.271 84.438 1.00 0.00 C ATOM 1415 O GLY A 91 22.886 -12.444 85.228 1.00 0.00 O ATOM 0 H GLY A 91 22.136 -15.102 86.402 1.00 0.00 H new ATOM 0 HA2 GLY A 91 24.017 -14.754 84.765 1.00 0.00 H new ATOM 0 HA3 GLY A 91 22.891 -15.171 83.488 1.00 0.00 H new ATOM 1419 N ALA A 92 21.586 -12.966 83.535 1.00 0.00 N ATOM 1420 CA ALA A 92 21.041 -11.578 83.448 1.00 0.00 C ATOM 1421 C ALA A 92 22.165 -10.542 83.438 1.00 0.00 C ATOM 1422 O ALA A 92 21.905 -9.357 83.439 1.00 0.00 O ATOM 1423 CB ALA A 92 20.149 -11.319 84.668 1.00 0.00 C ATOM 0 H ALA A 92 21.210 -13.620 82.849 1.00 0.00 H new ATOM 0 HA ALA A 92 20.474 -11.488 82.521 1.00 0.00 H new ATOM 0 HB1 ALA A 92 19.745 -10.308 84.615 1.00 0.00 H new ATOM 0 HB2 ALA A 92 19.329 -12.037 84.678 1.00 0.00 H new ATOM 0 HB3 ALA A 92 20.738 -11.428 85.579 1.00 0.00 H new ATOM 1429 N ASP A 93 23.402 -10.956 83.438 1.00 0.00 N ATOM 1430 CA ASP A 93 24.503 -9.949 83.450 1.00 0.00 C ATOM 1431 C ASP A 93 24.094 -8.806 84.405 1.00 0.00 C ATOM 1432 O ASP A 93 23.655 -9.049 85.512 1.00 0.00 O ATOM 1433 CB ASP A 93 24.695 -9.427 82.016 1.00 0.00 C ATOM 1434 CG ASP A 93 26.173 -9.126 81.759 1.00 0.00 C ATOM 1435 OD1 ASP A 93 27.007 -9.853 82.274 1.00 0.00 O ATOM 1436 OD2 ASP A 93 26.447 -8.175 81.045 1.00 0.00 O ATOM 0 H ASP A 93 23.697 -11.932 83.430 1.00 0.00 H new ATOM 0 HA ASP A 93 25.442 -10.382 83.795 1.00 0.00 H new ATOM 0 HB2 ASP A 93 24.337 -10.167 81.300 1.00 0.00 H new ATOM 0 HB3 ASP A 93 24.101 -8.525 81.866 1.00 0.00 H new ATOM 1441 N LYS A 94 24.191 -7.572 83.989 1.00 0.00 N ATOM 1442 CA LYS A 94 23.754 -6.455 84.878 1.00 0.00 C ATOM 1443 C LYS A 94 23.461 -5.221 84.017 1.00 0.00 C ATOM 1444 O LYS A 94 22.556 -4.458 84.296 1.00 0.00 O ATOM 1445 CB LYS A 94 24.810 -6.171 85.963 1.00 0.00 C ATOM 1446 CG LYS A 94 26.002 -5.377 85.410 1.00 0.00 C ATOM 1447 CD LYS A 94 27.032 -6.336 84.782 1.00 0.00 C ATOM 1448 CE LYS A 94 26.981 -6.221 83.259 1.00 0.00 C ATOM 1449 NZ LYS A 94 28.254 -6.718 82.682 1.00 0.00 N ATOM 0 H LYS A 94 24.552 -7.289 83.078 1.00 0.00 H new ATOM 0 HA LYS A 94 22.841 -6.735 85.403 1.00 0.00 H new ATOM 0 HB2 LYS A 94 24.350 -5.614 86.779 1.00 0.00 H new ATOM 0 HB3 LYS A 94 25.164 -7.114 86.380 1.00 0.00 H new ATOM 0 HG2 LYS A 94 25.657 -4.662 84.663 1.00 0.00 H new ATOM 0 HG3 LYS A 94 26.469 -4.803 86.210 1.00 0.00 H new ATOM 0 HD2 LYS A 94 28.033 -6.096 85.141 1.00 0.00 H new ATOM 0 HD3 LYS A 94 26.821 -7.361 85.086 1.00 0.00 H new ATOM 0 HE2 LYS A 94 26.143 -6.798 82.868 1.00 0.00 H new ATOM 0 HE3 LYS A 94 26.818 -5.184 82.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 28.049 -7.362 81.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 28.816 -5.914 82.