USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1185 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 176 THR OG1 : rot 129:sc= 0.00708 USER MOD Set 1.2: A 178 HIS : no HE2:sc= -0.888 K(o=-0.88,f=-2!) USER MOD Set 2.1: A 170 GLN : amide:sc= -1.47 K(o=-0.22,f=1.1) USER MOD Set 2.2: A 173 THR OG1 : rot 35:sc= 1.25 USER MOD Set 3.1: A 106 SER OG : rot 180:sc=-0.00158 USER MOD Set 3.2: A 125 HIS : no HD1:sc= -0.569 X(o=-0.57,f=-0.6) USER MOD Set 4.1: A 39 CYS SG : rot 39:sc= 1.03 USER MOD Set 4.2: A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 7 CYS SG : rot 180:sc= -0.215 USER MOD Single : A 15 SER OG : rot 180:sc= -0.226 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0.141 X(o=0.14,f=-0.11) USER MOD Single : A 35 GLN : amide:sc= -0.615 K(o=-0.61,f=-3.9!) USER MOD Single : A 40 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-4.1) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.219 K(o=-0.22,f=-2.6!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 57 HIS : no HE2:sc= 0.217 K(o=0.22,f=-1.6) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.627 X(o=-0.63,f=-0.15) USER MOD Single : A 75 GLN : amide:sc= -0.0407 X(o=-0.041,f=0) USER MOD Single : A 81 HIS : no HD1:sc= -1.2 K(o=-1.2,f=-2.9!) USER MOD Single : A 84 SER OG : rot 62:sc= 0.121 USER MOD Single : A 86 GLN : amide:sc= -0.0322 X(o=-0.032,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= -0.0229 USER MOD Single : A 92 ASN : amide:sc= -0.756 K(o=-0.76,f=-1.9!) USER MOD Single : A 99 CYS SG : rot -160:sc= -0.228 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -0.867 K(o=-0.87,f=-3!) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.627 K(o=-0.63,f=-2.8!) USER MOD Single : A 133 GLN : amide:sc= -0.0901 X(o=-0.09,f=-0.061) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.0874 X(o=-0.087,f=-0.0013) USER MOD Single : A 136 THR OG1 : rot 29:sc= 0.925 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.349 X(o=-0.35,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 174 SER OG : rot -113:sc= -0.0852 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 2.847 15.060 -6.523 1.00 0.00 N ATOM 64 CA ARG A 5 3.814 15.518 -5.526 1.00 0.00 C ATOM 65 C ARG A 5 4.506 14.326 -4.863 1.00 0.00 C ATOM 66 O ARG A 5 4.056 13.820 -3.831 1.00 0.00 O ATOM 67 CB ARG A 5 3.146 16.417 -4.473 1.00 0.00 C ATOM 68 CG ARG A 5 1.891 15.824 -3.849 1.00 0.00 C ATOM 69 CD ARG A 5 1.745 16.227 -2.387 1.00 0.00 C ATOM 70 NE ARG A 5 1.566 17.672 -2.226 1.00 0.00 N ATOM 71 CZ ARG A 5 2.548 18.526 -1.907 1.00 0.00 C ATOM 72 NH1 ARG A 5 3.790 18.093 -1.693 1.00 0.00 N ATOM 73 NH2 ARG A 5 2.281 19.823 -1.798 1.00 0.00 N ATOM 0 HA ARG A 5 4.569 16.114 -6.039 1.00 0.00 H new ATOM 0 HB2 ARG A 5 3.866 16.627 -3.682 1.00 0.00 H new ATOM 0 HB3 ARG A 5 2.892 17.371 -4.935 1.00 0.00 H new ATOM 0 HG2 ARG A 5 1.015 16.155 -4.407 1.00 0.00 H new ATOM 0 HG3 ARG A 5 1.925 14.737 -3.925 1.00 0.00 H new ATOM 0 HD2 ARG A 5 0.892 15.706 -1.952 1.00 0.00 H new ATOM 0 HD3 ARG A 5 2.629 15.908 -1.834 1.00 0.00 H new ATOM 0 HE ARG A 5 0.631 18.054 -2.366 1.00 0.00 H new ATOM 0 HH11 ARG A 5 4.004 17.099 -1.771 1.00 0.00 H new ATOM 0 HH12 ARG A 5 4.527 18.756 -1.451 1.00 0.00 H new ATOM 0 HH21 ARG A 5 1.333 20.164 -1.957 1.00 0.00 H new ATOM 0 HH22 ARG A 5 3.024 20.478 -1.555 1.00 0.00 H new ATOM 87 N ASP A 6 5.605 13.880 -5.476 1.00 0.00 N ATOM 88 CA ASP A 6 6.376 12.744 -4.969 1.00 0.00 C ATOM 89 C ASP A 6 7.150 13.130 -3.705 1.00 0.00 C ATOM 90 O ASP A 6 7.547 14.285 -3.538 1.00 0.00 O ATOM 91 CB ASP A 6 7.348 12.238 -6.044 1.00 0.00 C ATOM 92 CG ASP A 6 6.652 11.544 -7.207 1.00 0.00 C ATOM 93 OD1 ASP A 6 5.420 11.694 -7.351 1.00 0.00 O ATOM 94 OD2 ASP A 6 7.346 10.849 -7.979 1.00 0.00 O ATOM 0 H ASP A 6 5.982 14.292 -6.330 1.00 0.00 H new ATOM 0 HA ASP A 6 5.677 11.946 -4.716 1.00 0.00 H new ATOM 0 HB2 ASP A 6 7.927 13.079 -6.426 1.00 0.00 H new ATOM 0 HB3 ASP A 6 8.055 11.546 -5.587 1.00 0.00 H new ATOM 99 N CYS A 7 7.353 12.156 -2.818 1.00 0.00 N ATOM 100 CA CYS A 7 8.068 12.388 -1.563 1.00 0.00 C ATOM 101 C CYS A 7 9.281 11.461 -1.433 1.00 0.00 C ATOM 102 O CYS A 7 9.129 10.239 -1.379 1.00 0.00 O ATOM 103 CB CYS A 7 7.115 12.182 -0.381 1.00 0.00 C ATOM 104 SG CYS A 7 5.903 13.506 -0.172 1.00 0.00 S ATOM 0 H CYS A 7 7.032 11.196 -2.946 1.00 0.00 H new ATOM 0 HA CYS A 7 8.433 13.415 -1.561 1.00 0.00 H new ATOM 0 HB2 CYS A 7 6.587 11.238 -0.514 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.701 12.093 0.534 1.00 0.00 H new ATOM 0 HG CYS A 7 5.143 13.241 0.849 1.00 0.00 H new ATOM 110 N PRO A 8 10.503 12.039 -1.380 1.00 0.00 N ATOM 111 CA PRO A 8 11.756 11.270 -1.255 1.00 0.00 C ATOM 112 C PRO A 8 11.739 10.303 -0.075 1.00 0.00 C ATOM 113 O PRO A 8 11.281 10.648 1.015 1.00 0.00 O ATOM 114 CB PRO A 8 12.819 12.353 -1.037 1.00 0.00 C ATOM 115 CG PRO A 8 12.242 13.580 -1.654 1.00 0.00 C ATOM 116 CD PRO A 8 10.758 13.491 -1.439 1.00 0.00 C ATOM 0 HA PRO A 8 11.932 10.645 -2.130 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.022 12.501 0.024 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.764 12.080 -1.507 1.00 0.00 H new ATOM 0 HG2 PRO A 8 12.650 14.479 -1.192 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.480 13.632 -2.716 1.00 0.00 H new ATOM 0 HD2 PRO A 8 10.456 13.989 -0.518 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.206 13.962 -2.252 1.00 0.00 H new ATOM 124 N LEU A 9 12.241 9.089 -0.300 1.00 0.00 N ATOM 125 CA LEU A 9 12.283 8.068 0.744 1.00 0.00 C ATOM 126 C LEU A 9 13.690 7.495 0.889 1.00 0.00 C ATOM 127 O LEU A 9 14.293 7.055 -0.092 1.00 0.00 O ATOM 128 CB LEU A 9 11.283 6.951 0.436 1.00 0.00 C ATOM 129 CG LEU A 9 9.812 7.374 0.477 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.917 6.245 -0.012 1.00 0.00 C ATOM 131 CD2 LEU A 9 9.419 7.803 1.885 1.00 0.00 C ATOM 0 H LEU A 9 12.624 8.789 -1.197 1.00 0.00 H new ATOM 0 HA LEU A 9 12.007 8.536 1.689 1.00 0.00 H new ATOM 0 HB2 LEU A 9 11.503 6.549 -0.553 1.00 0.00 H new ATOM 0 HB3 LEU A 9 11.433 6.141 1.150 1.00 0.00 H new ATOM 0 HG LEU A 9 9.680 8.226 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.876 6.565 0.024 1.00 0.00 H new ATOM 0 HD12 LEU A 9 9.182 5.989 -1.038 1.00 0.00 H new ATOM 0 HD13 LEU A 9 9.051 5.372 0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 9 8.370 8.100 1.895 1.00 0.00 H new ATOM 0 HD22 LEU A 9 9.567 6.971 2.574 1.00 0.00 H new ATOM 0 HD23 LEU A 9 10.038 8.645 2.195 1.00 0.00 H new ATOM 143 N PHE A 10 14.208 7.513 2.119 1.00 0.00 N ATOM 144 CA PHE A 10 15.550 7.006 2.414 1.00 0.00 C ATOM 145 C PHE A 10 16.615 7.735 1.592 1.00 0.00 C ATOM 146 O PHE A 10 17.585 7.127 1.137 1.00 0.00 O ATOM 147 CB PHE A 10 15.630 5.496 2.157 1.00 0.00 C ATOM 148 CG PHE A 10 14.884 4.671 3.169 1.00 0.00 C ATOM 149 CD1 PHE A 10 15.501 4.267 4.343 1.00 0.00 C ATOM 150 CD2 PHE A 10 13.567 4.304 2.946 1.00 0.00 C ATOM 151 CE1 PHE A 10 14.815 3.511 5.275 1.00 0.00 C ATOM 152 CE2 PHE A 10 12.877 3.549 3.874 1.00 0.00 C ATOM 153 CZ PHE A 10 13.502 3.152 5.040 1.00 0.00 C ATOM 0 H PHE A 10 13.713 7.877 2.933 1.00 0.00 H new ATOM 0 HA PHE A 10 15.746 7.195 3.470 1.00 0.00 H new ATOM 0 HB2 PHE A 10 15.233 5.284 1.164 1.00 0.00 H new ATOM 0 HB3 PHE A 10 16.677 5.192 2.154 1.00 0.00 H new ATOM 0 HD1 PHE A 10 16.527 4.546 4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 10 13.074 4.612 2.036 1.00 0.00 H new ATOM 0 HE1 PHE A 10 15.305 3.201 6.186 1.00 0.00 H new ATOM 0 HE2 PHE A 10 11.850 3.269 3.688 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.965 2.561 5.767 1.00 0.00 H new ATOM 163 N GLY A 11 16.431 9.043 1.410 1.00 0.00 N ATOM 164 CA GLY A 11 17.390 9.832 0.654 1.00 0.00 C ATOM 165 C GLY A 11 17.005 10.026 -0.806 1.00 0.00 C ATOM 166 O GLY A 11 17.703 10.729 -1.540 1.00 0.00 O ATOM 0 H GLY A 11 15.636 9.569 1.773 1.00 0.00 H new ATOM 0 HA2 GLY A 11 17.496 10.809 1.126 1.00 0.00 H new ATOM 0 HA3 GLY A 11 18.365 9.347 0.702 1.00 0.00 H new ATOM 170 N GLY A 12 15.899 9.413 -1.231 1.00 0.00 N ATOM 171 CA GLY A 12 15.455 9.546 -2.609 1.00 0.00 C ATOM 172 C GLY A 12 15.462 8.229 -3.373 1.00 0.00 C ATOM 173 O GLY A 12 15.586 8.225 -4.598 1.00 0.00 O ATOM 0 H GLY A 12 15.304 8.827 -0.645 1.00 0.00 H new ATOM 0 HA2 GLY A 12 14.447 9.959 -2.620 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.098 10.260 -3.123 1.00 0.00 H new ATOM 177 N ALA A 13 15.317 7.112 -2.658 1.00 0.00 N ATOM 178 CA ALA A 13 15.295 5.793 -3.290 1.00 0.00 C ATOM 179 C ALA A 13 13.923 5.511 -3.898 1.00 0.00 C ATOM 180 O ALA A 13 13.816 4.880 -4.950 1.00 0.00 O ATOM 181 CB ALA A 13 15.669 4.712 -2.286 1.00 0.00 C ATOM 0 H ALA A 13 15.213 7.095 -1.643 1.00 0.00 H new ATOM 0 HA ALA A 13 16.033 5.785 -4.092 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.647 3.738 -2.775 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.671 4.903 -1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.957 4.720 -1.461 1.00 0.00 H new ATOM 187 N PHE A 14 12.879 5.995 -3.227 1.00 0.00 N ATOM 188 CA PHE A 14 11.511 5.818 -3.694 1.00 0.00 C ATOM 189 C PHE A 14 10.752 7.138 -3.622 1.00 0.00 C ATOM 190 O PHE A 14 11.080 8.006 -2.809 1.00 0.00 O ATOM 191 CB PHE A 14 10.793 4.751 -2.865 1.00 0.00 C ATOM 192 CG PHE A 14 10.926 3.363 -3.423 1.00 0.00 C ATOM 193 CD1 PHE A 14 10.583 3.093 -4.740 1.00 0.00 C ATOM 194 CD2 PHE A 14 11.392 2.327 -2.632 1.00 0.00 C ATOM 195 CE1 PHE A 14 10.703 1.817 -5.254 1.00 0.00 C ATOM 196 CE2 PHE A 14 11.512 1.048 -3.139 1.00 0.00 C ATOM 197 CZ PHE A 14 11.169 0.793 -4.453 1.00 0.00 C ATOM 0 H PHE A 14 12.959 6.515 -2.353 1.00 0.00 H new ATOM 0 HA PHE A 14 11.543 5.487 -4.732 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.189 4.765 -1.850 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.735 5.006 -2.798 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.218 3.890 -5.371 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.665 2.521 -1.605 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.433 1.620 -6.281 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.873 0.248 -2.509 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.265 -0.206 -4.853 1.00 0.00 H new ATOM 207 N SER A 15 9.739 7.289 -4.473 1.00 0.00 N ATOM 208 CA SER A 15 8.943 8.509 -4.496 1.00 0.00 C ATOM 209 C SER A 15 7.466 8.193 -4.308 1.00 0.00 C ATOM 210 O SER A 15 6.858 7.503 -5.129 1.00 0.00 O ATOM 211 CB SER A 15 9.169 9.261 -5.805 1.00 0.00 C ATOM 212 OG SER A 15 10.102 10.313 -5.629 1.00 0.00 O ATOM 0 H SER A 15 9.453 6.584 -5.152 1.00 0.00 H new ATOM 0 HA SER A 15 9.261 9.145 -3.669 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.532 8.571 -6.567 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.223 9.665 -6.165 1.00 0.00 H new ATOM 0 HG SER A 15 10.233 10.780 -6.481 1.00 0.00 H new ATOM 218 N ALA A 16 6.900 8.698 -3.213 1.00 0.00 N ATOM 219 CA ALA A 16 5.497 8.466 -2.895 1.00 0.00 C ATOM 220 C ALA A 16 4.638 9.691 -3.191 1.00 0.00 C ATOM 221 O ALA A 16 4.934 10.797 -2.740 1.00 0.00 O ATOM 222 CB ALA A 16 5.349 8.056 -1.436 1.00 0.00 C ATOM 0 H ALA A 16 7.396 9.272 -2.531 1.00 0.00 H new ATOM 0 HA ALA A 16 5.144 7.656 -3.533 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.296 7.886 -1.211 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.911 7.140 -1.257 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.733 8.849 -0.794 1.00 0.00 H new ATOM 228 N ILE A 17 3.567 9.474 -3.946 1.00 0.00 N ATOM 229 CA ILE A 17 2.647 10.544 -4.305 1.00 0.00 C ATOM 230 C ILE A 17 1.583 10.726 -3.221 1.00 0.00 C ATOM 231 O ILE A 17 1.011 9.749 -2.736 1.00 0.00 O ATOM 232 CB ILE A 17 1.955 10.256 -5.653 1.00 0.00 C ATOM 233 CG1 ILE A 17 2.987 9.902 -6.730 1.00 0.00 C ATOM 234 CG2 ILE A 17 1.126 11.455 -6.087 1.00 0.00 C ATOM 235 CD1 ILE A 17 2.603 8.706 -7.572 1.00 0.00 C ATOM 0 H ILE A 17 3.314 8.560 -4.323 1.00 0.00 H new ATOM 0 HA ILE A 17 3.231 11.459 -4.398 1.00 0.00 H new ATOM 0 HB ILE A 17 1.292 9.401 -5.522 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.128 10.764 -7.382 1.00 0.00 H new ATOM 0 HG13 ILE A 17 3.946 9.705 -6.251 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.643 11.238 -7.040 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.366 11.663 -5.334 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.774 12.324 -6.198 1.00 0.00 H new ATOM 0 HD11 ILE A 17 3.381 8.517 -8.311 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.490 7.831 -6.932 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.660 8.907 -8.081 1.00 0.00 H new ATOM 247 N LEU A 18 1.328 11.979 -2.843 1.00 0.00 N ATOM 248 CA LEU A 18 0.336 12.287 -1.811 1.00 0.00 C ATOM 249 C LEU A 18 -0.725 13.253 -2.342 1.00 0.00 C ATOM 250 O LEU A 18 -0.403 14.210 -3.045 1.00 0.00 O ATOM 251 CB LEU A 18 1.022 12.906 -0.586 1.00 0.00 C ATOM 252 CG LEU A 18 1.772 11.926 0.327 1.00 0.00 C ATOM 253 CD1 LEU A 18 0.815 10.898 0.908 1.00 0.00 C ATOM 254 CD2 LEU A 18 2.901 11.236 -0.426 1.00 0.00 C ATOM 0 H LEU A 18 1.794 12.797 -3.235 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.151 11.355 -1.524 1.00 0.00 H new ATOM 0 HB2 LEU A 18 1.726 13.663 -0.931 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.267 13.421 0.008 1.00 0.00 H new ATOM 0 HG LEU A 18 2.209 12.496 1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.365 10.212 1.552 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.046 11.405 1.491 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.347 10.338 0.098 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.417 10.547 0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.490 10.683 -1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.606 11.984 -0.790 1.00 0.00 H new ATOM 266 N PRO A 19 -2.013 13.020 -2.008 1.00 0.00 N ATOM 267 CA PRO A 19 -3.119 13.883 -2.454 1.00 0.00 C ATOM 268 C PRO A 19 -3.002 15.305 -1.907 1.00 0.00 C ATOM 269 O PRO A 19 -2.132 15.594 -1.082 1.00 0.00 O ATOM 270 CB PRO A 19 -4.372 13.202 -1.880 1.00 0.00 C ATOM 271 CG PRO A 19 -3.946 11.810 -1.563 1.00 0.00 C ATOM 272 CD PRO A 19 -2.499 11.907 -1.175 1.00 0.00 C ATOM 0 HA PRO A 19 -3.132 13.986 -3.539 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -4.728 13.718 -0.988 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -5.190 13.210 -2.600 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -4.542 11.393 -0.751 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -4.078 11.155 -2.424 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.378 12.115 -0.112 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.962 10.982 -1.382 1.00 0.00 H new ATOM 280 N MET A 20 -3.887 16.190 -2.367 1.00 0.00 N ATOM 281 CA MET A 20 -3.886 17.581 -1.918 1.00 0.00 C ATOM 282 C MET A 20 -4.527 17.698 -0.534 1.00 0.00 C ATOM 283 O MET A 20 -5.747 17.823 -0.415 1.00 0.00 O ATOM 284 CB MET A 20 -4.632 18.468 -2.920 1.00 0.00 C ATOM 285 CG MET A 20 -4.415 19.960 -2.704 1.00 0.00 C ATOM 286 SD MET A 20 -5.785 20.958 -3.325 1.00 0.00 S ATOM 287 CE MET A 20 -5.915 22.207 -2.048 1.00 0.00 C ATOM 0 H MET A 20 -4.612 15.968 -3.049 1.00 0.00 H new ATOM 0 HA MET A 20 -2.852 17.919 -1.854 1.00 0.00 H new ATOM 0 HB2 MET A 20 -4.313 18.207 -3.929 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.699 18.253 -2.857 1.00 0.00 H new ATOM 0 HG2 MET A 20 -4.283 20.154 -1.640 1.00 0.00 H new ATOM 0 HG3 MET A 20 -3.494 20.265 -3.201 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.722 22.897 -2.295 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.127 21.729 -1.092 1.00 0.00 H new ATOM 0 HE3 MET A 20 -4.976 22.756 -1.979 1.00 0.00 H new ATOM 297 N GLY A 21 -3.696 17.652 0.509 1.00 0.00 N ATOM 298 CA GLY A 21 -4.201 17.751 1.870 1.00 0.00 C ATOM 299 C GLY A 21 -3.649 16.676 2.805 1.00 0.00 C ATOM 300 O GLY A 21 -3.849 16.751 4.019 1.00 0.00 O ATOM 0 H GLY A 21 -2.684 17.548 0.435 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -3.951 18.733 2.271 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.289 17.681 1.851 1.00 0.00 H new ATOM 304 N ALA A 22 -2.964 15.674 2.244 1.00 0.00 N ATOM 305 CA ALA A 22 -2.397 14.585 3.041 1.00 0.00 C ATOM 306 C ALA A 22 -1.329 15.089 4.013 1.00 0.00 C ATOM 307 O ALA A 22 -0.482 15.907 3.651 1.00 0.00 O ATOM 308 CB ALA A 22 -1.816 13.510 2.130 1.00 0.00 C ATOM 0 H ALA A 22 -2.790 15.596 1.242 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.205 14.155 3.633 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.398 12.706 2.736 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.603 13.110 1.491 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.031 13.943 1.511 1.00 0.00 H new ATOM 314 N ILE A 23 -1.380 14.589 5.251 1.00 0.00 N ATOM 315 CA ILE A 23 -0.422 14.976 6.284 1.00 0.00 C ATOM 316 C ILE A 23 0.044 13.760 7.089 1.00 0.00 C ATOM 317 O ILE A 23 -0.725 12.824 7.317 1.00 0.00 O ATOM 318 CB ILE A 23 -1.024 16.027 7.249 1.00 0.00 C ATOM 319 CG1 ILE A 23 0.036 16.503 8.251 1.00 0.00 C ATOM 320 CG2 ILE A 23 -2.241 15.462 7.975 1.00 0.00 C ATOM 321 CD1 ILE A 23 -0.486 17.477 9.287 1.00 0.00 C ATOM 0 H ILE A 23 -2.078 13.913 5.560 1.00 0.00 H new ATOM 0 HA ILE A 23 0.434 15.416 5.773 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.351 16.885 6.662 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.454 15.635 8.762 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.852 16.974 7.704 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.647 16.218 8.647 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.000 15.179 7.246 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.946 14.585 8.551 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.324 17.765 9.957 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.877 18.364 8.788 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.282 17.004 9.863 1.00 0.00 H new ATOM 333 N ASP A 24 1.301 13.790 7.529 1.00 0.00 N ATOM 334 CA ASP A 24 1.863 12.699 8.321 1.00 0.00 C ATOM 335 C ASP A 24 1.450 12.835 9.785 1.00 0.00 C ATOM 336 O ASP A 24 1.578 13.909 10.374 1.00 0.00 O ATOM 337 CB ASP A 24 3.389 12.691 8.210 1.00 0.00 C ATOM 338 CG ASP A 24 3.970 11.295 8.309 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.869 10.684 9.394 1.00 0.00 O ATOM 340 OD2 ASP A 24 4.526 10.811 7.300 1.00 0.00 O ATOM 0 H ASP A 24 1.948 14.558 7.350 1.00 0.00 H new ATOM 0 HA ASP A 24 1.475 11.758 7.931 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.683 13.137 7.260 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.811 13.314 8.999 1.00 0.00 H new ATOM 345 N VAL A 25 0.955 11.742 10.370 1.00 0.00 N ATOM 346 CA VAL A 25 0.527 11.743 11.767 