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 28.791 -7.227 83.413 1.00 0.00 H new ATOM 1463 N THR A 95 24.188 -5.054 82.945 1.00 0.00 N ATOM 1464 CA THR A 95 23.938 -3.915 82.018 1.00 0.00 C ATOM 1465 C THR A 95 23.745 -4.520 80.632 1.00 0.00 C ATOM 1466 O THR A 95 24.292 -4.058 79.652 1.00 0.00 O ATOM 1467 CB THR A 95 25.147 -2.969 82.000 1.00 0.00 C ATOM 1468 OG1 THR A 95 25.671 -2.836 83.313 1.00 0.00 O ATOM 1469 CG2 THR A 95 24.722 -1.595 81.479 1.00 0.00 C ATOM 0 H THR A 95 24.955 -5.668 82.670 1.00 0.00 H new ATOM 0 HA THR A 95 23.066 -3.341 82.332 1.00 0.00 H new ATOM 0 HB THR A 95 25.913 -3.382 81.344 1.00 0.00 H new ATOM 0 HG1 THR A 95 26.650 -2.830 83.275 1.00 0.00 H new ATOM 0 HG21 THR A 95 25.584 -0.927 81.468 1.00 0.00 H new ATOM 0 HG22 THR A 95 24.328 -1.695 80.468 1.00 0.00 H new ATOM 0 HG23 THR A 95 23.951 -1.182 82.129 1.00 0.00 H new ATOM 1477 N VAL A 96 23.001 -5.587 80.561 1.00 0.00 N ATOM 1478 CA VAL A 96 22.802 -6.281 79.265 1.00 0.00 C ATOM 1479 C VAL A 96 21.771 -5.543 78.394 1.00 0.00 C ATOM 1480 O VAL A 96 21.583 -5.872 77.240 1.00 0.00 O ATOM 1481 CB VAL A 96 22.353 -7.730 79.561 1.00 0.00 C ATOM 1482 CG1 VAL A 96 21.021 -8.049 78.875 1.00 0.00 C ATOM 1483 CG2 VAL A 96 23.423 -8.706 79.062 1.00 0.00 C ATOM 0 H VAL A 96 22.519 -6.010 81.354 1.00 0.00 H new ATOM 0 HA VAL A 96 23.735 -6.292 78.702 1.00 0.00 H new ATOM 0 HB VAL A 96 22.220 -7.833 80.638 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.731 -9.075 79.102 1.00 0.00 H new ATOM 0 HG12 VAL A 96 20.252 -7.366 79.238 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.130 -7.933 77.797 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.108 -9.729 79.270 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.559 -8.579 77.988 1.00 0.00 H new ATOM 0 HG23 VAL A 96 24.365 -8.506 79.573 1.00 0.00 H new ATOM 1493 N LYS A 97 21.118 -4.536 78.913 1.00 0.00 N ATOM 1494 CA LYS A 97 20.128 -3.799 78.068 1.00 0.00 C ATOM 1495 C LYS A 97 19.839 -2.397 78.633 1.00 0.00 C ATOM 1496 O LYS A 97 19.047 -1.661 78.079 1.00 0.00 O ATOM 1497 CB LYS A 97 18.821 -4.597 77.976 1.00 0.00 C ATOM 1498 CG LYS A 97 18.233 -4.465 76.559 1.00 0.00 C ATOM 1499 CD LYS A 97 18.855 -5.517 75.634 1.00 0.00 C ATOM 1500 CE LYS A 97 18.384 -5.281 74.196 1.00 0.00 C ATOM 1501 NZ LYS A 97 19.269 -6.022 73.249 1.00 0.00 N ATOM 0 H LYS A 97 21.223 -4.195 79.869 1.00 0.00 H new ATOM 0 HA LYS A 97 20.559 -3.683 77.074 1.00 0.00 H new ATOM 0 HB2 LYS A 97 19.007 -5.646 78.207 1.00 0.00 H new ATOM 0 HB3 LYS A 97 18.106 -4.230 78.713 1.00 0.00 H new ATOM 0 HG2 LYS A 97 17.151 -4.592 76.592 1.00 0.00 H new ATOM 0 HG3 LYS A 97 18.425 -3.466 76.168 1.00 0.00 H new ATOM 0 HD2 LYS A 97 19.942 -5.463 75.685 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.570 -6.517 75.961 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.353 -5.614 74.082 1.00 0.00 H new ATOM 0 HE3 LYS A 97 18.402 -4.215 73.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 18.947 -5.860 72.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 20.247 -5.684 73.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 19.230 -7.039 73.462 1.00 0.00 H new ATOM 1515 N GLY A 98 20.473 -2.005 79.705 1.00 0.00 N ATOM 1516 CA GLY A 98 20.220 -0.640 80.251 1.00 0.00 C ATOM 1517 C GLY A 98 20.868 0.378 79.312 1.00 0.00 C ATOM 1518 O GLY A 98 21.519 -0.002 78.360 1.00 0.00 O ATOM 0 H GLY A 98 21.150 -2.565 80.223 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.149 -0.455 80.331 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.635 -0.549 81.255 1.00 0.00 H new ATOM 1522 N PRO A 99 20.694 1.642 79.604 1.00 0.00 N ATOM 1523 CA PRO A 99 21.289 2.705 78.780 1.00 0.00 C ATOM 1524 C PRO A 99 22.777 2.443 78.639 1.00 0.00 C ATOM 1525 O PRO A 99 23.234 1.897 77.655 1.00 0.00 O ATOM 1526 CB PRO A 99 21.020 4.004 79.556 1.00 0.00 C ATOM 1527 CG PRO A 99 20.261 3.618 80.854 1.00 0.00 C ATOM 1528 CD PRO A 99 19.917 2.118 80.762 1.00 0.00 C ATOM 0 HA PRO A 99 20.874 2.757 77.773 1.00 0.00 H new ATOM 0 HB2 PRO A 99 21.956 4.510 79.794 1.00 0.00 H new ATOM 0 HB3 PRO A 99 20.428 4.695 78.956 1.00 0.00 H new ATOM 0 HG2 PRO A 99 20.876 3.817 81.731 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.354 4.213 80.959 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.195 1.589 81.673 1.00 0.00 H new ATOM 0 HD3 PRO A 99 18.848 1.962 80.616 1.00 0.00 H new ATOM 1536 N ASP A 100 23.529 2.817 79.623 1.00 0.00 N ATOM 1537 CA ASP A 100 24.989 2.584 79.574 1.00 0.00 C ATOM 1538 C ASP A 100 25.433 2.026 80.920 1.00 0.00 C ATOM 1539 O ASP A 100 24.783 1.177 81.505 1.00 0.00 O ATOM 1540 CB ASP A 100 25.709 3.909 79.289 1.00 0.00 C ATOM 1541 CG ASP A 100 27.159 3.629 78.889 1.00 0.00 C ATOM 1542 OD1 ASP A 100 27.501 2.466 78.755 1.00 0.00 O ATOM 1543 OD2 ASP A 100 27.904 4.582 78.725 1.00 0.00 O ATOM 0 H ASP A 100 23.193 3.279 80.468 1.00 0.00 H new ATOM 0 HA ASP A 100 25.234 1.876 78.783 1.00 0.00 H new ATOM 0 HB2 ASP A 100 25.198 4.448 78.491 1.00 0.00 H new ATOM 0 HB3 ASP A 100 25.681 4.547 80.172 1.00 0.00 H new ATOM 1548 N GLY A 101 26.529 2.498 81.419 1.00 0.00 N ATOM 1549 CA GLY A 101 27.027 2.000 82.730 1.00 0.00 C ATOM 1550 C GLY A 101 25.971 2.235 83.814 1.00 0.00 C ATOM 1551 O GLY A 101 26.175 1.907 84.975 1.00 0.00 O ATOM 0 H GLY A 101 27.109 3.211 80.977 1.00 0.00 H new ATOM 0 HA2 GLY A 101 27.259 0.937 82.661 1.00 0.00 H new ATOM 0 HA3 GLY A 101 27.952 2.511 82.995 1.00 0.00 H new ATOM 1555 N LEU A 102 24.830 2.775 83.458 1.00 0.00 N ATOM 1556 CA LEU A 102 23.783 3.006 84.485 1.00 0.00 C ATOM 1557 C LEU A 102 23.635 1.758 85.301 1.00 0.00 C ATOM 1558 O LEU A 102 23.980 1.739 86.460 1.00 0.00 O ATOM 1559 CB LEU A 102 22.436 3.340 83.836 1.00 0.00 C ATOM 1560 CG LEU A 102 21.388 3.770 84.891 1.00 0.00 C ATOM 1561 CD1 LEU A 102 20.049 4.010 84.204 1.00 0.00 C ATOM 1562 CD2 LEU A 102 21.187 2.684 85.953 1.00 0.00 C ATOM 0 H LEU A 102 24.586 3.061 82.510 1.00 0.00 H new ATOM 0 HA LEU A 102 24.081 3.848 85.109 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.570 4.140 83.108 