1.00 0.00 C ATOM 347 C VAL A 25 1.709 11.621 12.737 1.00 0.00 C ATOM 348 O VAL A 25 1.508 11.502 13.947 1.00 0.00 O ATOM 349 CB VAL A 25 -0.476 10.605 12.050 1.00 0.00 C ATOM 350 CG1 VAL A 25 -1.844 10.936 11.468 1.00 0.00 C ATOM 351 CG2 VAL A 25 0.041 9.279 11.513 1.00 0.00 C ATOM 0 H VAL A 25 0.841 10.846 9.896 1.00 0.00 H new ATOM 0 HA VAL A 25 0.041 12.704 11.932 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.584 10.507 13.130 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.536 10.121 11.679 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.218 11.855 11.918 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.758 11.069 10.390 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.684 8.493 11.725 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.189 9.355 10.436 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.989 9.037 11.993 1.00 0.00 H new ATOM 361 N SER A 26 2.938 11.657 12.212 1.00 0.00 N ATOM 362 CA SER A 26 4.134 11.561 13.048 1.00 0.00 C ATOM 363 C SER A 26 4.142 12.638 14.133 1.00 0.00 C ATOM 364 O SER A 26 4.686 12.433 15.218 1.00 0.00 O ATOM 365 CB SER A 26 5.395 11.681 12.189 1.00 0.00 C ATOM 366 OG SER A 26 5.483 12.961 11.583 1.00 0.00 O ATOM 0 H SER A 26 3.128 11.752 11.214 1.00 0.00 H new ATOM 0 HA SER A 26 4.121 10.586 13.534 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.276 11.506 12.806 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.388 10.910 11.418 1.00 0.00 H new ATOM 0 HG SER A 26 6.298 13.011 11.042 1.00 0.00 H new ATOM 372 N ASP A 27 3.537 13.789 13.829 1.00 0.00 N ATOM 373 CA ASP A 27 3.478 14.895 14.781 1.00 0.00 C ATOM 374 C ASP A 27 2.496 14.607 15.920 1.00 0.00 C ATOM 375 O ASP A 27 2.656 15.119 17.028 1.00 0.00 O ATOM 376 CB ASP A 27 3.089 16.194 14.067 1.00 0.00 C ATOM 377 CG ASP A 27 4.035 17.338 14.387 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.263 17.147 14.262 1.00 0.00 O ATOM 379 OD2 ASP A 27 3.547 18.424 14.763 1.00 0.00 O ATOM 0 H ASP A 27 3.084 13.977 12.935 1.00 0.00 H new ATOM 0 HA ASP A 27 4.471 15.009 15.215 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.080 16.024 12.990 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.075 16.473 14.354 1.00 0.00 H new ATOM 384 N LEU A 28 1.481 13.788 15.644 1.00 0.00 N ATOM 385 CA LEU A 28 0.480 13.438 16.649 1.00 0.00 C ATOM 386 C LEU A 28 0.841 12.142 17.384 1.00 0.00 C ATOM 387 O LEU A 28 0.494 11.973 18.555 1.00 0.00 O ATOM 388 CB LEU A 28 -0.892 13.294 15.985 1.00 0.00 C ATOM 389 CG LEU A 28 -2.076 13.147 16.944 1.00 0.00 C ATOM 390 CD1 LEU A 28 -2.179 14.358 17.859 1.00 0.00 C ATOM 391 CD2 LEU A 28 -3.369 12.954 16.162 1.00 0.00 C ATOM 0 H LEU A 28 1.331 13.355 14.733 1.00 0.00 H new ATOM 0 HA LEU A 28 0.452 14.241 17.386 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.064 14.166 15.354 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.869 12.425 15.328 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.911 12.266 17.564 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.027 14.234 18.533 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.263 14.452 18.442 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.321 15.257 17.259 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.202 12.851 16.857 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.538 13.818 15.519 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.293 12.055 15.550 1.00 0.00 H new ATOM 403 N ARG A 29 1.524 11.224 16.696 1.00 0.00 N ATOM 404 CA ARG A 29 1.914 9.942 17.291 1.00 0.00 C ATOM 405 C ARG A 29 3.156 9.362 16.608 1.00 0.00 C ATOM 406 O ARG A 29 3.485 9.740 15.483 1.00 0.00 O ATOM 407 CB ARG A 29 0.757 8.941 17.188 1.00 0.00 C ATOM 408 CG ARG A 29 -0.083 8.830 18.451 1.00 0.00 C ATOM 409 CD ARG A 29 -1.515 8.429 18.130 1.00 0.00 C ATOM 410 NE ARG A 29 -2.495 9.271 18.818 1.00 0.00 N ATOM 411 CZ ARG A 29 -3.787 9.340 18.484 1.00 0.00 C ATOM 412 NH1 ARG A 29 -4.266 8.613 17.477 1.00 0.00 N ATOM 413 NH2 ARG A 29 -4.605 10.134 19.163 1.00 0.00 N ATOM 0 H ARG A 29 1.819 11.344 15.727 1.00 0.00 H new ATOM 0 HA ARG A 29 2.153 10.121 18.339 1.00 0.00 H new ATOM 0 HB2 ARG A 29 0.111 9.233 16.360 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.162 7.958 16.946 1.00 0.00 H new ATOM 0 HG2 ARG A 29 0.361 8.095 19.122 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -0.080 9.785 18.977 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.676 8.494 17.054 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.671 7.388 18.414 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.172 9.840 19.600 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -3.645 7.996 16.953 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -5.254 8.673 17.230 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -4.247 10.691 19.939 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.591 10.187 18.909 1.00 0.00 H new ATOM 427 N PRO A 30 3.862 8.428 17.283 1.00 0.00 N ATOM 428 CA PRO A 30 5.074 7.788 16.738 1.00 0.00 C ATOM 429 C PRO A 30 4.816 7.080 15.403 1.00 0.00 C ATOM 430 O PRO A 30 3.698 6.647 15.128 1.00 0.00 O ATOM 431 CB PRO A 30 5.459 6.765 17.816 1.00 0.00 C ATOM 432 CG PRO A 30 4.806 7.254 19.064 1.00 0.00 C ATOM 433 CD PRO A 30 3.533 7.921 18.630 1.00 0.00 C ATOM 0 HA PRO A 30 5.853 8.520 16.526 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.111 5.766 17.554 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.541 6.705 17.934 1.00 0.00 H new ATOM 0 HG2 PRO A 30 4.601 6.429 19.746 1.00 0.00 H new ATOM 0 HG3 PRO A 30 5.452 7.954 19.594 1.00 0.00 H new ATOM 0 HD2 PRO A 30 2.699 7.220 18.604 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.250 8.728 19.306 1.00 0.00 H new ATOM 441 N VAL A 31 5.861 6.972 14.576 1.00 0.00 N ATOM 442 CA VAL A 31 5.745 6.324 13.269 1.00 0.00 C ATOM 443 C VAL A 31 6.967 5.450 12.965 1.00 0.00 C ATOM 444 O VAL A 31 8.102 5.853 13.222 1.00 0.00 O ATOM 445 CB VAL A 31 5.583 7.366 12.138 1.00 0.00 C ATOM 446 CG1 VAL A 31 5.325 6.683 10.801 1.00 0.00 C ATOM 447 CG2 VAL A 31 4.462 8.345 12.463 1.00 0.00 C ATOM 0 H VAL A 31 6.794 7.325 14.789 1.00 0.00 H new ATOM 0 HA VAL A 31 4.856 5.695 13.311 1.00 0.00 H new ATOM 0 HB VAL A 31 6.516 7.925 12.060 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.215 7.438 10.022 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.164 6.031 10.558 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.412 6.091 10.865 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.365 9.069 11.654 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.525 7.800 12.576 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.693 8.867 13.392 1.00 0.00 H new ATOM 457 N PRO A 32 6.745 4.237 12.409 1.00 0.00 N ATOM 458 CA PRO A 32 7.829 3.299 12.063 1.00 0.00 C ATOM 459 C PRO A 32 8.790 3.862 11.011 1.00 0.00 C ATOM 460 O PRO A 32 8.554 4.931 10.448 1.00 0.00 O ATOM 461 CB PRO A 32 7.090 2.078 11.502 1.00 0.00 C ATOM 462 CG PRO A 32 5.749 2.589 11.103 1.00 0.00 C ATOM 463 CD PRO A 32 5.419 3.681 12.075 1.00 0.00 C ATOM 0 HA PRO A 32 8.453 3.079 12.929 1.00 0.00 H new ATOM 0 HB2 PRO A 32 7.620 1.653 10.650 1.00 0.00 H new ATOM 0 HB3 PRO A 32 7.005 1.290 12.250 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.764 2.967 10.081 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.002 1.796 11.139 1.00 0.00 H new ATOM 0 HD2 PRO A 32 4.766 4.433 11.632 1.00 0.00 H new ATOM 0 HD3 PRO A 32 4.909 3.296 12.958 1.00 0.00 H new ATOM 471 N ASP A 33 9.875 3.126 10.757 1.00 0.00 N ATOM 472 CA ASP A 33 10.879 3.546 9.778 1.00 0.00 C ATOM 473 C ASP A 33 10.603 2.960 8.391 1.00 0.00 C ATOM 474 O ASP A 33 10.792 3.637 7.380 1.00 0.00 O ATOM 475 CB ASP A 33 12.280 3.140 10.246 1.00 0.00 C ATOM 476 CG ASP A 33 13.224 4.324 10.342 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.848 5.336 10.970 1.00 0.00 O ATOM 478 OD2 ASP A 33 14.340 4.240 9.788 1.00 0.00 O ATOM 0 H ASP A 33 10.080 2.238 11.215 1.00 0.00 H new ATOM 0 HA ASP A 33 10.823 4.632 9.699 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.209 2.656 11.220 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.692 2.405 9.554 1.00 0.00 H new ATOM 483 N ASN A 34 10.162 1.701 8.347 1.00 0.00 N ATOM 484 CA ASN A 34 9.869 1.034 7.076 1.00 0.00 C ATOM 485 C ASN A 34 8.372 1.093 6.739 1.00 0.00 C ATOM 486 O ASN A 34 7.818 0.150 6.168 1.00 0.00 O ATOM 487 CB ASN A 34 10.358 -0.422 7.112 1.00 0.00 C ATOM 488 CG ASN A 34 9.873 -1.175 8.339 1.00 0.00 C ATOM 489 OD1 ASN A 34 10.639 -1.426 9.268 1.00 0.00 O ATOM 490 ND2 ASN A 34 8.598 -1.541 8.346 1.00 0.00 N ATOM 0 H ASN A 34 10.000 1.125 9.173 1.00 0.00 H new ATOM 0 HA ASN A 34 10.404 1.566 6.289 1.00 0.00 H new ATOM 0 HB2 ASN A 34 10.015 -0.938 6.215 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.448 -0.435 7.090 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.218 -2.051 9.143 1.00 0.00 H new ATOM 0 HD22 ASN A 34 7.997 -1.312 7.554 1.00 0.00 H new ATOM 497 N GLN A 35 7.725 2.211 7.084 1.00 0.00 N ATOM 498 CA GLN A 35 6.300 2.396 6.811 1.00 0.00 C ATOM 499 C GLN A 35 5.949 3.880 6.688 1.00 0.00 C ATOM 500 O GLN A 35 6.817 4.747 6.801 1.00 0.00 O ATOM 501 CB GLN A 35 5.456 1.767 7.922 1.00 0.00 C ATOM 502 CG GLN A 35 5.001 0.345 7.630 1.00 0.00 C ATOM 503 CD GLN A 35 4.732 -0.449 8.894 1.00 0.00 C ATOM 504 OE1 GLN A 35 3.617 -0.915 9.120 1.00 0.00 O ATOM 505 NE2 GLN A 35 5.754 -0.603 9.730 1.00 0.00 N ATOM 0 H GLN A 35 8.168 3.001 7.553 1.00 0.00 H new ATOM 0 HA GLN A 35 6.080 1.904 5.864 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.033 1.769 8.847 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.578 2.390 8.093 1.00 0.00 H new ATOM 0 HG2 GLN A 35 4.096 0.374 7.023 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.764 -0.164 7.041 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.663 -0.200 9.504 1.00 0.00 H new ATOM 0 HE22 GLN A 35 5.629 -1.125 10.598 1.00 0.00 H new ATOM 514 N GLU A 36 4.662 4.157 6.467 1.00 0.00 N ATOM 515 CA GLU A 36 4.168 5.529 6.335 1.00 0.00 C ATOM 516 C GLU A 36 2.734 5.642 6.851 1.00 0.00 C ATOM 517 O GLU A 36 1.944 4.706 6.719 1.00 0.00 O ATOM 518 CB GLU A 36 4.219 5.985 4.873 1.00 0.00 C ATOM 519 CG GLU A 36 5.616 6.340 4.379 1.00 0.00 C ATOM 520 CD GLU A 36 6.130 7.652 4.943 1.00 0.00 C ATOM 521 OE1 GLU A 36 6.384 7.719 6.165 1.00 0.00 O ATOM 522 OE2 GLU A 36 6.285 8.613 4.161 1.00 0.00 O ATOM 0 H GLU A 36 3.939 3.444 6.375 1.00 0.00 H new ATOM 0 HA GLU A 36 4.813 6.172 6.933 1.00 0.00 H new ATOM 0 HB2 GLU A 36 3.813 5.194 4.243 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.571 6.853 4.752 1.00 0.00 H new ATOM 0 HG2 GLU A 36 6.305 5.540 4.650 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.606 6.398 3.291 1.00 0.00 H new ATOM 529 N VAL A 37 2.403 6.794 7.433 1.00 0.00 N ATOM 530 CA VAL A 37 1.062 7.027 7.965 1.00 0.00 C ATOM 531 C VAL A 37 0.583 8.445 7.645 1.00 0.00 C ATOM 532 O VAL A 37 0.913 9.398 8.355 1.00 0.00 O ATOM 533 CB VAL A 37 1.008 6.805 9.493 1.00 0.00 C ATOM 534 CG1 VAL A 37 -0.433 6.680 9.965 1.00 0.00 C ATOM 535 CG2 VAL A 37 1.812 5.573 9.894 1.00 0.00 C ATOM 0 H VAL A 37 3.044 7.579 7.548 1.00 0.00 H new ATOM 0 HA VAL A 37 0.402 6.305 7.483 1.00 0.00 H new ATOM 0 HB VAL A 37 1.456 7.673 9.977 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.450 6.524 11.044 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.976 7.593 9.722 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -0.906 5.833 9.468 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.758 5.439 10.974 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.401 4.693 9.398 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.852 5.705 9.596 1.00 0.00 H new ATOM 545 N PHE A 38 -0.202 8.574 6.574 1.00 0.00 N ATOM 546 CA PHE A 38 -0.733 9.873 6.158 1.00 0.00 C ATOM 547 C PHE A 38 -2.243 9.942 6.387 1.00 0.00 C ATOM 548 O PHE A 38 -2.945 8.937 6.257 1.00 0.00 O ATOM 549 CB PHE A 38 -0.416 10.131 4.683 1.00 0.00 C ATOM 550 CG PHE A 38 0.973 10.662 4.452 1.00 0.00 C ATOM 551 CD1 PHE A 38 2.072 9.820 4.522 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.177 12.001 4.164 1.00 0.00 C ATOM 553 CE1 PHE A 38 3.348 10.305 4.308 1.00 0.00 C ATOM 554 CE2 PHE A 38 2.451 12.493 3.951 1.00 0.00 C ATOM 555 CZ PHE A 38 3.537 11.643 4.021 1.00 0.00 C ATOM 0 H PHE A 38 -0.484 7.795 5.979 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.255 10.643 6.764 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.539 9.203 4.125 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.139 10.841 4.283 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.929 8.773 4.746 1.00 0.00 H new ATOM 0 HD2 PHE A 38 0.330 12.669 4.105 1.00 0.00 H new ATOM 0 HE1 PHE A 38 4.196 9.639 4.365 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.597 13.540 3.730 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.533 12.024 3.852 1.00 0.00 H new ATOM 565 N CYS A 39 -2.739 11.132 6.736 1.00 0.00 N ATOM 566 CA CYS A 39 -4.166 11.325 6.991 1.00 0.00 C ATOM 567 C CYS A 39 -4.665 12.642 6.395 1.00 0.00 C ATOM 568 O CYS A 39 -3.935 13.633 6.358 1.00 0.00 O ATOM 569 CB CYS A 39 -4.434 11.297 8.500 1.00 0.00 C ATOM 570 SG CYS A 39 -6.157 11.593 8.960 1.00 0.00 S ATOM 0 H CYS A 39 -2.174 11.974 6.848 1.00 0.00 H new ATOM 0 HA CYS A 39 -4.709 10.512 6.510 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.128 10.328 8.893 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -3.808 12.048 8.982 1.00 0.00 H new ATOM 0 HG CYS A 39 -6.941 10.996 8.112 1.00 0.00 H new ATOM 576 N HIS A 40 -5.917 12.642 5.934 1.00 0.00 N ATOM 577 CA HIS A 40 -6.524 13.836 5.345 1.00 0.00 C ATOM 578 C HIS A 40 -7.544 14.446 6.300 1.00 0.00 C ATOM 579 O HIS A 40 -8.579 13.839 6.582 1.00 0.00 O ATOM 580 CB HIS A 40 -7.202 13.495 4.014 1.00 0.00 C ATOM 581 CG HIS A 40 -6.362 12.640 3.117 1.00 0.00 C ATOM 582 ND1 HIS A 40 -6.622 11.307 2.890 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.259 12.935 2.396 1.00 0.00 C ATOM 584 CE1 HIS A 40 -5.713 10.818 2.069 1.00 0.00 C ATOM 585 NE2 HIS A 40 -4.873 11.786 1.753 1.00 0.00 N ATOM 0 H HIS A 40 -6.531 11.827 5.957 1.00 0.00 H new ATOM 0 HA HIS A 40 -5.732 14.562 5.163 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.142 12.982 4.215 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -7.449 14.420 3.494 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.771 13.897 2.337 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -5.664 9.799 1.715 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -4.069 11.695 1.132 1.00 0.00 H new ATOM 594 N PRO A 41 -7.266 15.660 6.813 1.00 0.00 N ATOM 595 CA PRO A 41 -8.161 16.354 7.743 1.00 0.00 C ATOM 596 C PRO A 41 -9.290 17.110 7.032 1.00 0.00 C ATOM 597 O PRO A 41 -9.576 18.264 7.355 1.00 0.00 O ATOM 598 CB PRO A 41 -7.215 17.327 8.445 1.00 0.00 C ATOM 599 CG PRO A 41 -6.197 17.669 7.409 1.00 0.00 C ATOM 600 CD PRO A 41 -6.051 16.452 6.529 1.00 0.00 C ATOM 0 HA PRO A 41 -8.678 15.666 8.412 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.744 18.215 8.791 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.753 16.870 9.320 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -6.514 18.533 6.825 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.245 17.929 7.872 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.990 16.726 5.476 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.146 15.894 6.766 1.00 0.00 H new ATOM 608 N VAL A 42 -9.929 16.451 6.065 1.00 0.00 N ATOM 609 CA VAL A 42 -11.024 17.054 5.311 1.00 0.00 C ATOM 610 C VAL A 42 -12.164 16.053 5.134 1.00 0.00 C ATOM 611 O VAL A 42 -13.301 16.318 5.526 1.00 0.00 O ATOM 612 CB VAL A 42 -10.557 17.542 3.918 1.00 0.00 C ATOM 613 CG1 VAL A 42 -11.671 18.304 3.215 1.00 0.00 C ATOM 614 CG2 VAL A 42 -9.308 18.407 4.037 1.00 0.00 C ATOM 0 H VAL A 42 -9.705 15.496 5.786 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.373 17.915 5.881 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.308 16.667 3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.323 18.638 2.238 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.535 17.651 3.088 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.955 19.169 3.815 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.999 18.738 3.046 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.525 19.276 4.658 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.506 17.827 4.492 1.00 0.00 H new ATOM 624 N THR A 43 -11.841 14.904 4.546 1.00 0.00 N ATOM 625 CA THR A 43 -12.822 13.843 4.309 1.00 0.00 C ATOM 626 C THR A 43 -12.762 12.765 5.402 1.00 0.00 C ATOM 627 O THR A 43 -13.535 11.805 5.373 1.00 0.00 O ATOM 628 CB THR A 43 -12.579 13.207 2.938 1.00 0.00 C ATOM 629 OG1 THR A 43 -12.312 14.200 1.963 1.00 0.00 O ATOM 630 CG2 THR A 43 -13.745 12.378 2.437 1.00 0.00 C ATOM 0 H THR A 43 -10.900 14.681 4.222 1.00 0.00 H new ATOM 0 HA THR A 43 -13.815 14.292 4.335 1.00 0.00 H new ATOM 0 HB THR A 43 -11.723 12.548 3.080 1.00 0.00 H new ATOM 0 HG1 THR A 43 -12.158 13.773 1.095 1.00 0.00 H new ATOM 0 HG21 THR A 43 -13.501 11.959 1.461 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.945 11.569 3.140 1.00 0.00 H new ATOM 0 HG23 THR A 43 -14.629 13.009 2.350 1.00 0.00 H new ATOM 638 N ASP A 44 -11.836 12.923 6.357 1.00 0.00 N ATOM 639 CA ASP A 44 -11.671 11.965 7.451 1.00 0.00 C ATOM 640 C ASP A 44 -11.190 10.606 6.924 1.00 0.00 C ATOM 641 O ASP A 44 -11.759 9.561 7.248 1.00 0.00 O ATOM 642 CB ASP A 44 -12.983 11.807 8.234 1.00 0.00 C ATOM 643 CG ASP A 44 -13.076 12.755 9.420 1.00 0.00 C ATOM 644 OD1 ASP A 44 -12.966 13.982 9.211 1.00 0.00 O ATOM 645 OD2 ASP A 44 -13.263 12.269 10.556 1.00 0.00 O ATOM 0 H ASP A 44 -11.188 13.710 6.391 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.910 12.354 8.128 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.825 11.985 7.565 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.069 10.780 8.588 1.00 0.00 H new ATOM 650 N GLN A 45 -10.134 10.634 6.108 1.00 0.00 N ATOM 651 CA GLN A 45 -9.564 9.416 5.530 1.00 0.00 C ATOM 652 C GLN A 45 -8.179 9.122 6.116 1.00 0.00 C ATOM 653 O GLN A 45 -7.576 9.982 6.762 1.00 0.00 O ATOM 654 CB GLN A 45 -9.460 9.551 4.008 1.00 0.00 C ATOM 655 CG GLN A 45 -10.399 8.631 3.245 1.00 0.00 C ATOM 656 CD GLN A 45 -11.723 9.291 2.917 1.00 0.00 C ATOM 657 OE1 GLN A 45 -11.838 10.024 1.934 1.00 0.00 O ATOM 658 NE2 GLN A 45 -12.732 9.037 3.741 1.00 0.00 N ATOM 0 H GLN A 45 -9.655 11.491 5.832 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.227 8.587 5.776 