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.069 2.471 83.290 1.00 0.00 H new ATOM 0 HG LEU A 102 21.752 4.678 85.372 1.00 0.00 H new ATOM 0 HD11 LEU A 102 19.309 4.313 84.945 1.00 0.00 H new ATOM 0 HD12 LEU A 102 20.159 4.797 83.458 1.00 0.00 H new ATOM 0 HD13 LEU A 102 19.720 3.092 83.717 1.00 0.00 H new ATOM 0 HD21 LEU A 102 20.445 3.017 86.679 1.00 0.00 H new ATOM 0 HD22 LEU A 102 20.841 1.767 85.475 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.132 2.493 86.462 1.00 0.00 H new ATOM 1574 N THR A 103 23.092 0.723 84.721 1.00 0.00 N ATOM 1575 CA THR A 103 22.876 -0.511 85.509 1.00 0.00 C ATOM 1576 C THR A 103 22.849 -0.130 86.993 1.00 0.00 C ATOM 1577 O THR A 103 21.949 0.544 87.470 1.00 0.00 O ATOM 1578 CB THR A 103 24.001 -1.515 85.250 1.00 0.00 C ATOM 1579 OG1 THR A 103 24.055 -2.436 86.329 1.00 0.00 O ATOM 1580 CG2 THR A 103 25.339 -0.790 85.133 1.00 0.00 C ATOM 0 H THR A 103 22.793 0.683 83.747 1.00 0.00 H new ATOM 0 HA THR A 103 21.934 -0.976 85.218 1.00 0.00 H new ATOM 0 HB THR A 103 23.805 -2.043 84.317 1.00 0.00 H new ATOM 0 HG1 THR A 103 23.625 -3.276 86.064 1.00 0.00 H new ATOM 0 HG21 THR A 103 26.131 -1.516 84.949 1.00 0.00 H new ATOM 0 HG22 THR A 103 25.297 -0.081 84.306 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.545 -0.255 86.060 1.00 0.00 H new ATOM 1588 N ALA A 104 23.838 -0.534 87.723 1.00 0.00 N ATOM 1589 CA ALA A 104 23.876 -0.183 89.175 1.00 0.00 C ATOM 1590 C ALA A 104 24.656 1.129 89.400 1.00 0.00 C ATOM 1591 O ALA A 104 24.449 1.819 90.384 1.00 0.00 O ATOM 1592 CB ALA A 104 24.546 -1.319 89.953 1.00 0.00 C ATOM 0 H ALA A 104 24.624 -1.091 87.387 1.00 0.00 H new ATOM 0 HA ALA A 104 22.855 -0.042 89.529 1.00 0.00 H new ATOM 0 HB1 ALA A 104 24.575 -1.066 91.013 1.00 0.00 H new ATOM 0 HB2 ALA A 104 23.978 -2.239 89.815 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.562 -1.462 89.586 1.00 0.00 H new ATOM 1598 N LEU A 105 25.573 1.470 88.520 1.00 0.00 N ATOM 1599 CA LEU A 105 26.393 2.709 88.712 1.00 0.00 C ATOM 1600 C LEU A 105 25.540 3.980 88.827 1.00 0.00 C ATOM 1601 O LEU A 105 25.418 4.557 89.889 1.00 0.00 O ATOM 1602 CB LEU A 105 27.333 2.884 87.520 1.00 0.00 C ATOM 1603 CG LEU A 105 28.024 1.566 87.174 1.00 0.00 C ATOM 1604 CD1 LEU A 105 29.086 1.835 86.109 1.00 0.00 C ATOM 1605 CD2 LEU A 105 28.688 0.976 88.420 1.00 0.00 C ATOM 0 H LEU A 105 25.787 0.940 87.675 1.00 0.00 H new ATOM 0 HA LEU A 105 26.940 2.580 89.646 1.00 0.00 H new ATOM 0 HB2 LEU A 105 26.771 3.242 86.658 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.081 3.642 87.750 1.00 0.00 H new ATOM 0 HG LEU A 105 27.287 0.855 86.800 1.00 0.00 H new ATOM 0 HD11 LEU A 105 29.588 0.902 85.852 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.612 2.249 85.219 1.00 0.00 H new ATOM 0 HD13 LEU A 105 29.817 2.546 86.495 1.00 0.00 H new ATOM 0 HD21 LEU A 105 29.177 0.037 88.161 1.00 0.00 H new ATOM 0 HD22 LEU A 105 29.429 1.677 