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.671 10.583 3.729 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.435 9.342 3.703 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.917 8.312 2.321 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.581 7.733 3.836 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -12.593 8.423 4.544 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -13.647 9.455 3.571 1.00 0.00 H new ATOM 667 N SER A 46 -7.680 7.903 5.888 1.00 0.00 N ATOM 668 CA SER A 46 -6.368 7.499 6.396 1.00 0.00 C ATOM 669 C SER A 46 -5.656 6.559 5.420 1.00 0.00 C ATOM 670 O SER A 46 -6.222 5.553 4.986 1.00 0.00 O ATOM 671 CB SER A 46 -6.511 6.823 7.765 1.00 0.00 C ATOM 672 OG SER A 46 -7.210 7.653 8.679 1.00 0.00 O ATOM 0 H SER A 46 -8.165 7.181 5.356 1.00 0.00 H new ATOM 0 HA SER A 46 -5.762 8.399 6.502 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.040 5.877 7.652 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.523 6.591 8.163 1.00 0.00 H new ATOM 0 HG SER A 46 -7.288 7.196 9.542 1.00 0.00 H new ATOM 678 N LEU A 47 -4.408 6.897 5.083 1.00 0.00 N ATOM 679 CA LEU A 47 -3.600 6.094 4.163 1.00 0.00 C ATOM 680 C LEU A 47 -2.328 5.592 4.853 1.00 0.00 C ATOM 681 O LEU A 47 -1.646 6.354 5.541 1.00 0.00 O ATOM 682 CB LEU A 47 -3.234 6.918 2.919 1.00 0.00 C ATOM 683 CG LEU A 47 -4.074 6.626 1.670 1.00 0.00 C ATOM 684 CD1 LEU A 47 -5.557 6.795 1.968 1.00 0.00 C ATOM 685 CD2 LEU A 47 -3.656 7.531 0.516 1.00 0.00 C ATOM 0 H LEU A 47 -3.933 7.728 5.437 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.190 5.230 3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.331 7.976 3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.185 6.740 2.681 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.898 5.591 1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.135 6.583 1.069 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.850 6.105 2.759 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.749 7.818 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.264 7.307 -0.360 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.799 8.573 0.801 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.605 7.360 0.282 1.00 0.00 H new ATOM 697 N ILE A 48 -2.021 4.302 4.674 1.00 0.00 N ATOM 698 CA ILE A 48 -0.837 3.702 5.293 1.00 0.00 C ATOM 699 C ILE A 48 -0.084 2.796 4.313 1.00 0.00 C ATOM 700 O ILE A 48 -0.689 1.965 3.630 1.00 0.00 O ATOM 701 CB ILE A 48 -1.221 2.880 6.547 1.00 0.00 C ATOM 702 CG1 ILE A 48 -2.142 3.692 7.466 1.00 0.00 C ATOM 703 CG2 ILE A 48 0.025 2.436 7.306 1.00 0.00 C ATOM 704 CD1 ILE A 48 -3.614 3.500 7.176 1.00 0.00 C ATOM 0 H ILE A 48 -2.574 3.658 4.108 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.184 4.525 5.584 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.758 1.991 6.216 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.945 3.413 8.501 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.897 4.750 7.369 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -0.269 1.860 8.183 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.645 1.818 6.657 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.591 3.313 7.621 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -4.203 4.105 7.865 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.826 3.807 6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.876 2.449 7.302 1.00 0.00 H new ATOM 716 N VAL A 49 1.239 2.958 4.265 1.00 0.00 N ATOM 717 CA VAL A 49 2.095 2.153 3.389 1.00 0.00 C ATOM 718 C VAL A 49 3.054 1.297 4.220 1.00 0.00 C ATOM 719 O VAL A 49 3.651 1.787 5.179 1.00 0.00 O ATOM 720 CB VAL A 49 2.914 3.040 2.425 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.621 2.188 1.378 1.00 0.00 C ATOM 722 CG2 VAL A 49 2.026 4.084 1.763 1.00 0.00 C ATOM 0 H VAL A 49 1.745 3.644 4.826 1.00 0.00 H new ATOM 0 HA VAL A 49 1.442 1.509 2.800 1.00 0.00 H new ATOM 0 HB VAL A 49 3.673 3.563 3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.192 2.832 0.710 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.296 1.489 1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.882 1.632 0.802 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.625 4.696 1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.238 3.586 1.198 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.578 4.718 2.528 1.00 0.00 H new ATOM 732 N GLU A 50 3.186 0.017 3.858 1.00 0.00 N ATOM 733 CA GLU A 50 4.063 -0.897 4.592 1.00 0.00 C ATOM 734 C GLU A 50 4.965 -1.704 3.652 1.00 0.00 C ATOM 735 O GLU A 50 4.520 -2.185 2.608 1.00 0.00 O ATOM 736 CB GLU A 50 3.228 -1.853 5.451 1.00 0.00 C ATOM 737 CG GLU A 50 2.092 -1.169 6.208 1.00 0.00 C ATOM 738 CD GLU A 50 1.000 -2.131 6.646 1.00 0.00 C ATOM 739 OE1 GLU A 50 0.748 -3.122 5.928 1.00 0.00 O ATOM 740 OE2 GLU A 50 0.390 -1.887 7.708 1.00 0.00 O ATOM 0 H GLU A 50 2.700 -0.406 3.067 1.00 0.00 H new ATOM 0 HA GLU A 50 4.704 -0.290 5.232 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.810 -2.630 4.811 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.883 -2.349 6.168 1.00 0.00 H new ATOM 0 HG2 GLU A 50 2.499 -0.668 7.086 1.00 0.00 H new ATOM 0 HG3 GLU A 50 1.655 -0.397 5.574 1.00 0.00 H new ATOM 747 N LEU A 51 6.233 -1.854 4.045 1.00 0.00 N ATOM 748 CA LEU A 51 7.208 -2.613 3.258 1.00 0.00 C ATOM 749 C LEU A 51 7.538 -3.941 3.944 1.00 0.00 C ATOM 750 O LEU A 51 7.981 -3.961 5.094 1.00 0.00 O ATOM 751 CB LEU A 51 8.489 -1.792 3.054 1.00 0.00 C ATOM 752 CG LEU A 51 9.608 -2.507 2.286 1.00 0.00 C ATOM 753 CD1 LEU A 51 9.474 -2.267 0.790 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.972 -2.048 2.781 1.00 0.00 C ATOM 0 H LEU A 51 6.609 -1.458 4.907 1.00 0.00 H new ATOM 0 HA LEU A 51 6.768 -2.825 2.283 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.233 -0.876 2.522 1.00 0.00 H new ATOM 0 HB3 LEU A 51 8.872 -1.497 4.031 1.00 0.00 H new ATOM 0 HG LEU A 51 9.517 -3.578 2.468 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.278 -2.783 0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.513 -2.647 0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.535 -1.198 0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.754 -2.566 2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.071 -0.973 2.631 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.070 -2.276 3.842 1.00 0.00 H new ATOM 766 N LEU A 52 7.316 -5.046 3.229 1.00 0.00 N ATOM 767 CA LEU A 52 7.582 -6.385 3.762 1.00 0.00 C ATOM 768 C LEU A 52 8.461 -7.201 2.811 1.00 0.00 C ATOM 769 O LEU A 52 8.691 -6.806 1.666 1.00 0.00 O ATOM 770 CB LEU A 52 6.262 -7.128 4.002 1.00 0.00 C ATOM 771 CG LEU A 52 5.785 -7.169 5.457 1.00 0.00 C ATOM 772 CD1 LEU A 52 6.742 -7.982 6.316 1.00 0.00 C ATOM 773 CD2 LEU A 52 5.630 -5.759 6.012 1.00 0.00 C ATOM 0 H LEU A 52 6.952 -5.040 2.276 1.00 0.00 H new ATOM 0 HA LEU A 52 8.115 -6.267 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.486 -6.660 3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.371 -8.152 3.644 1.00 0.00 H new ATOM 0 HG LEU A 52 4.810 -7.655 5.481 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.383 -7.998 7.345 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.796 -9.002 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.733 -7.530 6.284 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.290 -5.810 7.046 1.00 0.00 H new ATOM 0 HD22 LEU A 52 6.590 -5.244 5.970 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.899 -5.212 5.417 1.00 0.00 H new ATOM 785 N GLU A 53 8.940 -8.351 3.292 1.00 0.00 N ATOM 786 CA GLU A 53 9.783 -9.236 2.490 1.00 0.00 C ATOM 787 C GLU A 53 9.113 -10.599 2.307 1.00 0.00 C ATOM 788 O GLU A 53 8.527 -11.144 3.246 1.00 0.00 O ATOM 789 CB GLU A 53 11.157 -9.407 3.151 1.00 0.00 C ATOM 790 CG GLU A 53 12.297 -8.776 2.366 1.00 0.00 C ATOM 791 CD GLU A 53 12.604 -7.359 2.815 1.00 0.00 C ATOM 792 OE1 GLU A 53 11.857 -6.438 2.423 1.00 0.00 O ATOM 793 OE2 GLU A 53 13.592 -7.172 3.555 1.00 0.00 O ATOM 0 H GLU A 53 8.757 -8.690 4.236 1.00 0.00 H new ATOM 0 HA GLU A 53 9.919 -8.783 1.508 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.128 -8.968 4.148 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.360 -10.471 3.277 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.191 -9.389 2.476 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.043 -8.770 1.306 1.00 0.00 H new ATOM 800 N LEU A 54 9.204 -11.142 1.089 1.00 0.00 N ATOM 801 CA LEU A 54 8.611 -12.443 0.761 1.00 0.00 C ATOM 802 C LEU A 54 9.059 -13.522 1.751 1.00 0.00 C ATOM 803 O LEU A 54 10.257 -13.706 1.978 1.00 0.00 O ATOM 804 CB LEU A 54 8.994 -12.851 -0.667 1.00 0.00 C ATOM 805 CG LEU A 54 7.828 -12.963 -1.654 1.00 0.00 C ATOM 806 CD1 LEU A 54 8.264 -12.530 -3.048 1.00 0.00 C ATOM 807 CD2 LEU A 54 7.292 -14.387 -1.679 1.00 0.00 C ATOM 0 H LEU A 54 9.686 -10.697 0.308 1.00 0.00 H new ATOM 0 HA LEU A 54 7.527 -12.347 0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.708 -12.124 -1.055 1.00 0.00 H new ATOM 0 HB3 LEU A 54 9.507 -13.812 -0.627 1.00 0.00 H new ATOM 0 HG LEU A 54 7.029 -12.299 -1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.423 -12.616 -3.736 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.603 -11.495 -3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.078 -13.169 -3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.464 -14.452 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 54 8.085 -15.069 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.943 -14.662 -0.684 1.00 0.00 H new ATOM 819 N GLN A 55 8.091 -14.230 2.337 1.00 0.00 N ATOM 820 CA GLN A 55 8.387 -15.286 3.303 1.00 0.00 C ATOM 821 C GLN A 55 7.737 -16.610 2.895 1.00 0.00 C ATOM 822 O GLN A 55 6.577 -16.638 2.482 1.00 0.00 O ATOM 823 CB GLN A 55 7.906 -14.873 4.698 1.00 0.00 C ATOM 824 CG GLN A 55 8.361 -15.806 5.810 1.00 0.00 C ATOM 825 CD GLN A 55 9.740 -15.457 6.343 1.00 0.00 C ATOM 826 OE1 GLN A 55 9.929 -14.412 6.965 1.00 0.00 O ATOM 827 NE2 GLN A 55 10.711 -16.332 6.104 1.00 0.00 N ATOM 0 H GLN A 55 7.097 -14.090 2.159 1.00 0.00 H new ATOM 0 HA GLN A 55 9.467 -15.432 3.323 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.266 -13.867 4.912 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.817 -14.829 4.697 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.640 -15.769 6.627 1.00 0.00 H new ATOM 0 HG3 GLN A 55 8.369 -16.831 5.438 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.511 -17.186 5.584 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.656 -16.149 6.440 1.00 0.00 H new ATOM 836 N ALA A 56 8.500 -17.701 3.024 1.00 0.00 N ATOM 837 CA ALA A 56 8.026 -19.043 2.678 1.00 0.00 C ATOM 838 C ALA A 56 7.739 -19.174 1.181 1.00 0.00 C ATOM 839 O ALA A 56 8.583 -19.659 0.428 1.00 0.00 O ATOM 840 CB ALA A 56 6.801 -19.419 3.505 1.00 0.00 C ATOM 0 H ALA A 56 9.459 -17.678 3.370 1.00 0.00 H new ATOM 0 HA ALA A 56 8.826 -19.743 2.918 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.469 -20.420 3.229 1.00 0.00 H new ATOM 0 HB2 ALA A 56 7.058 -19.401 4.564 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.000 -18.705 3.314 1.00 0.00 H new ATOM 846 N HIS A 57 6.548 -18.742 0.755 1.00 0.00 N ATOM 847 CA HIS A 57 6.159 -18.816 -0.655 1.00 0.00 C ATOM 848 C HIS A 57 4.798 -18.160 -0.889 1.00 0.00 C ATOM 849 O HIS A 57 3.838 -18.823 -1.287 1.00 0.00 O ATOM 850 CB HIS A 57 6.124 -20.278 -1.127 1.00 0.00 C ATOM 851 CG HIS A 57 5.479 -21.221 -0.156 1.00 0.00 C ATOM 852 ND1 HIS A 57 4.126 -21.223 0.111 1.00 0.00 N ATOM 853 CD2 HIS A 57 6.011 -22.206 0.606 1.00 0.00 C ATOM 854 CE1 HIS A 57 3.854 -22.167 0.994 1.00 0.00 C ATOM 855 NE2 HIS A 57 4.982 -22.778 1.310 1.00 0.00 N ATOM 0 H HIS A 57 5.838 -18.338 1.366 1.00 0.00 H new ATOM 0 HA HIS A 57 6.905 -18.272 -1.234 1.00 0.00 H new ATOM 0 HB2 HIS A 57 5.590 -20.329 -2.076 1.00 0.00 H new ATOM 0 HB3 HIS A 57 7.144 -20.611 -1.317 1.00 0.00 H new ATOM 0 HD1 HIS A 57 3.442 -20.593 -0.308 1.00 0.00 H new ATOM 0 HD2 HIS A 57 7.052 -22.489 0.651 1.00 0.00 H new ATOM 0 HE1 HIS A 57 2.877 -22.400 1.390 1.00 0.00 H new ATOM 864 N VAL A 58 4.719 -16.855 -0.635 1.00 0.00 N ATOM 865 CA VAL A 58 3.472 -16.114 -0.815 1.00 0.00 C ATOM 866 C VAL A 58 3.693 -14.836 -1.621 1.00 0.00 C ATOM 867 O VAL A 58 4.194 -13.839 -1.100 1.00 0.00 O ATOM 868 CB VAL A 58 2.827 -15.763 0.544 1.00 0.00 C ATOM 869 CG1 VAL A 58 2.270 -17.012 1.212 1.00 0.00 C ATOM 870 CG2 VAL A 58 3.826 -15.065 1.460 1.00 0.00 C ATOM 0 H VAL A 58 5.502 -16.290 -0.305 1.00 0.00 H new ATOM 0 HA VAL A 58 2.795 -16.764 -1.369 1.00 0.00 H new ATOM 0 HB VAL A 58 2.003 -15.075 0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.820 -16.744 2.168 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.514 -17.462 0.569 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.077 -17.726 1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.346 -14.829 2.410 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.678 -15.722 1.637 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.170 -14.144 0.989 1.00 0.00 H new ATOM 880 N ARG A 59 3.314 -14.875 -2.899 1.00 0.00 N ATOM 881 CA ARG A 59 3.467 -13.722 -3.786 1.00 0.00 C ATOM 882 C ARG A 59 2.399 -13.725 -4.878 1.00 0.00 C ATOM 883 O ARG A 59 2.006 -14.784 -5.373 1.00 0.00 O ATOM 884 CB ARG A 59 4.869 -13.707 -4.413 1.00 0.00 C ATOM 885 CG ARG A 59 5.151 -14.883 -5.339 1.00 0.00 C ATOM 886 CD ARG A 59 5.937 -15.979 -4.636 1.00 0.00 C ATOM 887 NE ARG A 59 5.914 -17.233 -5.390 1.00 0.00 N ATOM 888 CZ ARG A 59 6.797 -18.222 -5.230 1.00 0.00 C ATOM 889 NH1 ARG A 59 7.774 -18.119 -4.332 1.00 0.00 N ATOM 890 NH2 ARG A 59 6.701 -19.320 -5.970 1.00 0.00 N ATOM 0 H ARG A 59 2.898 -15.694 -3.343 1.00 0.00 H new ATOM 0 HA ARG A 59 3.341 -12.819 -3.188 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.995 -12.780 -4.973 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.612 -13.701 -3.615 1.00 0.00 H new ATOM 0 HG2 ARG A 59 4.209 -15.290 -5.707 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.709 -14.536 -6.208 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.969 -15.656 -4.500 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.521 -16.145 -3.642 1.00 0.00 H new ATOM 0 HE ARG A 59 5.176 -17.360 -6.082 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.853 -17.279 -3.759 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.444 -18.880 -4.217 1.00 0.00 H new ATOM 0 HH21 ARG A 59 5.954 -19.407 -6.659 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.374 -20.077 -5.850 1.00 0.00 H new ATOM 904 N GLY A 60 1.934 -12.531 -5.250 1.00 0.00 N ATOM 905 CA GLY A 60 0.915 -12.412 -6.280 1.00 0.00 C ATOM 906 C GLY A 60 -0.482 -12.298 -5.698 1.00 0.00 C ATOM 907 O GLY A 60 -0.762 -11.378 -4.925 1.00 0.00 O ATOM 0 H GLY A 60 2.246 -11.644 -4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 60 1.123 -11.536 -6.894 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.963 -13.280 -6.937 1.00 0.00 H new ATOM 911 N GLU A 61 -1.359 -13.236 -6.062 1.00 0.00 N ATOM 912 CA GLU A 61 -2.734 -13.239 -5.562 1.00 0.00 C ATOM 913 C GLU A 61 -2.804 -13.843 -4.159 1.00 0.00 C ATOM 914 O GLU A 61 -3.558 -13.365 -3.309 1.00 0.00 O ATOM 915 CB GLU A 61 -3.661 -14.013 -6.507 1.00 0.00 C ATOM 916 CG GLU A 61 -5.111 -13.565 -6.420 1.00 0.00 C ATOM 917 CD GLU A 61 -6.097 -14.701 -6.624 1.00 0.00 C ATOM 918 OE1 GLU A 61 -6.047 -15.680 -5.850 1.00 0.00 O ATOM 919 OE2 GLU A 61 -6.926 -14.605 -7.553 1.00 0.00 O ATOM 0 H GLU A 61 -1.141 -14.002 -6.700 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.068 -12.203 -5.515 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.310 -13.890 -7.532 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.601 -15.076 -6.275 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.287 -13.110 -5.445 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.293 -12.795 -7.169 1.00 0.00 H new ATOM 926 N ALA A 62 -2.008 -14.890 -3.921 1.00 0.00 N ATOM 927 CA ALA A 62 -1.972 -15.553 -2.617 1.00 0.00 C ATOM 928 C ALA A 62 -1.349 -14.646 -1.559 1.00 0.00 C ATOM 929 O ALA A 62 -1.709 -14.715 -0.383 1.00 0.00 O ATOM 930 CB ALA A 62 -1.198 -16.863 -2.704 1.00 0.00 C ATOM 0 H ALA A 62 -1.380 -15.296 -4.615 1.00 0.00 H new ATOM 0 HA ALA A 62 -2.999 -15.769 -2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.182 -17.342 -1.725 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.681 -17.524 -3.423 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.176 -16.661 -3.026 1.00 0.00 H new ATOM 936 N ALA A 63 -0.413 -13.793 -1.983 1.00 0.00 N ATOM 937 CA ALA A 63 0.258 -12.869 -1.071 1.00 0.00 C ATOM 938 C ALA A 63 -0.734 -11.885 -0.449 1.00 0.00 C ATOM 939 O ALA A 63 -0.624 -11.546 0.730 1.00 0.00 O ATOM 940 CB ALA A 63 1.366 -12.115 -1.794 1.00 0.00 C ATOM 0 H ALA A 63 -0.104 -13.725 -2.953 1.00 0.00 H new ATOM 0 HA ALA A 63 0.700 -13.457 -0.267 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.854 -11.432 -1.099 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.098 -12.825 -2.179 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.940 -11.548 -2.622 1.00 0.00 H new ATOM 946 N ALA A 64 -1.701 -11.429 -1.250 1.00 0.00 N ATOM 947 CA ALA A 64 -2.709 -10.481 -0.778 1.00 0.00 C ATOM 948 C ALA A 64 -3.502 -11.048 0.398 1.00 0.00 C ATOM 949 O ALA A 64 -3.496 -10.475 1.485 1.00 0.00 O ATOM 950 CB ALA A 64 -3.649 -10.089 -1.911 1.00 0.00 C ATOM 0 H ALA A 64 -1.805 -11.702 -2.227 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.187 -9.589 -0.431 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.392 -9.383 -1.540 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.077 -9.625 -2.714 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.152 -10.978 -2.291 1.00 0.00 H new ATOM 956 N ARG A 65 -4.183 -12.175 0.173 1.00 0.00 N ATOM 957 CA ARG A 65 -4.981 -12.813 1.224 1.00 0.00 C ATOM 958 C ARG A 65 -4.104 -13.241 2.405 1.00 0.00 C ATOM 959 O ARG A 65 -4.519 -13.132 3.560 1.00 0.00 O ATOM 960 CB ARG A 65 -5.753 -14.019 0.669 1.00 0.00 C ATOM 961 CG ARG A 65 -4.889 -15.017 -0.093 1.00 0.00 C ATOM 962 CD ARG A 65 -5.535 -15.426 -1.407 1.00 0.00 C ATOM 963 NE ARG A 65 -6.831 -16.074 -1.207 1.00 0.00 N ATOM 964 CZ ARG A 65 -7.757 -16.199 -2.161 1.00 0.00 C ATOM 965 NH1 ARG A 65 -7.526 -15.744 -3.388 1.00 0.00 N ATOM 966 NH2 ARG A 65 -8.917 -16.789 -1.890 1.00 0.00 N ATOM 0 H ARG A 65 -4.198 -12.663 -0.723 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.700 -12.077 1.584 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -6.241 -14.535 1.496 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -6.541 -13.659 0.008 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -3.911 -14.578 -0.289 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -4.724 -15.901 0.523 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -5.664 -14.545 -2.036 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -4.870 -16.105 -1.941 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.040 -16.453 -0.283 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.636 -15.296 -3.607 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -8.238 -15.843 -4.111 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.100 -17.147 -0.953 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -9.624 -16.884 -2.619 1.00 0.00 H new ATOM 980 N TYR A 66 -2.894 -13.721 2.110 1.00 0.00 N ATOM 981 CA TYR A 66 -1.961 -14.155 3.149 1.00 0.00 C ATOM 982 C TYR A 66 -1.682 -13.025 4.138 1.00 0.00 C ATOM 983 O TYR A 66 -1.890 -13.181 5.341 1.00 0.00 O ATOM 984 CB TYR A 66 -0.652 -14.638 2.514 1.00 0.00 C ATOM 985 CG TYR A 66 0.331 -15.251 3.492 1.00 0.00 C ATOM 986 CD1 TYR A 66 0.119 -16.518 4.021 1.00 0.00 C ATOM 987 CD2 TYR A 66 1.472 -14.561 3.883 1.00 0.00 C ATOM 988 CE1 TYR A 66 1.021 -17.084 4.904 1.00 0.00 C ATOM 989 CE2 TYR A 66 2.379 -15.119 4.764 1.00 0.00 C ATOM 990 CZ TYR A 66 2.146 -16.379 5.276 1.00 0.00 C ATOM 991 OH TYR A 66 3.049 -16.938 6.152 1.00 0.00 O ATOM 0 H TYR A 66 -2.538 -13.819 1.159 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.417 -14.981 3.695 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.886 -15.373 1.744 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.172 -13.796 2.015 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.765 -17.070 3.738 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.653 -13.571 3.491 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.845 -18.073 5.300 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.265 -14.572 5.050 1.00 0.00 H new ATOM 0 HH TYR A 66 3.785 -16.310 6.308 1.00 0.00 H new ATOM 1001 N HIS A 67 -1.214 -11.885 3.627 1.00 0.00 N ATOM 1002 CA HIS A 67 -0.914 -10.732 4.474 1.00 0.00 C ATOM 1003 C HIS A 67 -2.197 -10.085 4.997 1.00 0.00 C ATOM 1004 O HIS A 67 -2.215 -9.535 6.100 1.00 0.00 O ATOM 1005 CB HIS A 67 -0.075 -9.704 3.709 1.00 0.00 C ATOM 1006 CG HIS A 67 1.396 -9.819 3.973 1.00 0.00 C ATOM 1007 ND1 HIS A 67 1.964 -9.545 5.199 1.00 0.00 N ATOM 1008 CD2 HIS A 67 2.418 -10.188 3.162 1.00 0.00 C ATOM 1009 CE1 HIS A 67 3.270 -9.738 5.131 1.00 0.00 C ATOM 1010 NE2 HIS A 67 3.570 -10.129 3.906 1.00 0.00 N ATOM 0 H HIS A 67 -1.035 -11.737 2.634 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.338 -11.086 5.329 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -0.255 -9.822 2.640 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.408 -8.702 3.979 1.00 0.00 H new ATOM 0 HD2 HIS A 67 2.340 -10.475 2.124 1.00 0.00 H new ATOM 0 HE1 HIS A 67 3.972 -9.599 5.940 1.00 0.00 H new ATOM 0 HE2 HIS A 67 4.506 -10.351 3.567 1.00 0.00 H new ATOM 1019 N PHE A 68 -3.270 -10.161 4.206 1.00 0.00 N ATOM 1020 CA PHE A 68 -4.563 -9.594 4.591 1.00 0.00 C ATOM 1021 C PHE A 68 -5.022 -10.166 5.930 1.00 0.00 C ATOM 1022 O PHE A 68 -5.424 -9.421 6.825 1.00 0.00 O ATOM 1023 CB PHE A 68 -5.613 -9.884 3.511 1.00 0.00 C ATOM 1024 CG PHE A 68 -6.976 -9.305 3.798 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -7.833 -9.919 4.701 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -7.397 -8.146 3.164 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -9.085 -9.389 4.958 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -8.646 -7.614 3.419 1.00 0.00 C ATOM 1029 CZ PHE A 68 -9.490 -8.233 4.320 1.00 0.00 C ATOM 0 H PHE A 68 -3.268 -10.612 3.291 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.448 -8.515 4.693 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.257 -9.489 2.559 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.707 -10.964 3.393 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.519 -10.819 5.208 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.740 -7.653 2.462 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -9.746 -9.879 5.658 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -8.963 -6.714 2.914 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.464 -7.814 4.525 1.00 0.00 H new ATOM 1039 N GLU A 69 -4.951 -11.491 6.060 1.00 0.00 N ATOM 1040 CA GLU A 69 -5.353 -12.165 7.294 1.00 0.00 C ATOM 1041 C GLU A 69 -4.494 -11.716 8.474 1.00 0.00 C ATOM 1042 O GLU A 69 -4.941 -11.746 9.620 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.262 -13.683 7.132 1.00 0.00 C ATOM 1044 CG GLU A 69 -6.514 -14.306 6.528 1.00 0.00 C ATOM 1045 CD GLU A 69 -7.127 -15.377 7.409 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -7.295 -15.129 8.622 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -7.448 -16.465 6.885 1.00 0.00 O ATOM 0 H GLU A 69 -4.619 -12.118 5.327 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.388 -11.891 7.498 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.406 -13.922 6.501 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.075 -14.134 8.107 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.252 -13.524 6.349 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.266 -14.739 5.559 1.00 0.00 H new ATOM 1054 N ASP A 70 -3.259 -11.295 8.190 1.00 0.00 N ATOM 1055 CA ASP A 70 -2.351 -10.834 9.236 1.00 0.00 C ATOM 1056 C ASP A 70 -2.733 -9.434 9.724 1.00 0.00 C ATOM 1057 O ASP A 70 -2.409 -9.056 10.849 1.00 0.00 O ATOM 1058 CB ASP A 70 -0.903 -10.842 8.734 1.00 0.00 C ATOM 1059 CG ASP A 70 0.056 -11.456 9.738 1.00 0.00 C ATOM 1060 OD1 ASP A 70 -0.283 -12.507 10.322 1.00 0.00 O ATOM 1061 OD2 ASP A 70 1.148 -10.886 9.939 1.00 0.00 O ATOM 0 H ASP A 70 -2.869 -11.265 7.248 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.436 -11.522 10.077 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.849 -11.398 7.798 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.591 -9.820 8.516 1.00 0.00 H new ATOM 1066 N VAL A 71 -3.429 -8.668 8.881 1.00 0.00 N ATOM 1067 CA VAL A 71 -3.853 -7.319 9.247 1.00 0.00 C ATOM 1068 C VAL A 71 -5.222 -7.345 9.919 1.00 0.00 C ATOM 1069 O VAL A 71 -5.386 -6.849 11.035 1.00 0.00 O ATOM 1070 CB VAL A 71 -3.921 -6.389 8.020 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -4.182 -4.951 8.449 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -2.643 -6.487 7.195 1.00 0.00 C ATOM 0 H VAL A 71 -3.709 -8.959 7.944 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.107 -6.933 9.941 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.752 -6.712 7.393 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.226 -4.311 7.568 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.130 -4.897 8.985 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.377 -4.614 9.102 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.714 -5.822 6.334 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.790 -6.196 7.809 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.510 -7.513 6.851 1.00 0.00 H new ATOM 1082 N GLY A 72 -6.198 -7.934 9.229 1.00 0.00 N ATOM 1083 CA GLY A 72 -7.544 -8.027 9.768 1.00 0.00 C ATOM 1084 C GLY A 72 -7.737 -9.230 10.678 1.00 0.00 C ATOM 1085 O GLY A 72 -8.863 -9.546 11.054 1.00 0.00 O ATOM 0 H GLY A 72 -6.079 -8.349 8.305 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -7.771 -7.117 10.324 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.256 -8.083 8.945 1.00 0.00 H new ATOM 1089 N GLY A 73 -6.642 -9.906 11.030 1.00 0.00 N ATOM 1090 CA GLY A 73 -6.730 -11.069 11.896 1.00 0.00 C ATOM 1091 C GLY A 73 -6.026 -10.867 13.225 1.00 0.00 C ATOM 1092 O GLY A 73 -6.482 -11.366 14.254 1.00 0.00 O ATOM 0 H GLY A 73 -5.697 -9.667 10.730 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -7.779 -11.303 12.078 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.295 -11.929 11.387 1.00 0.00 H new ATOM 1096 N VAL A 74 -4.911 -10.138 13.208 1.00 0.00 N ATOM 1097 CA VAL A 74 -4.145 -9.882 14.423 1.00 0.00 C ATOM 1098 C VAL A 74 -4.768 -8.758 15.256 1.00 0.00 C ATOM 1099 O VAL A 74 -4.656 -8.757 16.483 1.00 0.00 O ATOM 1100 CB VAL A 74 -2.676 -9.533 14.098 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -1.866 -9.359 15.376 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -2.061 -10.609 13.213 1.00 0.00 C ATOM 0 H VAL A 74 -4.520 -9.715 12.366 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.168 -10.801 15.008 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.658 -8.587 13.557 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.835 -9.114 15.123 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.295 -8.553 15.972 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.888 -10.286 15.950 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.026 -10.350 12.992 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.093 -11.568 13.731 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -2.624 -10.680 12.282 1.00 0.00 H new ATOM 1112 N GLN A 75 -5.424 -7.803 14.590 1.00 0.00 N ATOM 1113 CA GLN A 75 -6.058 -6.683 15.289 1.00 0.00 C ATOM 1114 C GLN A 75 -7.523 -6.533 14.882 1.00 0.00 C ATOM 1115 O GLN A 75 -7.836 -5.889 13.877 1.00 0.00 O ATOM 1116 CB GLN A 75 -5.304 -5.379 15.009 1.00 0.00 C ATOM 1117 CG GLN A 75 -3.804 -5.473 15.234 1.00 0.00 C ATOM 1118 CD GLN A 75 -3.005 -4.851 14.103 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -2.258 -3.896 14.309 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -3.161 -5.388 12.896 1.00 0.00 N ATOM 0 H GLN A 75 -5.529 -7.783 13.576 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.019 -6.896 16.357 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.488 -5.079 13.978 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.708 -4.593 15.647 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -3.549 -4.977 16.170 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -3.521 -6.520 15.341 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -3.791 -6.180 12.768 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -2.651 -5.008 12.099 1.00 0.00 H new ATOM 1129 N GLY A 76 -8.418 -7.127 15.673 1.00 0.00 N ATOM 1130 CA GLY A 76 -9.844 -7.045 15.388 1.00 0.00 C ATOM 1131 C GLY A 76 -10.207 -7.601 14.024 1.00 0.00 C ATOM 1132 O GLY A 76 -9.656 -8.616 13.595 1.00 0.00 O ATOM 0 H GLY A 76 -8.180 -7.664 16.507 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.394 -7.590 16.155 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.162 -6.004 15.447 1.00 0.00 H new ATOM 1136 N ALA A 77 -11.140 -6.929 13.345 1.00 0.00 N ATOM 1137 CA ALA A 77 -11.591 -7.347 12.020 1.00 0.00 C ATOM 1138 C ALA A 77 -11.983 -8.823 12.016 1.00 0.00 C ATOM 1139 O ALA A 77 -11.457 -9.617 11.233 1.00 0.00 O ATOM 1140 CB ALA A 77 -10.507 -7.070 10.988 1.00 0.00 C ATOM 0 H ALA A 77 -11.599 -6.088 13.696 1.00 0.00 H new ATOM 0 HA ALA A 77 -12.477 -6.769 11.757 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -10.853 -7.385 10.004 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -10.286 -6.003 10.970 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -9.605 -7.623 11.250 1.00 0.00 H new ATOM 1146 N ARG A 78 -12.901 -9.191 12.907 1.00 0.00 N ATOM 1147 CA ARG A 78 -13.347 -10.575 13.017 1.00 0.00 C ATOM 1148 C ARG A 78 -14.091 -11.026 11.761 1.00 0.00 C ATOM 1149 O ARG A 78 -13.539 -11.764 10.942 1.00 0.00 O ATOM 1150 CB ARG A 78 -14.221 -10.761 14.259 1.00 0.00 C ATOM 1151 CG ARG A 78 -13.548 -11.585 15.345 1.00 0.00 C ATOM 1152 CD ARG A 78 -14.386 -11.630 16.612 1.00 0.00 C ATOM 1153 NE ARG A 78 -13.578 -11.928 17.794 1.00 0.00 N ATOM 1154 CZ ARG A 78 -12.853 -11.023 18.456 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -12.810 -9.758 18.041 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -12.166 -11.384 19.533 1.00 0.00 N ATOM 0 H ARG A 78 -13.349 -8.550 13.562 1.00 0.00 H new ATOM 0 HA ARG A 78 -12.461 -11.202 13.118 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -14.481 -9.782 14.663 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -15.154 -11.245 13.970 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.381 -12.599 14.982 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -12.569 -11.162 15.570 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.888 -10.672 16.748 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.164 -12.386 16.505 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.568 -12.889 18.135 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -13.333 -9.475 17.212 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -12.254 -9.072 18.552 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.192 -12.352 19.854 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.612 -10.694 20.040 1.00 0.00 H new ATOM 1170 N ALA A 79 -15.337 -10.584 11.609 1.00 0.00 N ATOM 1171 CA ALA A 79 -16.136 -10.953 10.440 1.00 0.00 C ATOM 1172 C ALA A 79 -15.660 -10.195 9.206 1.00 0.00 C ATOM 1173 O ALA A 79 -15.895 -8.994 9.076 1.00 0.00 O ATOM 1174 CB ALA A 79 -17.613 -10.689 10.690 1.00 0.00 C ATOM 0 H ALA A 79 -15.814 -9.975 12.274 1.00 0.00 H new ATOM 0 HA ALA A 79 -16.006 -12.020 10.262 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -18.187 -10.971 9.808 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -17.948 -11.277 11.544 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -17.763 -9.630 10.898 1.00 0.00 H new ATOM 1180 N VAL A 80 -14.980 -10.900 8.306 1.00 0.00 N ATOM 1181 CA VAL A 80 -14.459 -10.287 7.087 1.00 0.00 C ATOM 1182 C VAL A 80 -14.835 -11.092 5.852 1.00 0.00 C ATOM 1183 O VAL A 80 -14.598 -12.300 5.787 1.00 0.00 O ATOM 1184 CB VAL A 80 -12.924 -10.151 7.132 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -12.435 -9.195 6.055 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -12.458 -9.694 8.508 1.00 0.00 C ATOM 0 H VAL A 80 -14.777 -11.895 8.397 1.00 0.00 H new ATOM 0 HA VAL A 80 -14.910 -9.296 7.027 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.494 -11.133 6.938 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.349 -9.115 6.106 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.726 -9.572 5.074 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.879 -8.212 6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.372 -9.606 8.513 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.902 -8.726 8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.767 -10.423 9.257 1.00 0.00 H new ATOM 1196 N HIS A 81 -15.410 -10.408 4.868 1.00 0.00 N ATOM 1197 CA HIS A 81 -15.806 -11.045 3.620 1.00 0.00 C ATOM 1198 C HIS A 81 -14.968 -10.517 2.454 1.00 0.00 C ATOM 1199 O HIS A 81 -14.196 -9.567 2.613 1.00 0.00 O ATOM 1200 CB HIS A 81 -17.298 -10.816 3.363 1.00 0.00 C ATOM 1201 CG HIS A 81 -17.631 -9.448 2.854 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -16.786 -8.365 2.972 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -18.730 -8.996 2.216 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.351 -7.309 2.430 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.533 -7.662 1.961 1.00 0.00 N ATOM 0 H HIS A 81 -15.612 -9.409 4.913 1.00 0.00 H new ATOM 0 HA HIS A 81 -15.628 -12.117 3.704 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -17.648 -11.555 2.642 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -17.846 -10.990 4.289 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.603 -9.576 1.954 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -16.921 -6.320 2.377 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -19.192 -7.045 1.487 1.00 0.00 H new ATOM 1214 N VAL A 82 -15.127 -11.131 1.284 1.00 0.00 N ATOM 1215 CA VAL A 82 -14.389 -10.716 0.093 1.00 0.00 C ATOM 1216 C VAL A 82 -15.342 -10.232 -0.995 1.00 0.00 C ATOM 1217 O VAL A 82 -16.179 -10.992 -1.483 1.00 0.00 O ATOM 1218 CB VAL A 82 -13.512 -11.856 -0.475 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -12.293 -12.085 0.405 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -14.316 -13.140 -0.629 1.00 0.00 C ATOM 0 H VAL A 82 -15.760 -11.917 1.135 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.736 -9.899 0.401 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.168 -11.555 -1.465 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.689 -12.891 -0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.699 -11.172 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.616 -12.356 1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -13.675 -13.925 -1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.701 -13.447 0.343 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.149 -12.968 -1.311 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.209 -8.962 -1.367 1.00 0.00 N ATOM 1231 CA GLU A 83 -16.057 -8.372 -2.397 1.00 0.00 C ATOM 1232 C GLU A 83 -15.623 -8.830 -3.789 1.00 0.00 C ATOM 1233 O GLU A 83 -16.417 -9.400 -4.538 1.00 0.00 O ATOM 1234 CB GLU A 83 -16.020 -6.842 -2.305 1.00 0.00 C ATOM 1235 CG GLU A 83 -17.380 -6.188 -2.516 1.00 0.00 C ATOM 1236 CD GLU A 83 -17.821 -5.329 -1.342 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -17.558 -5.714 -0.182 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -18.437 -4.271 -1.584 1.00 0.00 O ATOM 0 H GLU A 83 -14.521 -8.322 -0.970 1.00 0.00 H new ATOM 0 HA GLU A 83 -17.080 -8.710 -2.231 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.635 -6.554 -1.327 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.322 -6.458 -3.048 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -17.344 -5.572 -3.415 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -18.126 -6.964 -2.690 1.00 0.00 H new ATOM 1245 N SER A 84 -14.355 -8.584 -4.124 1.00 0.00 N ATOM 1246 CA SER A 84 -13.807 -8.972 -5.423 1.00 0.00 C ATOM 1247 C SER A 84 -12.334 -8.593 -5.530 1.00 0.00 C ATOM 1248 O SER A 84 -11.898 -7.591 -4.958 1.00 0.00 O ATOM 1249 CB SER A 84 -14.595 -8.315 -6.560 1.00 0.00 C ATOM 1250 OG SER A 84 -15.345 -9.273 -7.286 1.00 0.00 O ATOM 0 H SER A 84 -13.687 -8.116 -3.511 1.00 0.00 H new ATOM 0 HA SER A 84 -13.895 -10.055 -5.510 1.00 0.00 H new ATOM 0 HB2 SER A 84 -15.265 -7.559 -6.151 1.00 0.00 H new ATOM 0 HB3 SER A 84 -13.908 -7.802 -7.233 1.00 0.00 H new ATOM 0 HG SER A 84 -16.004 -9.690 -6.693 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.570 -9.396 -6.272 1.00 0.00 N ATOM 1257 CA VAL A 85 -10.147 -9.139 -6.457 1.00 0.00 C ATOM 1258 C VAL A 85 -9.900 -8.378 -7.759 1.00 0.00 C ATOM 1259 O VAL A 85 -10.352 -8.792 -8.828 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.320 -10.447 -6.457 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.720 -11.355 -7.615 