88.804 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.932 0.793 89.183 1.00 0.00 H new ATOM 1617 N GLU A 106 24.996 4.454 87.737 1.00 0.00 N ATOM 1618 CA GLU A 106 24.216 5.715 87.787 1.00 0.00 C ATOM 1619 C GLU A 106 22.842 5.450 88.394 1.00 0.00 C ATOM 1620 O GLU A 106 21.986 6.310 88.412 1.00 0.00 O ATOM 1621 CB GLU A 106 24.054 6.265 86.364 1.00 0.00 C ATOM 1622 CG GLU A 106 25.390 6.196 85.619 1.00 0.00 C ATOM 1623 CD GLU A 106 26.327 7.285 86.145 1.00 0.00 C ATOM 1624 OE1 GLU A 106 25.895 8.424 86.224 1.00 0.00 O ATOM 1625 OE2 GLU A 106 27.462 6.963 86.453 1.00 0.00 O ATOM 0 H GLU A 106 25.061 4.019 86.817 1.00 0.00 H new ATOM 0 HA GLU A 106 24.742 6.443 88.404 1.00 0.00 H new ATOM 0 HB2 GLU A 106 23.299 5.690 85.827 1.00 0.00 H new ATOM 0 HB3 GLU A 106 23.702 7.296 86.402 1.00 0.00 H new ATOM 0 HG2 GLU A 106 25.844 5.214 85.755 1.00 0.00 H new ATOM 0 HG3 GLU A 106 25.229 6.327 84.549 1.00 0.00 H new ATOM 1632 N ALA A 107 22.621 4.265 88.893 1.00 0.00 N ATOM 1633 CA ALA A 107 21.295 3.963 89.495 1.00 0.00 C ATOM 1634 C ALA A 107 21.174 4.544 90.911 1.00 0.00 C ATOM 1635 O ALA A 107 20.178 5.156 91.238 1.00 0.00 O ATOM 1636 CB ALA A 107 21.093 2.452 89.575 1.00 0.00 C ATOM 0 H ALA A 107 23.295 3.500 88.910 1.00 0.00 H new ATOM 0 HA ALA A 107 20.536 4.419 88.859 1.00 0.00 H new ATOM 0 HB1 ALA A 107 20.120 2.238 90.017 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.138 2.025 88.573 1.00 0.00 H new ATOM 0 HB3 ALA A 107 21.876 2.012 90.192 1.00 0.00 H new ATOM 1642 N THR A 108 22.131 4.329 91.780 1.00 0.00 N ATOM 1643 CA THR A 108 21.957 4.853 93.164 1.00 0.00 C ATOM 1644 C THR A 108 23.286 5.037 93.897 1.00 0.00 C ATOM 1645 O THR A 108 24.316 5.322 93.317 1.00 0.00 O ATOM 1646 CB THR A 108 21.143 3.827 93.938 1.00 0.00 C ATOM 1647 OG1 THR A 108 20.896 4.303 95.254 1.00 0.00 O ATOM 1648 CG2 THR A 108 21.941 2.523 94.001 1.00 0.00 C ATOM 0 H THR A 108 23.000 3.828 91.597 1.00 0.00 H new ATOM 0 HA THR A 108 21.472 5.827 93.100 1.00 0.00 H new ATOM 0 HB THR A 108 20.188 3.657 93.442 1.00 0.00 H new ATOM 0 HG1 THR A 108 20.370 3.640 95.748 1.00 0.00 H new ATOM 0 HG21 THR A 108 21.372 1.775 94.553 1.00 0.00 H new ATOM 0 HG22 THR A 108 22.129 2.162 92.990 1.00 0.00 H new ATOM 0 HG23 THR A 108 22.891 2.702 94.505 1.00 0.00 H new ATOM 1656 N ASP A 109 23.238 4.850 95.196 1.00 0.00 N ATOM 1657 CA ASP A 109 24.447 4.974 96.044 1.00 0.00 C ATOM 1658 C ASP A 109 24.376 3.945 97.177 1.00 0.00 C ATOM 1659 O ASP A 109 25.324 3.770 97.916 1.00 0.00 O ATOM 1660 CB ASP A 109 24.542 6.384 96.633 1.00 0.00 C ATOM 1661 CG ASP A 109 25.909 6.562 97.298 1.00 0.00 C ATOM 1662 OD1 ASP A 109 26.694 5.629 97.250 1.00 0.00 O ATOM 1663 OD2 ASP A 109 26.146 7.625 97.850 1.00 0.00 O ATOM 0 H ASP A 109 22.388 4.612 95.706 1.00 0.00 H new ATOM 0 HA ASP A 109 25.331 4.791 95.434 1.00 0.00 H new ATOM 0 HB2 ASP A 109 24.407 7.128 95.848 1.00 0.00 H new ATOM 