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -7.830 -10.136 -6.502 1.00 0.00 C ATOM 0 H VAL A 85 -11.915 -10.227 -6.752 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.821 -8.530 -5.614 1.00 0.00 H new ATOM 0 HB VAL A 85 -9.533 -10.980 -5.531 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -9.121 -12.265 -7.587 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -10.776 -11.612 -7.528 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -9.550 -10.837 -8.559 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -7.264 -11.067 -6.501 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.603 -9.574 -7.408 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -7.555 -9.544 -5.629 1.00 0.00 H new ATOM 1272 N GLN A 86 -9.182 -7.261 -7.660 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.877 -6.444 -8.827 1.00 0.00 C ATOM 1274 C GLN A 86 -7.418 -6.618 -9.245 1.00 0.00 C ATOM 1275 O GLN A 86 -6.521 -5.991 -8.678 1.00 0.00 O ATOM 1276 CB GLN A 86 -9.173 -4.971 -8.541 1.00 0.00 C ATOM 1277 CG GLN A 86 -9.807 -4.241 -9.715 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.850 -3.278 -10.393 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -8.997 -2.061 -10.286 1.00 0.00 O ATOM 1280 NE2 GLN A 86 -7.861 -3.820 -11.097 1.00 0.00 N ATOM 0 H GLN A 86 -8.802 -6.903 -6.784 1.00 0.00 H new ATOM 0 HA GLN A 86 -9.512 -6.776 -9.649 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -9.837 -4.903 -7.679 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -8.245 -4.468 -8.269 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -10.158 -4.971 -10.444 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -10.682 -3.692 -9.366 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.776 -4.835 -11.160 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -7.187 -3.221 -11.575 1.00 0.00 H new ATOM 1289 N PRO A 87 -7.162 -7.478 -10.249 1.00 0.00 N ATOM 1290 CA PRO A 87 -5.806 -7.733 -10.745 1.00 0.00 C ATOM 1291 C PRO A 87 -5.238 -6.541 -11.518 1.00 0.00 C ATOM 1292 O PRO A 87 -5.829 -6.084 -12.495 1.00 0.00 O ATOM 1293 CB PRO A 87 -5.987 -8.939 -11.671 1.00 0.00 C ATOM 1294 CG PRO A 87 -7.405 -8.864 -12.121 1.00 0.00 C ATOM 1295 CD PRO A 87 -8.177 -8.268 -10.977 1.00 0.00 C ATOM 0 HA PRO A 87 -5.099 -7.907 -9.933 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.301 -8.895 -12.517 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -5.787 -9.874 -11.147 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -7.497 -8.248 -13.016 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.786 -9.853 -12.374 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -8.996 -7.641 -11.329 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.615 -9.039 -10.344 1.00 0.00 H new ATOM 1303 N LEU A 88 -4.085 -6.044 -11.066 1.00 0.00 N ATOM 1304 CA LEU A 88 -3.430 -4.906 -11.709 1.00 0.00 C ATOM 1305 C LEU A 88 -2.414 -5.375 -12.753 1.00 0.00 C ATOM 1306 O LEU A 88 -2.134 -6.571 -12.865 1.00 0.00 O ATOM 1307 CB LEU A 88 -2.736 -4.029 -10.661 1.00 0.00 C ATOM 1308 CG LEU A 88 -3.648 -3.489 -9.555 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -2.831 -3.066 -8.343 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -4.479 -2.324 -10.074 1.00 0.00 C ATOM 0 H LEU A 88 -3.586 -6.413 -10.256 1.00 0.00 H new ATOM 0 HA LEU A 88 -4.196 -4.319 -12.215 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.935 -4.607 -10.200 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.268 -3.185 -11.169 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.325 -4.286 -9.248 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.498 -2.686 -7.569 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.281 -3.924 -7.958 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.128 -2.285 -8.633 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.122 -1.952 -9.276 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.817 -1.526 -10.409 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.094 -2.659 -10.909 1.00 0.00 H new ATOM 1322 N SER A 89 -1.870 -4.427 -13.517 1.00 0.00 N ATOM 1323 CA SER A 89 -0.889 -4.741 -14.555 1.00 0.00 C ATOM 1324 C SER A 89 0.367 -3.878 -14.412 1.00 0.00 C ATOM 1325 O SER A 89 0.431 -2.997 -13.555 1.00 0.00 O ATOM 1326 CB SER A 89 -1.513 -4.537 -15.938 1.00 0.00 C ATOM 1327 OG SER A 89 -0.728 -5.141 -16.949 1.00 0.00 O ATOM 0 H SER A 89 -2.093 -3.435 -13.436 1.00 0.00 H new ATOM 0 HA SER A 89 -0.594 -5.784 -14.440 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.517 -4.960 -15.952 1.00 0.00 H new ATOM 0 HB3 SER A 89 -1.614 -3.471 -16.141 1.00 0.00 H new ATOM 0 HG SER A 89 -1.151 -4.997 -17.821 1.00 0.00 H new ATOM 1333 N LEU A 90 1.362 -4.140 -15.261 1.00 0.00 N ATOM 1334 CA LEU A 90 2.619 -3.390 -15.237 1.00 0.00 C ATOM 1335 C LEU A 90 2.398 -1.932 -15.645 1.00 0.00 C ATOM 1336 O LEU A 90 3.099 -1.036 -15.172 1.00 0.00 O ATOM 1337 CB LEU A 90 3.649 -4.044 -16.165 1.00 0.00 C ATOM 1338 CG LEU A 90 5.113 -3.750 -15.823 1.00 0.00 C ATOM 1339 CD1 LEU A 90 5.992 -4.950 -16.147 1.00 0.00 C ATOM 1340 CD2 LEU A 90 5.599 -2.513 -16.567 1.00 0.00 C ATOM 0 H LEU A 90 1.322 -4.867 -15.975 1.00 0.00 H new ATOM 0 HA LEU A 90 3.000 -3.406 -14.216 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.498 -5.123 -16.146 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.457 -3.713 -17.186 1.00 0.00 H new ATOM 0 HG LEU A 90 5.182 -3.555 -14.753 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.028 -4.720 -15.897 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.661 -5.811 -15.566 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.918 -5.179 -17.210 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.641 -2.320 -16.311 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.514 -2.677 -17.641 1.00 0.00 H new ATOM 0 HD23 LEU A 90 4.991 -1.655 -16.282 1.00 0.00 H new ATOM 1352 N GLU A 91 1.420 -1.700 -16.525 1.00 0.00 N ATOM 1353 CA GLU A 91 1.106 -0.351 -16.996 1.00 0.00 C ATOM 1354 C GLU A 91 0.744 0.583 -15.835 1.00 0.00 C ATOM 1355 O GLU A 91 0.892 1.799 -15.946 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.040 -0.394 -18.011 1.00 0.00 C ATOM 1357 CG GLU A 91 -0.181 0.885 -18.830 1.00 0.00 C ATOM 1358 CD GLU A 91 0.785 0.956 -20.004 1.00 0.00 C ATOM 1359 OE1 GLU A 91 1.829 0.273 -19.968 1.00 0.00 O ATOM 1360 OE2 GLU A 91 0.492 1.701 -20.963 1.00 0.00 O ATOM 0 H GLU A 91 0.832 -2.431 -16.925 1.00 0.00 H new ATOM 0 HA GLU A 91 1.999 0.045 -17.479 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.118 -1.233 -18.688 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -0.975 -0.582 -17.483 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.202 0.959 -19.204 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.017 1.745 -18.180 1.00 0.00 H new ATOM 1367 N ASN A 92 0.272 0.009 -14.723 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.100 0.799 -13.547 1.00 0.00 C ATOM 1369 C ASN A 92 1.081 1.621 -13.036 1.00 0.00 C ATOM 1370 O ASN A 92 0.885 2.675 -12.432 1.00 0.00 O ATOM 1371 CB ASN A 92 -0.636 -0.109 -12.432 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.119 0.096 -12.169 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -2.540 0.265 -11.025 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -2.919 0.080 -13.230 1.00 0.00 N ATOM 0 H ASN A 92 0.139 -0.996 -14.614 1.00 0.00 H new ATOM 0 HA ASN A 92 -0.889 1.489 -13.848 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.460 -1.150 -12.701 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.079 0.082 -11.515 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.924 0.211 -13.113 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.528 -0.063 -14.161 1.00 0.00 H new ATOM 1381 N LEU A 93 2.305 1.156 -13.293 1.00 0.00 N ATOM 1382 CA LEU A 93 3.483 1.887 -12.866 1.00 0.00 C ATOM 1383 C LEU A 93 3.729 3.056 -13.811 1.00 0.00 C ATOM 1384 O LEU A 93 4.163 2.869 -14.948 1.00 0.00 O ATOM 1385 CB LEU A 93 4.708 0.969 -12.813 1.00 0.00 C ATOM 1386 CG LEU A 93 4.971 0.317 -11.454 1.00 0.00 C ATOM 1387 CD1 LEU A 93 4.138 -0.950 -11.300 1.00 0.00 C ATOM 1388 CD2 LEU A 93 6.455 0.015 -11.288 1.00 0.00 C ATOM 0 H LEU A 93 2.498 0.286 -13.789 1.00 0.00 H new ATOM 0 HA LEU A 93 3.312 2.271 -11.860 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.586 0.183 -13.558 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.588 1.546 -13.098 1.00 0.00 H new ATOM 0 HG LEU A 93 4.676 1.014 -10.670 1.00 0.00 H new ATOM 0 HD11 LEU A 93 4.338 -1.401 -10.328 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.079 -0.701 -11.374 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.400 -1.656 -12.088 1.00 0.00 H new ATOM 0 HD21 LEU A 93 6.626 -0.448 -10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.778 -0.665 -12.076 1.00 0.00 H new ATOM 0 HD23 LEU A 93 7.024 0.942 -11.353 1.00 0.00 H new ATOM 1400 N ALA A 94 3.428 4.256 -13.326 1.00 0.00 N ATOM 1401 CA ALA A 94 3.595 5.486 -14.104 1.00 0.00 C ATOM 1402 C ALA A 94 4.915 5.472 -14.861 1.00 0.00 C ATOM 1403 O ALA A 94 4.933 5.397 -16.090 1.00 0.00 O ATOM 1404 CB ALA A 94 3.514 6.708 -13.197 1.00 0.00 C ATOM 0 H ALA A 94 3.062 4.407 -12.386 1.00 0.00 H new ATOM 0 HA ALA A 94 2.785 5.540 -14.831 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.640 7.612 -13.793 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.542 6.731 -12.704 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.301 6.656 -12.445 1.00 0.00 H new ATOM 1410 N LEU A 95 6.020 5.514 -14.117 1.00 0.00 N ATOM 1411 CA LEU A 95 7.347 5.471 -14.725 1.00 0.00 C ATOM 1412 C LEU A 95 7.558 4.127 -15.424 1.00 0.00 C ATOM 1413 O LEU A 95 8.339 4.024 -16.370 1.00 0.00 O ATOM 1414 CB LEU A 95 8.438 5.701 -13.670 1.00 0.00 C ATOM 1415 CG LEU A 95 8.767 4.496 -12.781 1.00 0.00 C ATOM 1416 CD1 LEU A 95 10.046 4.753 -11.998 1.00 0.00 C ATOM 1417 CD2 LEU A 95 7.613 4.189 -11.837 1.00 0.00 C ATOM 0 H LEU A 95 6.022 5.577 -13.099 1.00 0.00 H new ATOM 0 HA LEU A 95 7.416 6.270 -15.463 1.00 0.00 H new ATOM 0 HB2 LEU A 95 9.350 6.014 -14.179 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.131 6.528 -13.030 1.00 0.00 H new ATOM 0 HG LEU A 95 8.919 3.627 -13.421 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.268 3.890 -11.371 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.870 4.919 -12.692 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.917 5.634 -11.370 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.869 3.330 -11.216 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.424 5.053 -11.201 1.00 0.00 H new ATOM 0 HD23 LEU A 95 6.718 3.963 -12.417 1.00 0.00 H new ATOM 1429 N ARG A 96 6.840 3.103 -14.947 1.00 0.00 N ATOM 1430 CA ARG A 96 6.916 1.760 -15.513 1.00 0.00 C ATOM 1431 C ARG A 96 8.350 1.214 -15.441 1.00 0.00 C ATOM 1432 O ARG A 96 8.928 0.814 -16.457 1.00 0.00 O ATOM 1433 CB ARG A 96 6.418 1.778 -16.970 1.00 0.00 C ATOM 1434 CG ARG A 96 5.163 0.951 -17.207 1.00 0.00 C ATOM 1435 CD ARG A 96 4.687 1.057 -18.650 1.00 0.00 C ATOM 1436 NE ARG A 96 3.988 2.319 -18.918 1.00 0.00 N ATOM 1437 CZ ARG A 96 3.852 2.856 -20.137 1.00 0.00 C ATOM 1438 NH1 ARG A 96 4.358 2.250 -21.208 1.00 0.00 N ATOM 1439 NH2 ARG A 96 3.200 4.005 -20.289 1.00 0.00 N ATOM 0 H ARG A 96 6.194 3.186 -14.162 1.00 0.00 H new ATOM 0 HA ARG A 96 6.277 1.100 -14.927 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.221 2.809 -17.263 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.212 1.408 -17.619 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.363 -0.093 -16.965 1.00 0.00 H new ATOM 0 HG3 ARG A 96 4.372 1.288 -16.537 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.543 0.970 -19.319 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.022 0.222 -18.873 1.00 0.00 H new ATOM 0 HE ARG A 96 3.581 2.818 -18.127 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.856 1.366 -21.106 1.00 0.00 H new ATOM 0 HH12 ARG A 96 4.248 2.670 -22.131 1.00 0.00 H new ATOM 0 HH21 ARG A 96 2.803 4.478 -19.477 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.097 4.414 -21.218 1.00 0.00 H new ATOM 1453 N GLY A 97 8.918 1.195 -14.231 1.00 0.00 N ATOM 1454 CA GLY A 97 10.271 0.687 -14.053 1.00 0.00 C ATOM 1455 C GLY A 97 10.308 -0.817 -14.190 1.00 0.00 C ATOM 1456 O GLY A 97 10.197 -1.339 -15.300 1.00 0.00 O ATOM 0 H GLY A 97 8.466 1.521 -13.377 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.933 1.139 -14.792 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.645 0.975 -13.071 1.00 0.00 H new ATOM 1460 N ARG A 98 10.422 -1.523 -13.068 1.00 0.00 N ATOM 1461 CA ARG A 98 10.417 -2.979 -13.098 1.00 0.00 C ATOM 1462 C ARG A 98 9.486 -3.526 -12.018 1.00 0.00 C ATOM 1463 O ARG A 98 9.806 -3.508 -10.829 1.00 0.00 O ATOM 1464 CB ARG A 98 11.841 -3.545 -12.932 1.00 0.00 C ATOM 1465 CG ARG A 98 12.622 -2.978 -11.753 1.00 0.00 C ATOM 1466 CD ARG A 98 13.330 -1.682 -12.124 1.00 0.00 C ATOM 1467 NE ARG A 98 14.721 -1.899 -12.532 1.00 0.00 N ATOM 1468 CZ ARG A 98 15.453 -0.991 -13.184 1.00 0.00 C ATOM 1469 NH1 ARG A 98 14.933 0.191 -13.502 1.00 0.00 N ATOM 1470 NH2 ARG A 98 16.712 -1.261 -13.515 1.00 0.00 N ATOM 0 H ARG A 98 10.518 -1.115 -12.138 1.00 0.00 H new ATOM 0 HA ARG A 98 10.047 -3.299 -14.072 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.776 -4.627 -12.819 1.00 0.00 H new ATOM 0 HB3 ARG A 98 12.402 -3.353 -13.847 1.00 0.00 H new ATOM 0 HG2 ARG A 98 11.944 -2.797 -10.919 1.00 0.00 H new ATOM 0 HG3 ARG A 98 13.355 -3.710 -11.415 1.00 0.00 H new ATOM 0 HD2 ARG A 98 12.789 -1.195 -12.935 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.306 -1.002 -11.272 1.00 0.00 H new ATOM 0 HE ARG A 98 15.155 -2.794 -12.305 1.00 0.00 H new ATOM 0 HH11 ARG A 98 13.970 0.409 -13.248 1.00 0.00 H new ATOM 0 HH12 ARG A 98 15.498 0.879 -14.000 1.00 0.00 H new ATOM 0 HH21 ARG A 98 17.121 -2.163 -13.271 1.00 0.00 H new ATOM 0 HH22 ARG A 98 17.269 -0.566 -14.013 1.00 0.00 H new ATOM 1484 N CYS A 99 8.323 -4.013 -12.453 1.00 0.00 N ATOM 1485 CA CYS A 99 7.329 -4.570 -11.537 1.00 0.00 C ATOM 1486 C CYS A 99 6.895 -5.964 -11.985 1.00 0.00 C ATOM 1487 O CYS A 99 6.489 -6.155 -13.131 1.00 0.00 O ATOM 1488 CB CYS A 99 6.110 -3.648 -11.456 1.00 0.00 C ATOM 1489 SG CYS A 99 4.862 -4.174 -10.256 1.00 0.00 S ATOM 0 H CYS A 99 8.047 -4.033 -13.435 1.00 0.00 H new ATOM 0 HA CYS A 99 7.785 -4.650 -10.550 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.445 -2.643 -11.199 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.648 -3.587 -12.441 1.00 0.00 H new ATOM 0 HG CYS A 99 3.724 -3.614 -10.540 1.00 0.00 H new ATOM 1495 N GLN A 100 6.975 -6.933 -11.074 1.00 0.00 N ATOM 1496 CA GLN A 100 6.581 -8.307 -11.380 1.00 0.00 C ATOM 1497 C GLN A 100 5.074 -8.399 -11.622 1.00 0.00 C ATOM 1498 O GLN A 100 4.637 -8.964 -12.624 1.00 0.00 O ATOM 1499 CB GLN A 100 6.983 -9.251 -10.241 1.00 0.00 C ATOM 1500 CG GLN A 100 7.972 -10.327 -10.660 1.00 0.00 C ATOM 1501 CD GLN A 100 7.312 -11.676 -10.875 1.00 0.00 C ATOM 1502 OE1 GLN A 100 7.040 -12.405 -9.920 1.00 0.00 O ATOM 1503 NE2 GLN A 100 7.050 -12.017 -12.132 1.00 0.00 N ATOM 0 H GLN A 100 7.308 -6.792 -10.120 1.00 0.00 H new ATOM 0 HA GLN A 100 7.101 -8.609 -12.289 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.418 -8.665 -9.432 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.087 -9.728 -9.843 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.469 -10.020 -11.580 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.744 -10.422 -9.897 1.00 0.00 H new ATOM 0 HE21 GLN A 100 7.292 -11.383 -12.893 1.00 0.00 H new ATOM 0 HE22 GLN A 100 6.607 -12.913 -12.336 1.00 0.00 H new ATOM 1512 N GLU A 101 4.291 -7.835 -10.698 1.00 0.00 N ATOM 1513 CA GLU A 101 2.831 -7.845 -10.803 1.00 0.00 C ATOM 1514 C GLU A 101 2.197 -7.016 -9.683 1.00 0.00 C ATOM 1515 O GLU A 101 2.900 -6.473 -8.826 1.00 0.00 O ATOM 1516 CB GLU A 101 2.299 -9.282 -10.752 1.00 0.00 C ATOM 1517 CG GLU A 101 1.248 -9.585 -11.809 1.00 0.00 C ATOM 1518 CD GLU A 101 1.853 -9.920 -13.158 1.00 0.00 C ATOM 1519 OE1 GLU A 101 2.380 -11.042 -13.310 1.00 0.00 O ATOM 1520 OE2 GLU A 101 1.807 -9.056 -14.060 1.00 0.00 O ATOM 0 H GLU A 101 4.647 -7.364 -9.866 1.00 0.00 H new ATOM 0 HA GLU A 101 2.561 -7.400 -11.761 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.133 -9.973 -10.874 1.00 0.00 H new ATOM 0 HB3 GLU A 101 1.873 -9.467 -9.766 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.632 -10.420 -11.474 1.00 0.00 H new ATOM 0 HG3 GLU A 101 0.587 -8.725 -11.915 1.00 0.00 H new ATOM 1527 N ALA A 102 0.866 -6.920 -9.695 1.00 0.00 N ATOM 1528 CA ALA A 102 0.140 -6.157 -8.682 1.00 0.00 C ATOM 1529 C ALA A 102 -1.316 -6.615 -8.582 1.00 0.00 C ATOM 1530 O ALA A 102 -1.949 -6.915 -9.594 1.00 0.00 O ATOM 1531 CB ALA A 102 0.214 -4.670 -8.992 1.00 0.00 C ATOM 0 H ALA A 102 0.271 -7.362 -10.396 1.00 0.00 H new ATOM 0 HA ALA A 102 0.612 -6.338 -7.716 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.331 -4.112 -8.230 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.256 -4.351 -9.000 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.231 -4.479 -9.969 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.838 -6.671 -7.355 1.00 0.00 N ATOM 1538 CA TRP A 103 -3.219 -7.100 -7.122 1.00 0.00 C ATOM 1539 C TRP A 103 -3.908 -6.207 -6.086 1.00 0.00 C ATOM 1540 O TRP A 103 -3.247 -5.496 -5.327 1.00 0.00 O ATOM 1541 CB TRP A 103 -3.256 -8.558 -6.649 1.00 0.00 C ATOM 1542 CG TRP A 103 -2.700 -9.534 -7.645 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -1.385 -9.729 -7.958 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -3.445 -10.451 -8.458 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -1.267 -10.707 -8.915 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -2.517 -11.167 -9.237 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.807 -10.737 -8.601 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -2.908 -12.147 -10.146 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.192 -11.711 -9.504 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -4.245 -12.406 -10.265 1.00 0.00 C ATOM 0 H TRP A 103 -1.326 -6.425 -6.508 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.755 -7.014 -8.067 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -2.694 -8.643 -5.719 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -4.287 -8.831 -6.424 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.558 -9.192 -7.517 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -0.391 -11.037 -9.320 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -5.544 -10.207 -8.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -2.180 -12.684 -10.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -6.241 -11.939 -9.624 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -4.577 -13.162 -10.961 1.00 0.00 H new ATOM 1561 N VAL A 104 -5.242 -6.255 -6.063 1.00 0.00 N ATOM 1562 CA VAL A 104 -6.030 -5.456 -5.125 1.00 0.00 C ATOM 1563 C VAL A 104 -7.167 -6.278 -4.514 1.00 0.00 C ATOM 1564 O VAL A 104 -7.893 -6.971 -5.228 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.639 -4.212 -5.809 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -7.312 -3.307 -4.786 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -5.583 -3.445 -6.591 1.00 0.00 C ATOM 0 H VAL A 104 -5.799 -6.841 -6.685 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.344 -5.137 -4.340 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.397 -4.556 -6.513 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.733 -2.438 -5.291 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.108 -3.856 -4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.577 -2.979 -4.051 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.040 -2.575 -7.062 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.794 -3.119 -5.913 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -5.158 -4.091 -7.359 1.00 0.00 H new ATOM 1577 N LEU A 105 -7.323 -6.183 -3.194 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.379 -6.904 -2.485 1.00 0.00 C ATOM 1579 C LEU A 105 -9.313 -5.927 -1.773 1.00 0.00 C ATOM 1580 O LEU A 105 -8.955 -5.340 -0.750 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.778 -7.891 -1.477 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.504 -9.237 -1.380 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -7.517 -10.390 -1.512 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -9.276 -9.337 -0.071 1.00 0.00 C ATOM 0 H LEU A 105 -6.729 -5.612 -2.593 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.957 -7.466 -3.219 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.738 -8.074 -1.746 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.775 -7.425 -0.492 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.216 -9.302 -2.202 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.052 -11.337 -1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.014 -10.330 -2.477 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.778 -10.330 -0.713 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -9.785 -10.300 -0.021 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.585 -9.248 0.767 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.012 -8.535 -0.021 1.00 0.00 H new ATOM 1596 N SER A 106 -10.513 -5.755 -2.328 1.00 0.00 N ATOM 1597 CA SER A 106 -11.506 -4.847 -1.757 1.00 0.00 C ATOM 1598 C SER A 106 -12.541 -5.612 -0.934 1.00 0.00 C ATOM 1599 O SER A 106 -13.038 -6.657 -1.363 1.00 0.00 O ATOM 1600 CB SER A 106 -12.203 -4.051 -2.866 1.00 0.00 C ATOM 1601 OG SER A 106 -11.282 -3.653 -3.870 1.00 0.00 O ATOM 0 H SER A 106 -10.821 -6.234 -3.174 1.00 0.00 H new ATOM 0 HA SER A 106 -10.985 -4.154 -1.096 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.991 -4.658 -3.312 1.00 0.00 H new ATOM 0 HB3 SER A 106 -12.682 -3.170 -2.439 1.00 0.00 H new ATOM 0 HG SER A 106 -11.754 -3.148 -4.565 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.860 -5.085 0.247 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.832 -5.728 1.114 1.00 0.00 C ATOM 1609 C GLY A 107 -14.073 -4.960 2.403 1.00 0.00 C ATOM 1610 O GLY A 107 -13.776 -3.767 2.490 1.00 0.00 O ATOM 0 H GLY A 107 -12.461 -4.223 0.618 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.775 -5.834 0.578 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.487 -6.734 1.355 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.619 -5.653 3.404 1.00 0.00 N ATOM 1615 CA LYS A 108 -14.909 -5.043 4.704 1.00 0.00 C ATOM 1616 C LYS A 108 -14.774 -6.069 5.830 1.00 0.00 C ATOM 1617 O LYS A 108 -14.950 -7.270 5.608 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.323 -4.448 4.721 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.662 -3.631 3.484 1.00 0.00 C ATOM 1620 CD LYS A 108 -18.064 -3.045 3.567 1.00 0.00 C ATOM 1621 CE LYS A 108 -19.122 -4.055 3.147 1.00 0.00 C ATOM 1622 NZ LYS A 108 -20.347 -3.972 3.992 1.00 0.00 N ATOM 0 H LYS A 108 -14.870 -6.640 3.339 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.184 -4.245 4.864 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -17.046 -5.258 4.819 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.430 -3.816 5.603 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.937 -2.826 3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -16.582 -4.261 2.598 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -18.261 -2.715 4.587 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -18.128 -2.164 2.929 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -19.390 -3.885 2.104 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.707 -5.061 3.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -21.040 -4.678 3.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -20.098 -4.160 4.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -20.760 -3.021 3.913 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.468 -5.587 7.036 1.00 0.00 N ATOM 1637 CA GLN A 109 -14.313 -6.460 8.197 1.00 0.00 C ATOM 1638 C GLN A 109 -15.127 -5.943 9.378 1.00 0.00 C ATOM 1639 O GLN A 109 -15.604 -4.806 9.366 1.00 0.00 O ATOM 1640 CB GLN A 109 -12.836 -6.571 8.587 1.00 0.00 C ATOM 1641 CG GLN A 109 -12.168 -5.228 8.858 1.00 0.00 C ATOM 1642 CD GLN A 109 -10.728 -5.170 8.378 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -10.210 -6.133 7.808 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -10.070 -4.038 8.606 1.00 0.00 N ATOM 0 H GLN A 109 -14.323 -4.597 7.232 1.00 0.00 H new ATOM 0 HA GLN A 109 -14.684 -7.449 7.929 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -12.751 -7.195 9.477 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.296 -7.080 7.788 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -12.740 -4.440 8.369 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -12.196 -5.025 9.928 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.535 -3.264 9.081 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -9.100 -3.943 8.306 1.00 0.00 H new ATOM 1653 N GLN A 110 -15.282 -6.783 10.401 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.038 -6.407 11.587 1.00 0.00 C ATOM 1655 C GLN A 110 -15.099 -6.143 12.758 1.00 0.00 C ATOM 1656 O GLN A 110 -14.817 -7.040 13.559 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.047 -7.505 11.940 1.00 0.00 C ATOM 1658 CG GLN A 110 -17.724 -7.307 13.287 1.00 0.00 C ATOM 1659 CD GLN A 110 -18.592 -8.485 13.685 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -19.818 -8.404 13.651 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -17.959 -9.587 14.072 1.00 0.00 N ATOM 0 H GLN A 110 -14.894 -7.726 10.429 1.00 0.00 H new ATOM 0 HA GLN A 110 -16.585 -5.488 11.376 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -17.810 -7.547 11.163 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -16.537 -8.468 11.938 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -16.963 -7.147 14.051 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -18.336 -6.406 13.252 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -16.939 -9.611 14.085 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -18.493 -10.409 14.356 1.00 0.00 H new ATOM 1670 N ILE A 111 -14.611 -4.909 12.850 1.00 0.00 N ATOM 1671 CA ILE A 111 -13.699 -4.536 13.926 1.00 0.00 C ATOM 1672 C ILE A 111 -14.463 -4.252 15.215 1.00 0.00 C ATOM 1673 O ILE A 111 -15.018 -3.169 15.412 1.00 0.00 O ATOM 1674 CB ILE A 111 -12.810 -3.334 13.538 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -11.848 -2.977 14.677 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -13.651 -2.125 13.145 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -10.505 -2.473 14.191 1.00 0.00 C ATOM 0 H ILE A 111 -14.830 -4.156 12.198 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.039 -5.386 14.098 1.00 0.00 H new ATOM 0 HB ILE A 111 -12.220 -3.626 12.669 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -12.308 -2.215 15.306 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -11.694 -3.857 15.302 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -12.995 -1.297 12.878 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.279 -2.381 12.291 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.282 -1.832 13.984 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -9.873 -2.239 15.047 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -10.025 -3.242 13.585 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -10.649 -1.575 13.590 1.00 0.00 H new ATOM 1689 N ALA A 112 -14.490 -5.261 16.081 1.00 0.00 N ATOM 1690 CA ALA A 112 -15.185 -5.176 17.364 1.00 0.00 C ATOM 1691 C ALA A 112 -14.207 -5.241 18.536 1.00 0.00 C ATOM 1692 O ALA A 112 -13.407 -6.174 18.629 1.00 0.00 O ATOM 1693 CB ALA A 112 -16.203 -6.301 17.474 1.00 0.00 C ATOM 0 H ALA A 112 -14.033 -6.158 15.915 1.00 0.00 H new ATOM 0 HA ALA A 112 -15.696 -4.214 17.408 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -16.718 -6.233 18.432 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -16.928 -6.216 16.665 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -15.693 -7.262 17.404 1.00 0.00 H new ATOM 1800 N ALA A 119 -19.910 -4.010 16.145 1.00 0.00 N ATOM 1801 CA ALA A 119 -18.852 -3.384 15.350 1.00 0.00 C ATOM 1802 C ALA A 119 -19.438 -2.596 14.174 1.00 0.00 C ATOM 1803 O ALA A 119 -20.659 -2.491 14.033 1.00 0.00 O ATOM 1804 CB ALA A 119 -17.873 -4.438 14.850 1.00 0.00 C ATOM 0 HA ALA A 119 -18.317 -2.683 15.990 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -17.092 -3.958 14.260 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -17.423 -4.949 15.701 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -18.403 -5.162 14.230 1.00 0.00 H new ATOM 1810 N LYS A 120 -18.561 -2.040 13.335 1.00 0.00 N ATOM 1811 CA LYS A 120 -18.991 -1.260 12.173 1.00 0.00 C ATOM 1812 C LYS A 120 -18.268 -1.716 10.905 1.00 0.00 C ATOM 1813 O LYS A 120 -17.094 -2.093 10.953 1.00 0.00 O ATOM 1814 CB LYS A 120 -18.730 0.232 12.409 1.00 0.00 C ATOM 1815 CG LYS A 120 -19.523 0.823 13.566 1.00 0.00 C ATOM 1816 CD LYS A 120 -18.894 2.113 14.075 1.00 0.00 C ATOM 1817 CE LYS A 120 -18.077 1.877 15.338 1.00 0.00 C ATOM 1818 NZ LYS A 120 -16.939 2.832 15.459 1.00 0.00 N ATOM 0 H LYS A 120 -17.549 -2.116 13.439 1.00 0.00 H new ATOM 0 HA LYS A 120 -20.060 -1.422 12.038 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -17.667 0.379 12.598 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -18.971 0.781 11.499 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -20.546 1.018 13.245 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -19.577 0.098 14.379 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -18.254 2.537 13.301 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -19.676 2.845 14.278 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.724 1.973 16.210 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.694 0.856 15.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -16.411 2.634 16.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -16.307 2.724 14.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -17.304 3.805 15.488 1.00 0.00 H new ATOM 1832 N ASP A 121 -18.973 -1.671 9.772 1.00 0.00 N ATOM 1833 CA ASP A 121 -18.396 -2.075 8.489 1.00 0.00 C ATOM 1834 C ASP A 121 -17.444 -1.004 7.961 1.00 0.00 C ATOM 1835 O ASP A 121 -17.830 0.155 7.799 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.499 -2.334 7.453 1.00 0.00 C ATOM 1837 CG ASP A 121 -20.368 -3.531 7.796 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -19.810 -4.595 8.142 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -21.607 -3.405 7.711 1.00 0.00 O ATOM 0 H ASP A 121 -19.943 -1.359 9.718 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.838 -2.997 8.653 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -20.128 -1.447 7.371 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -19.042 -2.492 6.476 1.00 0.00 H new ATOM 1844 N VAL A 122 -16.203 -1.403 7.689 1.00 0.00 N ATOM 1845 CA VAL A 122 -15.195 -0.478 7.173 1.00 0.00 C ATOM 1846 C VAL A 122 -14.676 -0.937 5.813 1.00 0.00 C ATOM 1847 O VAL A 122 -14.179 -2.057 5.671 1.00 0.00 O ATOM 1848 CB VAL A 122 -14.006 -0.324 8.145 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -14.398 0.542 9.332 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -13.502 -1.684 8.610 1.00 0.00 C ATOM 0 H VAL A 122 -15.871 -2.359 7.817 1.00 0.00 H new ATOM 0 HA VAL A 122 -15.684 0.490 7.067 1.00 0.00 H new ATOM 0 HB VAL A 122 -13.193 0.170 7.613 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -13.548 0.640 10.007 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -14.697 1.529 8.979 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -15.230 0.078 9.861 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -12.664 -1.547 9.294 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -14.305 -2.214 9.122 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -13.175 -2.265 7.748 1.00 0.00 H new ATOM 1860 N THR A 123 -14.795 -0.062 4.816 1.00 0.00 N ATOM 1861 CA THR A 123 -14.339 -0.370 3.464 1.00 0.00 C ATOM 1862 C THR A 123 -12.822 -0.235 3.365 1.00 0.00 C ATOM 1863 O THR A 123 -12.291 0.874 3.264 1.00 0.00 O ATOM 1864 CB THR A 123 -15.017 0.555 2.449 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.405 0.670 2.719 1.00 0.00 O ATOM 1866 CG2 THR A 123 -14.862 0.088 1.017 1.00 0.00 C ATOM 0 H THR A 123 -15.204 0.867 4.920 1.00 0.00 H new ATOM 0 HA THR A 123 -14.612 -1.401 3.237 1.00 0.00 H new ATOM 0 HB THR A 123 -14.516 1.517 2.556 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.818 1.266 2.060 1.00 0.00 H new ATOM 0 HG21 THR A 123 -15.365 0.788 0.350 1.00 0.00 H new ATOM 0 HG22 THR A 123 -13.803 0.041 0.762 1.00 0.00 H new ATOM 0 HG23 THR A 123 -15.306 -0.901 0.907 1.00 0.00 H new ATOM 1874 N LEU A 124 -12.130 -1.372 3.404 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.673 -1.383 3.323 1.00 0.00 C ATOM 1876 C LEU A 124 -10.194 -1.789 1.933 1.00 0.00 C ATOM 1877 O LEU A 124 -10.599 -2.824 1.399 1.00 0.00 O ATOM 1878 CB LEU A 124 -10.089 -2.333 4.372 1.00 0.00 C ATOM 1879 CG LEU A 124 -8.670 -1.991 4.835 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -8.436 -2.488 6.253 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -7.639 -2.579 3.881 1.00 0.00 C ATOM 0 H LEU A 124 -12.555 -2.295 3.491 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.324 -0.369 3.520 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.747 -2.340 5.241 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.089 -3.344 3.965 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.559 -0.907 4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.422 -2.236 6.564 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -9.151 -2.015 6.927 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.567 -3.570 6.286 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -6.637 -2.325 4.227 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.749 -3.663 3.850 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.793 -2.170 2.882 1.00 0.00 H new ATOM 1893 N HIS A 125 -9.318 -0.965 1.361 1.00 0.00 N ATOM 1894 CA HIS A 125 -8.759 -1.224 0.039 1.00 0.00 C ATOM 1895 C HIS A 125 -7.269 -1.538 0.154 1.00 0.00 C ATOM 1896 O HIS A 125 -6.453 -0.641 0.373 1.00 0.00 O ATOM 1897 CB HIS A 125 -8.976 -0.013 -0.876 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.563 -0.365 -2.206 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -10.881 -0.132 -2.536 1.00 0.00 N ATOM 1900 CD2 HIS A 125 -9.002 -0.942 -3.295 1.00 0.00 C ATOM 1901 CE1 HIS A 125 -11.106 -0.552 -3.768 1.00 0.00 C ATOM 1902 NE2 HIS A 125 -9.982 -1.047 -4.251 1.00 0.00 N ATOM 0 H HIS A 125 -8.979 -0.107 1.797 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.268 -2.084 -0.396 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -9.633 0.697 -0.375 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -8.022 0.490 -1.031 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -7.975 -1.260 -3.393 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -12.049 -0.499 -4.291 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -9.861 -1.443 -5.183 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.917 -2.818 0.022 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.519 -3.232 0.130 1.00 0.00 C ATOM 1913 C GLN A 126 -4.920 -3.566 -1.233 1.00 0.00 C ATOM 1914 O GLN A 126 -5.566 -4.192 -2.076 1.00 0.00 O ATOM 1915 CB GLN A 126 -5.380 -4.429 1.076 1.00 0.00 C ATOM 1916 CG GLN A 126 -6.036 -5.705 0.568 1.00 0.00 C ATOM 1917 CD GLN A 126 -5.025 -6.782 0.214 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -4.748 -7.026 -0.961 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -4.466 -7.433 1.229 1.00 0.00 N ATOM 0 H GLN A 126 -7.573 -3.578 -0.158 1.00 0.00 H new ATOM 0 HA GLN A 126 -4.963 -2.389 0.541 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -4.321 -4.622 1.247 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -5.816 -4.168 2.040 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.716 -6.087 1.329 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -6.638 -5.474 -0.311 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -4.723 -7.200 2.188 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -3.780 -8.166 1.049 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.672 -3.144 -1.432 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.957 -3.391 -2.679 1.00 0.00 C ATOM 1930 C ALA A 127 -1.632 -4.101 -2.410 1.00 0.00 C ATOM 1931 O ALA A 127 -0.744 -3.543 -1.759 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.719 -2.084 -3.421 1.00 0.00 C ATOM 0 H ALA A 127 -3.133 -2.625 -0.738 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.571 -4.039 -3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.184 -2.285 -4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.676 -1.615 -3.648 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -2.125 -1.415 -2.798 1.00 0.00 H new ATOM 1938 N LEU A 128 -1.505 -5.329 -2.911 1.00 0.00 N ATOM 1939 CA LEU A 128 -0.287 -6.111 -2.721 1.00 0.00 C ATOM 1940 C LEU A 128 0.580 -6.087 -3.978 1.00 0.00 C ATOM 1941 O LEU A 128 0.130 -6.460 -5.064 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.634 -7.558 -2.348 1.00 0.00 