0 HB3 ASP A 109 23.747 6.541 97.362 1.00 0.00 H new ATOM 1668 N ASN A 110 23.280 3.229 97.311 1.00 0.00 N ATOM 1669 CA ASN A 110 23.222 2.195 98.388 1.00 0.00 C ATOM 1670 C ASN A 110 24.071 1.021 97.903 1.00 0.00 C ATOM 1671 O ASN A 110 24.090 0.698 96.732 1.00 0.00 O ATOM 1672 CB ASN A 110 21.773 1.763 98.687 1.00 0.00 C ATOM 1673 CG ASN A 110 21.157 1.077 97.478 1.00 0.00 C ATOM 1674 OD1 ASN A 110 21.792 1.104 96.352 1.00 0.00 O flip ATOM 1675 ND2 ASN A 110 20.085 0.510 97.563 1.00 0.00 N flip ATOM 0 H ASN A 110 22.443 3.315 96.734 1.00 0.00 H new ATOM 0 HA ASN A 110 23.607 2.592 99.328 1.00 0.00 H new ATOM 0 HB2 ASN A 110 21.759 1.087 99.542 1.00 0.00 H new ATOM 0 HB3 ASN A 110 21.177 2.634 98.960 1.00 0.00 H new ATOM 0 HD21 ASN A 110 19.587 0.491 98.453 1.00 0.00 H new ATOM 0 HD22 ASN A 110 19.683 0.053 96.744 1.00 0.00 H new ATOM 1682 N GLN A 111 24.842 0.442 98.771 1.00 0.00 N ATOM 1683 CA GLN A 111 25.775 -0.643 98.345 1.00 0.00 C ATOM 1684 C GLN A 111 25.073 -1.984 98.023 1.00 0.00 C ATOM 1685 O GLN A 111 25.729 -2.972 97.762 1.00 0.00 O ATOM 1686 CB GLN A 111 26.820 -0.819 99.447 1.00 0.00 C ATOM 1687 CG GLN A 111 27.666 -2.068 99.193 1.00 0.00 C ATOM 1688 CD GLN A 111 28.995 -1.920 99.931 1.00 0.00 C ATOM 1689 OE1 GLN A 111 30.011 -1.645 99.327 1.00 0.00 O ATOM 1690 NE2 GLN A 111 29.024 -2.080 101.224 1.00 0.00 N ATOM 0 H GLN A 111 24.871 0.671 99.765 1.00 0.00 H new ATOM 0 HA GLN A 111 26.240 -0.343 97.406 1.00 0.00 H new ATOM 0 HB2 GLN A 111 27.463 0.060 99.489 1.00 0.00 H new ATOM 0 HB3 GLN A 111 26.325 -0.899 100.415 1.00 0.00 H new ATOM 0 HG2 GLN A 111 27.139 -2.957 99.539 1.00 0.00 H new ATOM 0 HG3 GLN A 111 27.840 -2.195 98.125 1.00 0.00 H new ATOM 0 HE21 GLN A 111 28.168 -2.311 101.729 1.00 0.00 H new ATOM 0 HE22 GLN A 111 29.902 -1.974 101.731 1.00 0.00 H new ATOM 1699 N ALA A 112 23.768 -2.045 97.990 1.00 0.00 N ATOM 1700 CA ALA A 112 23.111 -3.344 97.635 1.00 0.00 C ATOM 1701 C ALA A 112 23.018 -3.423 96.113 1.00 0.00 C ATOM 1702 O ALA A 112 23.306 -4.431 95.482 1.00 0.00 O ATOM 1703 CB ALA A 112 21.706 -3.406 98.240 1.00 0.00 C ATOM 0 H ALA A 112 23.136 -1.270 98.189 1.00 0.00 H new ATOM 0 HA ALA A 112 23.693 -4.178 98.028 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.238 -4.354 97.976 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.773 -3.324 99.325 1.00 0.00 H new ATOM 0 HB3 ALA A 112 21.106 -2.584 97.851 1.00 0.00 H new ATOM 1709 N ILE A 113 22.660 -2.333 95.533 1.00 0.00 N ATOM 1710 CA ILE A 113 22.565 -2.240 94.056 1.00 0.00 C ATOM 1711 C ILE A 113 23.971 -2.334 93.506 1.00 0.00 C ATOM 1712 O ILE A 113 24.282 -3.128 92.634 1.00 0.00 O ATOM 1713 CB ILE A 113 22.011 -0.854 93.716 1.00 0.00 C ATOM 1714 CG1 ILE A 113 20.484 -0.874 93.701 1.00 0.00 C ATOM 1715 CG2 ILE A 113 22.537 -0.393 92.355 1.00 0.00 C ATOM 1716 CD1 ILE A 113 19.942 -0.804 95.129 1.00 0.00 C ATOM 0 H ILE A 113 22.421 -1.474 96.028 