C ATOM 1943 CG LEU A 128 0.128 -8.121 -1.145 1.00 0.00 C ATOM 1944 CD1 LEU A 128 1.629 -8.104 -1.403 1.00 0.00 C ATOM 1945 CD2 LEU A 128 -0.209 -7.336 0.117 1.00 0.00 C ATOM 0 H LEU A 128 -2.230 -5.802 -3.450 1.00 0.00 H new ATOM 0 HA LEU A 128 0.279 -5.661 -1.905 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.703 -7.617 -2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.441 -8.195 -3.211 1.00 0.00 H new ATOM 0 HG LEU A 128 -0.181 -9.156 -0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 128 2.152 -8.508 -0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.855 -8.712 -2.279 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.956 -7.079 -1.579 1.00 0.00 H new ATOM 0 HD21 LEU A 128 0.342 -7.751 0.961 1.00 0.00 H new ATOM 0 HD22 LEU A 128 0.069 -6.291 -0.020 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -1.279 -7.404 0.313 1.00 0.00 H new ATOM 1957 N LEU A 129 1.827 -5.648 -3.818 1.00 0.00 N ATOM 1958 CA LEU A 129 2.770 -5.571 -4.932 1.00 0.00 C ATOM 1959 C LEU A 129 4.007 -6.420 -4.645 1.00 0.00 C ATOM 1960 O LEU A 129 4.717 -6.183 -3.667 1.00 0.00 O ATOM 1961 CB LEU A 129 3.184 -4.119 -5.185 1.00 0.00 C ATOM 1962 CG LEU A 129 2.030 -3.137 -5.401 1.00 0.00 C ATOM 1963 CD1 LEU A 129 1.680 -2.423 -4.102 1.00 0.00 C ATOM 1964 CD2 LEU A 129 2.384 -2.132 -6.489 1.00 0.00 C ATOM 0 H LEU A 129 2.209 -5.339 -2.924 1.00 0.00 H new ATOM 0 HA LEU A 129 2.276 -5.957 -5.823 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.778 -3.775 -4.338 1.00 0.00 H new ATOM 0 HB3 LEU A 129 3.832 -4.091 -6.061 1.00 0.00 H new ATOM 0 HG LEU A 129 1.155 -3.701 -5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.857 -1.730 -4.278 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.382 -3.156 -3.353 1.00 0.00 H new ATOM 0 HD13 LEU A 129 2.549 -1.871 -3.744 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.553 -1.441 -6.630 1.00 0.00 H new ATOM 0 HD22 LEU A 129 3.273 -1.575 -6.194 1.00 0.00 H new ATOM 0 HD23 LEU A 129 2.580 -2.660 -7.422 1.00 0.00 H new ATOM 1976 N ARG A 130 4.260 -7.408 -5.504 1.00 0.00 N ATOM 1977 CA ARG A 130 5.413 -8.290 -5.333 1.00 0.00 C ATOM 1978 C ARG A 130 6.501 -7.983 -6.363 1.00 0.00 C ATOM 1979 O ARG A 130 6.268 -8.066 -7.571 1.00 0.00 O ATOM 1980 CB ARG A 130 4.991 -9.764 -5.439 1.00 0.00 C ATOM 1981 CG ARG A 130 4.097 -10.071 -6.633 1.00 0.00 C ATOM 1982 CD ARG A 130 4.385 -11.450 -7.209 1.00 0.00 C ATOM 1983 NE ARG A 130 3.897 -11.586 -8.582 1.00 0.00 N ATOM 1984 CZ ARG A 130 3.656 -12.758 -9.177 1.00 0.00 C ATOM 1985 NH1 ARG A 130 3.853 -13.901 -8.526 1.00 0.00 N ATOM 1986 NH2 ARG A 130 3.214 -12.785 -10.430 1.00 0.00 N ATOM 0 H ARG A 130 3.685 -7.616 -6.320 1.00 0.00 H new ATOM 0 HA ARG A 130 5.820 -8.111 -4.338 1.00 0.00 H new ATOM 0 HB2 ARG A 130 5.886 -10.383 -5.500 1.00 0.00 H new ATOM 0 HB3 ARG A 130 4.469 -10.048 -4.525 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.052 -10.014 -6.330 1.00 0.00 H new ATOM 0 HG3 ARG A 130 4.247 -9.315 -7.404 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.459 -11.635 -7.186 1.00 0.00 H new ATOM 0 HD3 ARG A 130 3.918 -12.209 -6.582 1.00 0.00 H new ATOM 0 HE ARG A 130 3.731 -10.734 -9.118 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.191 -13.888 -7.564 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.666 -14.790 -8.989 1.00 0.00 H new ATOM 0 HH21 ARG A 130 3.060 -11.912 -10.935 1.00 0.00 H new ATOM 0 HH22 ARG A 130 3.029 -13.678 -10.886 1.00 0.00 H new ATOM 2000 N LEU A 131 7.691 -7.637 -5.873 1.00 0.00 N ATOM 2001 CA LEU A 131 8.827 -7.328 -6.740 1.00 0.00 C ATOM 2002 C LEU A 131 9.941 -8.352 -6.533 1.00 0.00 C ATOM 2003 O LEU A 131 10.216 -8.756 -5.399 1.00 0.00 O ATOM 2004 CB LEU A 131 9.359 -5.918 -6.460 1.00 0.00 C ATOM 2005 CG LEU A 131 8.326 -4.791 -6.560 1.00 0.00 C ATOM 2006 CD1 LEU A 131 7.515 -4.690 -5.276 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.011 -3.467 -6.869 1.00 0.00 C ATOM 0 H LEU A 131 7.893 -7.564 -4.876 1.00 0.00 H new ATOM 0 HA LEU A 131 8.487 -7.371 -7.775 1.00 0.00 H new ATOM 0 HB2 LEU A 131 9.791 -5.904 -5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.168 -5.708 -7.159 1.00 0.00 H new ATOM 0 HG LEU A 131 7.642 -5.023 -7.376 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.787 -3.884 -5.368 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.994 -5.631 -5.100 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.182 -4.483 -4.439 1.00 0.00 H new ATOM 0 HD21 LEU A 131 8.263 -2.677 -6.937 1.00 0.00 H new ATOM 0 HD22 LEU A 131 9.719 -3.229 -6.075 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.543 -3.545 -7.817 1.00 0.00 H new ATOM 2019 N PRO A 132 10.596 -8.796 -7.623 1.00 0.00 N ATOM 2020 CA PRO A 132 11.675 -9.783 -7.551 1.00 0.00 C ATOM 2021 C PRO A 132 13.050 -9.165 -7.258 1.00 0.00 C ATOM 2022 O PRO A 132 14.060 -9.868 -7.280 1.00 0.00 O ATOM 2023 CB PRO A 132 11.651 -10.391 -8.947 1.00 0.00 C ATOM 2024 CG PRO A 132 11.248 -9.262 -9.836 1.00 0.00 C ATOM 2025 CD PRO A 132 10.334 -8.380 -9.018 1.00 0.00 C ATOM 0 HA PRO A 132 11.525 -10.493 -6.738 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.628 -10.787 -9.225 1.00 0.00 H new ATOM 0 HB3 PRO A 132 10.943 -11.218 -9.008 1.00 0.00 H new ATOM 0 HG2 PRO A 132 12.121 -8.706 -10.177 1.00 0.00 H new ATOM 0 HG3 PRO A 132 10.738 -9.631 -10.725 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.557 -7.324 -9.169 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.289 -8.527 -9.289 1.00 0.00 H new ATOM 2033 N GLN A 133 13.085 -7.856 -6.983 1.00 0.00 N ATOM 2034 CA GLN A 133 14.343 -7.165 -6.684 1.00 0.00 C ATOM 2035 C GLN A 133 15.087 -7.865 -5.543 1.00 0.00 C ATOM 2036 O GLN A 133 16.317 -7.946 -5.544 1.00 0.00 O ATOM 2037 CB GLN A 133 14.076 -5.699 -6.316 1.00 0.00 C ATOM 2038 CG GLN A 133 14.371 -4.711 -7.438 1.00 0.00 C ATOM 2039 CD GLN A 133 13.717 -5.096 -8.753 1.00 0.00 C ATOM 2040 OE1 GLN A 133 12.492 -5.101 -8.872 1.00 0.00 O ATOM 2041 NE2 GLN A 133 14.533 -5.419 -9.752 1.00 0.00 N ATOM 0 H GLN A 133 12.260 -7.257 -6.961 1.00 0.00 H new ATOM 0 HA GLN A 133 14.968 -7.196 -7.577 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.032 -5.594 -6.020 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.681 -5.438 -5.448 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.025 -3.720 -7.143 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.449 -4.643 -7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.543 -5.402 -9.611 1.00 0.00 H new ATOM 0 HE22 GLN A 133 14.149 -5.684 -10.659 1.00 0.00 H new ATOM 2050 N TYR A 134 14.323 -8.365 -4.572 1.00 0.00 N ATOM 2051 CA TYR A 134 14.882 -9.062 -3.416 1.00 0.00 C ATOM 2052 C TYR A 134 13.775 -9.779 -2.636 1.00 0.00 C ATOM 2053 O TYR A 134 13.791 -9.804 -1.404 1.00 0.00 O ATOM 2054 CB TYR A 134 15.617 -8.075 -2.497 1.00 0.00 C ATOM 2055 CG TYR A 134 14.972 -6.708 -2.450 1.00 0.00 C ATOM 2056 CD1 TYR A 134 13.774 -6.506 -1.776 1.00 0.00 C ATOM 2057 CD2 TYR A 134 15.560 -5.626 -3.084 1.00 0.00 C ATOM 2058 CE1 TYR A 134 13.180 -5.261 -1.742 1.00 0.00 C ATOM 2059 CE2 TYR A 134 14.973 -4.380 -3.054 1.00 0.00 C ATOM 2060 CZ TYR A 134 13.785 -4.199 -2.380 1.00 0.00 C ATOM 2061 OH TYR A 134 13.197 -2.957 -2.349 1.00 0.00 O ATOM 0 H TYR A 134 13.305 -8.299 -4.565 1.00 0.00 H new ATOM 0 HA TYR A 134 15.595 -9.804 -3.776 1.00 0.00 H new ATOM 0 HB2 TYR A 134 15.654 -8.487 -1.488 1.00 0.00 H new ATOM 0 HB3 TYR A 134 16.648 -7.971 -2.837 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.301 -7.335 -1.271 1.00 0.00 H new ATOM 0 HD2 TYR A 134 16.493 -5.761 -3.610 1.00 0.00 H new ATOM 0 HE1 TYR A 134 12.246 -5.119 -1.218 1.00 0.00 H new ATOM 0 HE2 TYR A 134 15.443 -3.548 -3.557 1.00 0.00 H new ATOM 0 HH TYR A 134 13.752 -2.320 -2.846 1.00 0.00 H new ATOM 2071 N GLN A 135 12.802 -10.345 -3.363 1.00 0.00 N ATOM 2072 CA GLN A 135 11.675 -11.038 -2.736 1.00 0.00 C ATOM 2073 C GLN A 135 10.970 -10.097 -1.756 1.00 0.00 C ATOM 2074 O GLN A 135 11.133 -10.216 -0.541 1.00 0.00 O ATOM 2075 CB GLN A 135 12.147 -12.307 -2.012 1.00 0.00 C ATOM 2076 CG GLN A 135 13.120 -13.167 -2.812 1.00 0.00 C ATOM 2077 CD GLN A 135 12.613 -13.508 -4.205 1.00 0.00 C ATOM 2078 OE1 GLN A 135 13.300 -13.272 -5.199 1.00 0.00 O ATOM 2079 NE2 GLN A 135 11.409 -14.065 -4.286 1.00 0.00 N ATOM 0 H GLN A 135 12.775 -10.335 -4.383 1.00 0.00 H new ATOM 0 HA GLN A 135 10.973 -11.336 -3.515 1.00 0.00 H new ATOM 0 HB2 GLN A 135 12.622 -12.019 -1.074 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.275 -12.909 -1.756 1.00 0.00 H new ATOM 0 HG2 GLN A 135 14.072 -12.643 -2.897 1.00 0.00 H new ATOM 0 HG3 GLN A 135 13.312 -14.091 -2.266 1.00 0.00 H new ATOM 0 HE21 GLN A 135 10.872 -14.244 -3.438 1.00 0.00 H new ATOM 0 HE22 GLN A 135 11.022 -14.314 -5.197 1.00 0.00 H new ATOM 2088 N THR A 136 10.211 -9.140 -2.292 1.00 0.00 N ATOM 2089 CA THR A 136 9.512 -8.161 -1.460 1.00 0.00 C ATOM 2090 C THR A 136 8.001 -8.175 -1.703 1.00 0.00 C ATOM 2091 O THR A 136 7.528 -8.619 -2.752 1.00 0.00 O ATOM 2092 CB THR A 136 10.073 -6.762 -1.740 1.00 0.00 C ATOM 2093 OG1 THR A 136 9.521 -5.797 -0.856 1.00 0.00 O ATOM 2094 CG2 THR A 136 9.818 -6.293 -3.157 1.00 0.00 C ATOM 0 H THR A 136 10.065 -9.023 -3.295 1.00 0.00 H new ATOM 0 HA THR A 136 9.676 -8.429 -0.416 1.00 0.00 H new ATOM 0 HB THR A 136 11.149 -6.851 -1.588 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.292 -6.226 -0.005 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.239 -5.297 -3.292 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.287 -6.983 -3.859 1.00 0.00 H new ATOM 0 HG23 THR A 136 8.744 -6.261 -3.342 1.00 0.00 H new ATOM 2102 N ASP A 137 7.250 -7.667 -0.722 1.00 0.00 N ATOM 2103 CA ASP A 137 5.792 -7.595 -0.814 1.00 0.00 C ATOM 2104 C ASP A 137 5.270 -6.279 -0.229 1.00 0.00 C ATOM 2105 O ASP A 137 5.188 -6.120 0.991 1.00 0.00 O ATOM 2106 CB ASP A 137 5.149 -8.776 -0.075 1.00 0.00 C ATOM 2107 CG ASP A 137 4.922 -9.985 -0.965 1.00 0.00 C ATOM 2108 OD1 ASP A 137 4.458 -9.808 -2.112 1.00 0.00 O ATOM 2109 OD2 ASP A 137 5.205 -11.112 -0.511 1.00 0.00 O ATOM 0 H ASP A 137 7.632 -7.298 0.149 1.00 0.00 H new ATOM 0 HA ASP A 137 5.522 -7.641 -1.869 1.00 0.00 H new ATOM 0 HB2 ASP A 137 5.786 -9.063 0.762 1.00 0.00 H new ATOM 0 HB3 ASP A 137 4.195 -8.458 0.345 1.00 0.00 H new ATOM 2114 N LEU A 138 4.909 -5.339 -1.107 1.00 0.00 N ATOM 2115 CA LEU A 138 4.386 -4.038 -0.679 1.00 0.00 C ATOM 2116 C LEU A 138 2.920 -4.156 -0.257 1.00 0.00 C ATOM 2117 O LEU A 138 2.106 -4.730 -0.983 1.00 0.00 O ATOM 2118 CB LEU A 138 4.520 -3.008 -1.811 1.00 0.00 C ATOM 2119 CG LEU A 138 5.433 -1.814 -1.513 1.00 0.00 C ATOM 2120 CD1 LEU A 138 4.851 -0.956 -0.399 1.00 0.00 C ATOM 2121 CD2 LEU A 138 6.833 -2.285 -1.153 1.00 0.00 C ATOM 0 H LEU A 138 4.969 -5.454 -2.119 1.00 0.00 H new ATOM 0 HA LEU A 138 4.971 -3.703 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 138 4.895 -3.517 -2.699 1.00 0.00 H new ATOM 0 HB3 LEU A 138 3.527 -2.631 -2.055 1.00 0.00 H new ATOM 0 HG LEU A 138 5.500 -1.203 -2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 138 5.515 -0.114 -0.204 1.00 0.00 H new ATOM 0 HD12 LEU A 138 3.872 -0.584 -0.700 1.00 0.00 H new ATOM 0 HD13 LEU A 138 4.749 -1.555 0.506 1.00 0.00 H new ATOM 0 HD21 LEU A 138 7.465 -1.422 -0.945 1.00 0.00 H new ATOM 0 HD22 LEU A 138 6.787 -2.922 -0.270 1.00 0.00 H new ATOM 0 HD23 LEU A 138 7.252 -2.850 -1.986 1.00 0.00 H new ATOM 2133 N LEU A 139 2.592 -3.612 0.918 1.00 0.00 N ATOM 2134 CA LEU A 139 1.224 -3.664 1.435 1.00 0.00 C ATOM 2135 C LEU A 139 0.624 -2.264 1.570 1.00 0.00 C ATOM 2136 O LEU A 139 1.245 -1.360 2.136 1.00 0.00 O ATOM 2137 CB LEU A 139 1.196 -4.377 2.792 1.00 0.00 C ATOM 2138 CG LEU A 139 -0.060 -5.213 3.062 1.00 0.00 C ATOM 2139 CD1 LEU A 139 0.222 -6.292 4.100 1.00 0.00 C ATOM 2140 CD2 LEU A 139 -1.210 -4.325 3.513 1.00 0.00 C ATOM 0 H LEU A 139 3.254 -3.132 1.527 1.00 0.00 H new ATOM 0 HA LEU A 139 0.620 -4.224 0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.068 -5.027 2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.292 -3.630 3.580 1.00 0.00 H new ATOM 0 HG LEU A 139 -0.349 -5.702 2.131 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -0.683 -6.873 4.276 1.00 0.00 H new ATOM 0 HD12 LEU A 139 1.011 -6.950 3.735 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.541 -5.826 5.032 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.092 -4.938 3.699 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -0.930 -3.804 4.429 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.433 -3.595 2.735 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.591 -2.100 1.045 1.00 0.00 N ATOM 2153 CA LEU A 140 -1.299 -0.822 1.100 1.00 0.00 C ATOM 2154 C LEU A 140 -2.543 -0.935 1.979 1.00 0.00 C ATOM 2155 O LEU A 140 -3.277 -1.921 1.898 1.00 0.00 O ATOM 2156 CB LEU A 140 -1.703 -0.385 -0.310 1.00 0.00 C ATOM 2157 CG LEU A 140 -0.923 0.801 -0.878 1.00 0.00 C ATOM 2158 CD1 LEU A 140 0.503 0.394 -1.217 1.00 0.00 C ATOM 2159 CD2 LEU A 140 -1.631 1.359 -2.105 1.00 0.00 C ATOM 0 H LEU A 140 -1.108 -2.843 0.574 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.631 -0.077 1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -1.582 -1.233 -0.984 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -2.763 -0.131 -0.304 1.00 0.00 H new ATOM 0 HG LEU A 140 -0.879 1.582 -0.119 1.00 0.00 H new ATOM 0 HD11 LEU A 140 1.040 1.253 -1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 140 1.005 0.042 -0.316 1.00 0.00 H new ATOM 0 HD13 LEU A 140 0.487 -0.404 -1.959 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -1.065 2.203 -2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -1.704 0.583 -2.867 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -2.632 1.691 -1.828 1.00 0.00 H new ATOM 2171 N THR A 141 -2.772 0.075 2.819 1.00 0.00 N ATOM 2172 CA THR A 141 -3.927 0.084 3.714 1.00 0.00 C ATOM 2173 C THR A 141 -4.751 1.361 3.540 1.00 0.00 C ATOM 2174 O THR A 141 -4.313 2.452 3.915 1.00 0.00 O ATOM 2175 CB THR A 141 -3.477 -0.056 5.175 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.199 -0.671 5.261 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.431 -0.871 6.022 1.00 0.00 C ATOM 0 H THR A 141 -2.173 0.897 2.897 1.00 0.00 H new ATOM 0 HA THR A 141 -4.556 -0.767 3.454 1.00 0.00 H new ATOM 0 HB THR A 141 -3.449 0.964 5.559 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.935 -0.747 6.202 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.052 -0.930 7.042 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.412 -0.395 6.026 1.00 0.00 H new ATOM 0 HG23 THR A 141 -4.517 -1.876 5.608 1.00 0.00 H new ATOM 2185 N PHE A 142 -5.948 1.211 2.973 1.00 0.00 N ATOM 2186 CA PHE A 142 -6.851 2.341 2.744 1.00 0.00 C ATOM 2187 C PHE A 142 -8.028 2.293 3.719 1.00 0.00 C ATOM 2188 O PHE A 142 -8.652 1.246 3.896 1.00 0.00 O ATOM 2189 CB PHE A 142 -7.368 2.317 1.303 1.00 0.00 C ATOM 2190 CG PHE A 142 -7.091 3.577 0.530 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -5.862 3.775 -0.080 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -8.064 4.556 0.404 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -5.609 4.929 -0.803 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -7.817 5.711 -0.314 1.00 0.00 C ATOM 2195 CZ PHE A 142 -6.588 5.897 -0.919 1.00 0.00 C ATOM 0 H PHE A 142 -6.317 0.313 2.662 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.297 3.265 2.910 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.914 1.475 0.780 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -8.444 2.141 1.317 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -5.094 3.021 0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -9.027 4.415 0.872 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -4.648 5.072 -1.275 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -8.583 6.467 -0.402 1.00 0.00 H new ATOM 0 HZ PHE A 142 -6.393 6.798 -1.482 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.325 3.429 4.352 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.427 3.507 5.311 1.00 0.00 C ATOM 2207 C ASN A 143 -10.539 4.424 4.809 1.00 0.00 C ATOM 2208 O ASN A 143 -10.307 5.605 4.540 1.00 0.00 O ATOM 2209 CB ASN A 143 -8.918 4.008 6.666 1.00 0.00 C ATOM 2210 CG ASN A 143 -8.010 3.005 7.353 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -8.475 2.014 7.915 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -6.707 3.260 7.315 1.00 0.00 N ATOM 0 H ASN A 143 -7.819 4.305 4.218 1.00 0.00 H new ATOM 0 HA ASN A 143 -9.837 2.503 5.426 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.378 4.944 6.524 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -9.769 4.225 7.312 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -6.049 2.622 7.763 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -6.364 4.094 6.838 1.00 0.00 H new ATOM 2219 N GLN A 144 -11.746 3.874 4.688 1.00 0.00 N ATOM 2220 CA GLN A 144 -12.901 4.642 4.222 1.00 0.00 C ATOM 2221 C GLN A 144 -14.148 4.295 5.035 1.00 0.00 C ATOM 2222 O GLN A 144 -14.743 3.231 4.846 1.00 0.00 O ATOM 2223 CB GLN A 144 -13.159 4.371 2.734 1.00 0.00 C ATOM 2224 CG GLN A 144 -11.927 4.532 1.856 1.00 0.00 C ATOM 2225 CD GLN A 144 -12.230 5.244 0.551 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -11.992 6.444 0.418 1.00 0.00 O ATOM 2227 NE2 GLN A 144 -12.758 4.508 -0.422 1.00 0.00 N ATOM 0 H GLN A 144 -11.950 2.899 4.906 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.679 5.700 4.358 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -13.544 3.358 2.621 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -13.936 5.049 2.381 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -11.167 5.090 2.402 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -11.508 3.549 1.641 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -12.939 3.516 -0.270 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -12.982 4.935 -1.321 1.00 0.00 H new ATOM 2236 N PRO A 145 -14.557 5.188 5.959 1.00 0.00 N ATOM 2237 CA PRO A 145 -15.734 4.971 6.808 1.00 0.00 C ATOM 2238 C PRO A 145 -17.048 5.298 6.089 1.00 0.00 C ATOM 2239 O PRO A 145 -17.337 6.462 5.809 1.00 0.00 O ATOM 2240 CB PRO A 145 -15.500 5.937 7.967 1.00 0.00 C ATOM 2241 CG PRO A 145 -14.727 7.064 7.368 1.00 0.00 C ATOM 2242 CD PRO A 145 -13.896 6.477 6.255 1.00 0.00 C ATOM 0 HA PRO A 145 -15.837 3.929 7.110 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -16.443 6.284 8.390 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -14.944 5.460 8.774 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -15.398 7.833 6.986 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -14.092 7.538 8.116 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -13.881 7.128 5.381 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -12.860 6.333 6.563 1.00 0.00 H new ATOM 2473 N PRO A 162 -15.566 13.088 -2.738 1.00 0.00 N ATOM 2474 CA PRO A 162 -15.386 11.725 -2.226 1.00 0.00 C ATOM 2475 C PRO A 162 -14.428 10.909 -3.094 1.00 0.00 C ATOM 2476 O PRO A 162 -14.795 10.452 -4.178 1.00 0.00 O ATOM 2477 CB PRO A 162 -16.803 11.134 -2.268 1.00 0.00 C ATOM 2478 CG PRO A 162 -17.520 11.935 -3.300 1.00 0.00 C ATOM 2479 CD PRO A 162 -16.936 13.317 -3.233 1.00 0.00 C ATOM 0 HA PRO A 162 -14.944 11.714 -1.230 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -16.783 10.077 -2.532 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -17.293 11.211 -1.297 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -17.386 11.503 -4.292 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -18.592 11.955 -3.103 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -16.934 13.800 -4.210 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -17.503 13.960 -2.561 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.195 10.741 -2.613 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.178 9.989 -3.348 1.00 0.00 C ATOM 2489 C TRP A 163 -12.610 8.538 -3.551 1.00 0.00 C ATOM 2490 O TRP A 163 -13.009 7.862 -2.602 1.00 0.00 O ATOM 2491 CB TRP A 163 -10.838 10.028 -2.605 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.161 11.364 -2.662 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -10.055 12.186 -3.746 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.494 12.030 -1.585 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -9.364 13.324 -3.407 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -9.007 13.251 -2.086 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.259 11.712 -0.244 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -8.301 14.154 -1.294 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.559 12.606 0.541 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -8.087 13.816 0.015 1.00 0.00 C ATOM 0 H TRP A 163 -12.877 11.115 -1.719 1.00 0.00 H new ATOM 0 HA TRP A 163 -12.059 10.458 -4.325 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.002 9.757 -1.562 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -10.174 9.275 -3.030 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -10.455 11.973 -4.726 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -9.151 14.098 -4.037 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -9.619 10.782 0.