1.00 0.00 H new ATOM 0 HA ILE A 113 21.930 -3.024 93.644 1.00 0.00 H new ATOM 0 HB ILE A 113 22.344 -0.155 94.483 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.108 -0.032 93.120 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.130 -1.782 93.214 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.136 0.594 92.125 1.00 0.00 H new ATOM 0 HG22 ILE A 113 23.626 -0.344 92.383 1.00 0.00 H new ATOM 0 HG23 ILE A 113 22.225 -1.100 91.586 1.00 0.00 H new ATOM 0 HD11 ILE A 113 18.852 -0.819 95.106 1.00 0.00 H new ATOM 0 HD12 ILE A 113 20.305 -1.660 95.698 1.00 0.00 H new ATOM 0 HD13 ILE A 113 20.282 0.117 95.603 1.00 0.00 H new ATOM 1728 N LYS A 114 24.819 -1.515 94.029 1.00 0.00 N ATOM 1729 CA LYS A 114 26.214 -1.513 93.582 1.00 0.00 C ATOM 1730 C LYS A 114 26.749 -2.933 93.726 1.00 0.00 C ATOM 1731 O LYS A 114 27.790 -3.275 93.198 1.00 0.00 O ATOM 1732 CB LYS A 114 27.009 -0.520 94.439 1.00 0.00 C ATOM 1733 CG LYS A 114 26.246 0.817 94.501 1.00 0.00 C ATOM 1734 CD LYS A 114 26.313 1.518 93.142 1.00 0.00 C ATOM 1735 CE LYS A 114 25.803 2.953 93.280 1.00 0.00 C ATOM 1736 NZ LYS A 114 26.873 3.806 93.870 1.00 0.00 N ATOM 0 H LYS A 114 24.598 -0.838 94.759 1.00 0.00 H new ATOM 0 HA LYS A 114 26.304 -1.203 92.541 1.00 0.00 H new ATOM 0 HB2 LYS A 114 27.150 -0.919 95.443 1.00 0.00 H new ATOM 0 HB3 LYS A 114 28.001 -0.367 94.014 1.00 0.00 H new ATOM 0 HG2 LYS A 114 25.207 0.640 94.778 1.00 0.00 H new ATOM 0 HG3 LYS A 114 26.677 1.456 95.271 1.00 0.00 H new ATOM 0 HD2 LYS A 114 27.338 1.520 92.772 1.00 0.00 H new ATOM 0 HD3 LYS A 114 25.712 0.976 92.412 1.00 0.00 H new ATOM 0 HE2 LYS A 114 25.510 3.341 92.305 1.00 0.00 H new ATOM 0 HE3 LYS A 114 24.915 2.976 93.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 26.617 4.808 93.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 26.978 3.582 94.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 27.772 3.624 93.379 1.00 0.00 H new ATOM 1750 N ALA A 115 26.020 -3.774 94.418 1.00 0.00 N ATOM 1751 CA ALA A 115 26.459 -5.178 94.569 1.00 0.00 C ATOM 1752 C ALA A 115 26.438 -5.835 93.195 1.00 0.00 C ATOM 1753 O ALA A 115 27.300 -6.623 92.864 1.00 0.00 O ATOM 1754 CB ALA A 115 25.526 -5.937 95.515 1.00 0.00 C ATOM 0 H ALA A 115 25.142 -3.540 94.881 1.00 0.00 H new ATOM 0 HA ALA A 115 27.464 -5.202 94.990 1.00 0.00 H new ATOM 0 HB1 ALA A 115 25.867 -6.968 95.612 1.00 0.00 H new ATOM 0 HB2 ALA A 115 25.533 -5.458 96.494 1.00 0.00 H new ATOM 0 HB3 ALA A 115 24.513 -5.926 95.113 1.00 0.00 H new ATOM 1760 N LEU A 116 25.467 -5.510 92.379 1.00 0.00 N ATOM 1761 CA LEU A 116 25.437 -6.129 91.018 1.00 0.00 C ATOM 1762 C LEU A 116 26.557 -5.520 90.168 1.00 0.00 C ATOM 1763 O LEU A 116 26.970 -6.090 89.177 1.00 0.00 O ATOM 1764 CB LEU A 116 24.079 -5.870 90.344 1.00 0.00 C ATOM 1765 CG LEU A 116 23.180 -7.122 90.397 1.00 0.00 C ATOM 1766 CD1 LEU A 116 21.971 -6.910 89.478 1.00 0.00 C ATOM 1767 CD2 LEU