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -7.936 15.087 -1.698 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -8.372 12.369 1.578 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.544 14.495 0.655 1.00 0.00 H new ATOM 2511 N SER A 164 -12.528 8.068 -4.797 1.00 0.00 N ATOM 2512 CA SER A 164 -12.908 6.696 -5.136 1.00 0.00 C ATOM 2513 C SER A 164 -11.678 5.878 -5.549 1.00 0.00 C ATOM 2514 O SER A 164 -10.553 6.207 -5.166 1.00 0.00 O ATOM 2515 CB SER A 164 -13.950 6.703 -6.260 1.00 0.00 C ATOM 2516 OG SER A 164 -14.879 7.760 -6.093 1.00 0.00 O ATOM 0 H SER A 164 -12.201 8.620 -5.590 1.00 0.00 H new ATOM 0 HA SER A 164 -13.345 6.228 -4.254 1.00 0.00 H new ATOM 0 HB2 SER A 164 -13.449 6.805 -7.223 1.00 0.00 H new ATOM 0 HB3 SER A 164 -14.479 5.750 -6.275 1.00 0.00 H new ATOM 0 HG SER A 164 -15.531 7.741 -6.825 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.893 4.811 -6.331 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.798 3.951 -6.792 1.00 0.00 C ATOM 2524 C LEU A 165 -9.695 4.761 -7.479 1.00 0.00 C ATOM 2525 O LEU A 165 -8.519 4.400 -7.408 1.00 0.00 O ATOM 2526 CB LEU A 165 -11.323 2.882 -7.756 1.00 0.00 C ATOM 2527 CG LEU A 165 -10.619 1.527 -7.665 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -11.617 0.392 -7.845 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -9.505 1.433 -8.699 1.00 0.00 C ATOM 0 H LEU A 165 -12.816 4.524 -6.657 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.373 3.469 -5.912 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -12.387 2.735 -7.568 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -11.229 3.256 -8.776 1.00 0.00 H new ATOM 0 HG LEU A 165 -10.174 1.436 -6.674 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.097 -0.564 -7.777 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -12.376 0.448 -7.065 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -12.093 0.478 -8.822 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -9.016 0.462 -8.619 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -9.926 1.546 -9.698 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.775 2.223 -8.521 1.00 0.00 H new ATOM 2541 N GLY A 166 -10.084 5.857 -8.135 1.00 0.00 N ATOM 2542 CA GLY A 166 -9.119 6.706 -8.817 1.00 0.00 C ATOM 2543 C GLY A 166 -7.979 7.135 -7.911 1.00 0.00 C ATOM 2544 O GLY A 166 -6.811 7.039 -8.289 1.00 0.00 O ATOM 0 H GLY A 166 -11.052 6.171 -8.205 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.714 6.172 -9.677 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.626 7.591 -9.201 1.00 0.00 H new ATOM 2548 N ASP A 167 -8.320 7.596 -6.708 1.00 0.00 N ATOM 2549 CA ASP A 167 -7.316 8.028 -5.737 1.00 0.00 C ATOM 2550 C ASP A 167 -6.458 6.848 -5.286 1.00 0.00 C ATOM 2551 O ASP A 167 -5.245 6.983 -5.118 1.00 0.00 O ATOM 2552 CB ASP A 167 -7.985 8.692 -4.525 1.00 0.00 C ATOM 2553 CG ASP A 167 -7.091 9.730 -3.868 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -6.769 10.739 -4.531 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -6.717 9.534 -2.694 1.00 0.00 O ATOM 0 H ASP A 167 -9.283 7.680 -6.383 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.670 8.760 -6.221 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -8.915 9.165 -4.840 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -8.248 7.927 -3.794 1.00 0.00 H new ATOM 2560 N PHE A 168 -7.094 5.690 -5.110 1.00 0.00 N ATOM 2561 CA PHE A 168 -6.390 4.477 -4.700 1.00 0.00 C ATOM 2562 C PHE A 168 -5.328 4.099 -5.734 1.00 0.00 C ATOM 2563 O PHE A 168 -4.203 3.740 -5.378 1.00 0.00 O ATOM 2564 CB PHE A 168 -7.378 3.320 -4.518 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.727 2.033 -4.087 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -6.374 1.832 -2.764 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -6.469 1.030 -5.007 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -5.773 0.653 -2.364 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.866 -0.150 -4.614 1.00 0.00 C ATOM 2570 CZ PHE A 168 -5.520 -0.338 -3.291 1.00 0.00 C ATOM 0 H PHE A 168 -8.097 5.567 -5.245 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.898 4.673 -3.747 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -8.126 3.605 -3.778 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.906 3.153 -5.457 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -6.570 2.605 -2.036 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -6.742 1.172 -6.042 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -5.502 0.508 -1.329 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.666 -0.923 -5.341 1.00 0.00 H new ATOM 0 HZ PHE A 168 -5.051 -1.260 -2.981 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.690 4.189 -7.016 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.765 3.864 -8.101 1.00 0.00 C ATOM 2582 C GLU A 169 -3.499 4.715 -8.007 1.00 0.00 C ATOM 2583 O GLU A 169 -2.402 4.240 -8.304 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.435 4.071 -9.463 1.00 0.00 C ATOM 2585 CG GLU A 169 -6.296 2.897 -9.904 1.00 0.00 C ATOM 2586 CD GLU A 169 -7.358 3.295 -10.913 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -8.365 3.911 -10.505 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -7.182 2.989 -12.112 1.00 0.00 O ATOM 0 H GLU A 169 -6.616 4.484 -7.326 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.488 2.814 -8.003 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.053 4.968 -9.422 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -4.665 4.248 -10.214 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -5.658 2.127 -10.339 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -6.777 2.457 -9.031 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.656 5.971 -7.582 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.519 6.877 -7.440 1.00 0.00 C ATOM 2597 C GLN A 170 -1.532 6.361 -6.390 1.00 0.00 C ATOM 2598 O GLN A 170 -0.324 6.576 -6.508 1.00 0.00 O ATOM 2599 CB GLN A 170 -2.995 8.286 -7.076 1.00 0.00 C ATOM 2600 CG GLN A 170 -3.086 9.223 -8.272 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.863 10.111 -8.423 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -1.980 11.330 -8.541 1.00 0.00 O ATOM 2603 NE2 GLN A 170 -0.682 9.503 -8.423 1.00 0.00 N ATOM 0 H GLN A 170 -4.556 6.380 -7.332 1.00 0.00 H new ATOM 0 HA GLN A 170 -2.003 6.920 -8.399 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -3.974 8.219 -6.601 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -2.313 8.713 -6.341 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -3.215 8.633 -9.180 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -3.973 9.849 -8.170 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -0.630 8.489 -8.322 1.00 0.00 H new ATOM 0 HE22 GLN A 170 0.173 10.050 -8.523 1.00 0.00 H new ATOM 2612 N LEU A 171 -2.045 5.668 -5.370 1.00 0.00 N ATOM 2613 CA LEU A 171 -1.192 5.113 -4.320 1.00 0.00 C ATOM 2614 C LEU A 171 -0.274 4.034 -4.894 1.00 0.00 C ATOM 2615 O LEU A 171 0.846 3.851 -4.422 1.00 0.00 O ATOM 2616 CB LEU A 171 -2.034 4.538 -3.173 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.509 4.831 -1.759 1.00 0.00 C ATOM 2618 CD1 LEU A 171 -0.199 4.098 -1.498 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -1.328 6.328 -1.549 1.00 0.00 C ATOM 0 H LEU A 171 -3.040 5.480 -5.250 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.579 5.921 -3.921 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.047 4.933 -3.255 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -2.101 3.458 -3.301 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.251 4.468 -1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.150 4.324 -0.490 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.357 3.024 -1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.549 4.421 -2.222 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -0.956 6.512 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.613 6.714 -2.276 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -2.286 6.832 -1.679 1.00 0.00 H new ATOM 2631 N VAL A 172 -0.746 3.331 -5.927 1.00 0.00 N ATOM 2632 CA VAL A 172 0.057 2.291 -6.566 1.00 0.00 C ATOM 2633 C VAL A 172 1.275 2.911 -7.249 1.00 0.00 C ATOM 2634 O VAL A 172 2.373 2.356 -7.201 1.00 0.00 O ATOM 2635 CB VAL A 172 -0.756 1.482 -7.602 1.00 0.00 C ATOM 2636 CG1 VAL A 172 0.062 0.312 -8.129 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.070 0.999 -7.000 1.00 0.00 C ATOM 0 H VAL A 172 -1.672 3.463 -6.334 1.00 0.00 H new ATOM 0 HA VAL A 172 0.378 1.606 -5.782 1.00 0.00 H new ATOM 0 HB VAL A 172 -0.991 2.138 -8.440 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -0.527 -0.245 -8.857 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.968 0.687 -8.606 1.00 0.00 H new ATOM 0 HG13 VAL A 172 0.332 -0.345 -7.302 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.626 0.432 -7.747 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -1.864 0.362 -6.140 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -2.662 1.857 -6.682 1.00 0.00 H new ATOM 2647 N THR A 173 1.079 4.082 -7.861 1.00 0.00 N ATOM 2648 CA THR A 173 2.172 4.791 -8.525 1.00 0.00 C ATOM 2649 C THR A 173 3.055 5.517 -7.506 1.00 0.00 C ATOM 2650 O THR A 173 4.076 6.104 -7.869 1.00 0.00 O ATOM 2651 CB THR A 173 1.636 5.802 -9.539 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.441 6.405 -9.078 1.00 0.00 O ATOM 2653 CG2 THR A 173 1.350 5.197 -10.893 1.00 0.00 C ATOM 0 H THR A 173 0.177 4.556 -7.910 1.00 0.00 H new ATOM 0 HA THR A 173 2.770 4.045 -9.048 1.00 0.00 H new ATOM 0 HB THR A 173 2.430 6.541 -9.646 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.481 6.508 -8.104 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.973 5.969 -11.564 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.267 4.775 -11.304 1.00 0.00 H new ATOM 0 HG23 THR A 173 0.603 4.410 -10.789 1.00 0.00 H new ATOM 2661 N SER A 174 2.660 5.476 -6.229 1.00 0.00 N ATOM 2662 CA SER A 174 3.418 6.131 -5.165 1.00 0.00 C ATOM 2663 C SER A 174 4.746 5.412 -4.852 1.00 0.00 C ATOM 2664 O SER A 174 5.391 5.707 -3.846 1.00 0.00 O ATOM 2665 CB SER A 174 2.562 6.235 -3.899 1.00 0.00 C ATOM 2666 OG SER A 174 1.453 7.097 -4.104 1.00 0.00 O ATOM 0 H SER A 174 1.819 4.995 -5.910 1.00 0.00 H new ATOM 0 HA SER A 174 3.673 7.129 -5.520 1.00 0.00 H new ATOM 0 HB2 SER A 174 2.209 5.244 -3.612 1.00 0.00 H new ATOM 0 HB3 SER A 174 3.170 6.608 -3.075 1.00 0.00 H new ATOM 0 HG SER A 174 1.556 7.899 -3.551 1.00 0.00 H new ATOM 2672 N LEU A 175 5.164 4.480 -5.714 1.00 0.00 N ATOM 2673 CA LEU A 175 6.421 3.763 -5.516 1.00 0.00 C ATOM 2674 C LEU A 175 7.315 3.901 -6.755 1.00 0.00 C ATOM 2675 O LEU A 175 8.058 2.981 -7.110 1.00 0.00 O ATOM 2676 CB LEU A 175 6.144 2.284 -5.211 1.00 0.00 C ATOM 2677 CG LEU A 175 7.326 1.495 -4.638 1.00 0.00 C ATOM 2678 CD1 LEU A 175 7.616 1.914 -3.204 1.00 0.00 C ATOM 2679 CD2 LEU A 175 7.046 -0.001 -4.714 1.00 0.00 C ATOM 0 H LEU A 175 4.650 4.207 -6.552 1.00 0.00 H new ATOM 0 HA LEU A 175 6.944 4.200 -4.666 1.00 0.00 H new ATOM 0 HB2 LEU A 175 5.315 2.226 -4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 175 5.816 1.797 -6.129 1.00 0.00 H new ATOM 0 HG LEU A 175 8.209 1.716 -5.237 1.00 0.00 H new ATOM 0 HD11 LEU A 175 8.459 1.339 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 175 7.859 2.976 -3.177 1.00 0.00 H new ATOM 0 HD13 LEU A 175 6.738 1.727 -2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 175 7.893 -0.551 -4.304 1.00 0.00 H new ATOM 0 HD22 LEU A 175 6.150 -0.233 -4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 175 6.895 -0.290 -5.754 1.00 0.00 H new ATOM 2691 N THR A 176 7.231 5.063 -7.415 1.00 0.00 N ATOM 2692 CA THR A 176 8.017 5.338 -8.620 1.00 0.00 C ATOM 2693 C THR A 176 9.519 5.259 -8.341 1.00 0.00 C ATOM 2694 O THR A 176 10.076 6.106 -7.638 1.00 0.00 O ATOM 2695 CB THR A 176 7.657 6.717 -9.184 1.00 0.00 C ATOM 2696 OG1 THR A 176 7.700 7.704 -8.169 1.00 0.00 O ATOM 2697 CG2 THR A 176 6.280 6.766 -9.809 1.00 0.00 C ATOM 0 H THR A 176 6.622 5.831 -7.131 1.00 0.00 H new ATOM 0 HA THR A 176 7.773 4.573 -9.358 1.00 0.00 H new ATOM 0 HB THR A 176 8.400 6.913 -9.957 1.00 0.00 H new ATOM 0 HG1 THR A 176 8.246 8.460 -8.471 1.00 0.00 H new ATOM 0 HG21 THR A 176 6.088 7.770 -10.188 1.00 0.00 H new ATOM 0 HG22 THR A 176 6.228 6.051 -10.630 1.00 0.00 H new ATOM 0 HG23 THR A 176 5.531 6.512 -9.059 1.00 0.00 H new ATOM 2705 N LEU A 177 10.168 4.234 -8.900 1.00 0.00 N ATOM 2706 CA LEU A 177 11.602 4.033 -8.719 1.00 0.00 C ATOM 2707 C LEU A 177 12.402 4.766 -9.796 1.00 0.00 C ATOM 2708 O LEU A 177 12.691 4.210 -10.858 1.00 0.00 O ATOM 2709 CB LEU A 177 11.930 2.535 -8.743 1.00 0.00 C ATOM 2710 CG LEU A 177 13.422 2.180 -8.760 1.00 0.00 C ATOM 2711 CD1 LEU A 177 14.178 2.964 -7.695 1.00 0.00 C ATOM 2712 CD2 LEU A 177 13.609 0.683 -8.561 1.00 0.00 C ATOM 0 H LEU A 177 9.717 3.529 -9.484 1.00 0.00 H new ATOM 0 HA LEU A 177 11.884 4.446 -7.750 1.00 0.00 H new ATOM 0 HB2 LEU A 177 11.474 2.068 -7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.460 2.093 -9.622 1.00 0.00 H new ATOM 0 HG LEU A 177 13.831 2.455 -9.732 1.00 0.00 H new ATOM 0 HD11 LEU A 177 15.234 2.695 -7.726 1.00 0.00 H new ATOM 0 HD12 LEU A 177 14.070 4.032 -7.884 1.00 0.00 H new ATOM 0 HD13 LEU A 177 13.772 2.726 -6.712 1.00 0.00 H new ATOM 0 HD21 LEU A 177 14.672 0.444 -8.575 1.00 0.00 H new ATOM 0 HD22 LEU A 177 13.183 0.387 -7.602 1.00 0.00 H new ATOM 0 HD23 LEU A 177 13.105 0.144 -9.363 1.00 0.00 H new ATOM 2724 N HIS A 178 12.764 6.016 -9.513 1.00 0.00 N ATOM 2725 CA HIS A 178 13.538 6.823 -10.453 1.00 0.00 C ATOM 2726 C HIS A 178 15.036 6.642 -10.205 1.00 0.00 C ATOM 2727 O HIS A 178 15.809 6.441 -11.143 1.00 0.00 O ATOM 2728 CB HIS A 178 13.166 8.303 -10.332 1.00 0.00 C ATOM 2729 CG HIS A 178 11.722 8.590 -10.614 1.00 0.00 C ATOM 2730 ND1 HIS A 178 11.250 8.914 -11.867 1.00 0.00 N ATOM 2731 CD2 HIS A 178 10.647 8.606 -9.793 1.00 0.00 C ATOM 2732 CE1 HIS A 178 9.946 9.120 -11.805 1.00 0.00 C ATOM 2733 NE2 HIS A 178 9.553 8.940 -10.555 1.00 0.00 N ATOM 0 H HIS A 178 12.534 6.491 -8.640 1.00 0.00 H new ATOM 0 HA HIS A 178 13.302 6.485 -11.462 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.405 8.647 -9.326 1.00 0.00 H new ATOM 0 HB3 HIS A 178 13.783 8.880 -11.021 1.00 0.00 H new ATOM 0 HD1 HIS A 178 11.818 8.984 -12.711 1.00 0.00 H new ATOM 0 HD2 HIS A 178 10.648 8.395 -8.734 1.00 0.00 H new ATOM 0 HE1 HIS A 178 9.309 9.390 -12.635 1.00 0.00 H new ATOM 2742 N ASP A 179 15.431 6.714 -8.935 1.00 0.00 N ATOM 2743 CA ASP A 179 16.829 6.556 -8.549 1.00 0.00 C ATOM 2744 C ASP A 179 16.981 5.378 -7.585 1.00 0.00 C ATOM 2745 O ASP A 179 16.525 5.444 -6.442 1.00 0.00 O ATOM 2746 CB ASP A 179 17.350 7.842 -7.895 1.00 0.00 C ATOM 2747 CG ASP A 179 17.113 9.072 -8.754 1.00 0.00 C ATOM 2748 OD1 ASP A 179 15.999 9.635 -8.689 1.00 0.00 O ATOM 2749 OD2 ASP A 179 18.039 9.468 -9.492 1.00 0.00 O ATOM 0 H ASP A 179 14.798 6.882 -8.153 1.00 0.00 H new ATOM 0 HA ASP A 179 17.417 6.356 -9.445 1.00 0.00 H new ATOM 0 HB2 ASP A 179 16.862 7.978 -6.930 1.00 0.00 H new ATOM 0 HB3 ASP A 179 18.418 7.739 -7.701 1.00 0.00 H new ATOM 2754 N PRO A 180 17.619 4.276 -8.036 1.00 0.00 N ATOM 2755 CA PRO A 180 17.820 3.078 -7.205 1.00 0.00 C ATOM 2756 C PRO A 180 18.879 3.289 -6.119 1.00 0.00 C ATOM 2757 O PRO A 180 19.935 2.651 -6.132 1.00 0.00 O ATOM 2758 CB PRO A 180 18.284 2.025 -8.218 1.00 0.00 C ATOM 2759 CG PRO A 180 18.949 2.811 -9.291 1.00 0.00 C ATOM 2760 CD PRO A 180 18.190 4.107 -9.390 1.00 0.00 C ATOM 0 HA PRO A 180 16.917 2.799 -6.662 1.00 0.00 H new ATOM 0 HB2 PRO A 180 18.972 1.312 -7.763 1.00 0.00 H new ATOM 0 HB3 PRO A 180 17.443 1.452 -8.608 1.00 0.00 H new ATOM 0 HG2 PRO A 180 19.997 2.990 -9.050 1.00 0.00 H new ATOM 0 HG3 PRO A 180 18.927 2.273 -10.239 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.845 4.937 -9.656 1.00 0.00 H new ATOM 0 HD3 PRO A 180 17.411 4.059 -10.151 1.00 0.00 H new