A 116 23.941 -8.371 89.918 1.00 0.00 C ATOM 0 H LEU A 116 24.710 -4.859 92.588 1.00 0.00 H new ATOM 0 HA LEU A 116 25.582 -7.205 91.109 1.00 0.00 H new ATOM 0 HB2 LEU A 116 23.578 -5.038 90.839 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.236 -5.576 89.306 1.00 0.00 H new ATOM 0 HG LEU A 116 22.864 -7.273 91.429 1.00 0.00 H new ATOM 0 HD11 LEU A 116 21.331 -7.791 89.510 1.00 0.00 H new ATOM 0 HD12 LEU A 116 21.407 -6.039 89.813 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.315 -6.748 88.456 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.283 -9.239 89.966 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.272 -8.223 88.890 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.807 -8.537 90.558 1.00 0.00 H new ATOM 1779 N LEU A 117 27.073 -4.375 90.549 1.00 0.00 N ATOM 1780 CA LEU A 117 28.179 -3.768 89.751 1.00 0.00 C ATOM 1781 C LEU A 117 29.478 -4.473 90.144 1.00 0.00 C ATOM 1782 O LEU A 117 30.552 -4.159 89.680 1.00 0.00 O ATOM 1783 CB LEU A 117 28.239 -2.244 90.012 1.00 0.00 C ATOM 1784 CG LEU A 117 29.409 -1.840 90.938 1.00 0.00 C ATOM 1785 CD1 LEU A 117 30.727 -1.763 90.144 1.00 0.00 C ATOM 1786 CD2 LEU A 117 29.128 -0.453 91.530 1.00 0.00 C ATOM 0 H LEU A 117 26.779 -3.842 91.368 1.00 0.00 H new ATOM 0 HA LEU A 117 28.015 -3.899 88.681 1.00 0.00 H new ATOM 0 HB2 LEU A 117 28.337 -1.721 89.061 1.00 0.00 H new ATOM 0 HB3 LEU A 117 27.299 -1.919 90.459 1.00 0.00 H new ATOM 0 HG LEU A 117 29.500 -2.589 91.725 1.00 0.00 H new ATOM 0 HD11 LEU A 117 31.539 -1.477 90.813 1.00 0.00 H new ATOM 0 HD12 LEU A 117 30.945 -2.737 89.705 1.00 0.00 H new ATOM 0 HD13 LEU A 117 30.632 -1.021 89.352 1.00 0.00 H new ATOM 0 HD21 LEU A 117 29.950 -0.163 92.184 1.00 0.00 H new ATOM 0 HD22 LEU A 117 29.032 0.274 90.724 1.00 0.00 H new ATOM 0 HD23 LEU A 117 28.202 -0.483 92.103 1.00 0.00 H new ATOM 1798 N GLN A 118 29.360 -5.461 90.985 1.00 0.00 N ATOM 1799 CA GLN A 118 30.549 -6.235 91.420 1.00 0.00 C ATOM 1800 C GLN A 118 31.078 -7.048 90.237 1.00 0.00 C ATOM 1801 O GLN A 118 30.489 -6.955 89.173 1.00 0.00 O ATOM 1802 CB GLN A 118 30.136 -7.197 92.540 1.00 0.00 C ATOM 1803 CG GLN A 118 29.283 -8.334 91.954 1.00 0.00 C ATOM 1804 CD GLN A 118 30.197 -9.460 91.460 1.00 0.00 C ATOM 1805 OE1 GLN A 118 30.292 -9.707 90.275 1.00 0.00 O ATOM 1806 NE2 GLN A 118 30.879 -10.157 92.327 1.00 0.00 N ATOM 1807 OXT GLN A 118 32.051 -7.759 90.420 1.00 0.00 O ATOM 0 H GLN A 118 28.477 -5.767 91.394 1.00 0.00 H new ATOM 0 HA GLN A 118 31.322 -5.555 91.778 1.00 0.00 H new ATOM 0 HB2 GLN A 118 31.021 -7.606 93.026 1.00 0.00 H new ATOM 0 HB3 GLN A 118 29.572 -6.662 93.303 1.00 0.00 H new ATOM 0 HG2 GLN A 118 28.597 -8.714 92.711 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.674 -7.959 91.131 1.00 0.00 H new ATOM 0 HE21 GLN A 118 30.800 -9.950 93.323 1.00 0.00 H new ATOM 0 HE22 GLN A 118 31.491 -10.908 92.009 1.00 0.00 H new TER 1816 GLN A 118