USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 606 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 Single : A 113 ASN : amide:sc= -0.056 K(o=-0.056,f=-1.3) USER MOD Single : A 114 LYS NZ :NH3+ -149:sc= 1.28 (180deg=0.433) USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.9!) USER MOD Single : A 124 CYS SG : rot 180:sc= -0.32 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 180:sc= 0.128 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 153:sc= 0.851 (180deg=0.523) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl -112:sc= -5.91! (180deg=-7.38!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 GLN : amide:sc= -0.142 K(o=-0.14,f=-2.2!) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 SER OG : rot 90:sc= 0.332 USER MOD Single : A 169 GLN : amide:sc= -1.65 K(o=-1.6,f=-5.9!) USER MOD Single : A 172 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 MET CE :methyl 175:sc= 0 (180deg=-0.049) USER MOD Single : A 174 HIS : no HE2:sc= -4.39! C(o=-4.4!,f=-7.7!) USER MOD Single : A 176 HIS :FLIP no HD1:sc= -3.18! C(o=-5!,f=-3.2!) USER MOD Single : A 179 MET CE :methyl 135:sc= -0.191 (180deg=-1.79!) USER MOD Single : A 181 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00419) USER MOD Single : A 182 LYS NZ :NH3+ -153:sc= -1.39 (180deg=-2.58!) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 110 N ASN A 113 -5.257 -7.264 10.322 1.00 0.00 N ATOM 111 CA ASN A 113 -4.664 -8.410 9.642 1.00 0.00 C ATOM 112 C ASN A 113 -5.740 -9.275 8.994 1.00 0.00 C ATOM 113 O ASN A 113 -5.663 -10.503 9.016 1.00 0.00 O ATOM 114 CB ASN A 113 -3.847 -9.247 10.628 1.00 0.00 C ATOM 115 CG ASN A 113 -3.006 -8.390 11.556 1.00 0.00 C ATOM 116 OD1 ASN A 113 -2.439 -7.379 11.141 1.00 0.00 O ATOM 117 ND2 ASN A 113 -2.922 -8.793 12.818 1.00 0.00 N ATOM 0 HA ASN A 113 -4.004 -8.035 8.859 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -4.521 -9.866 11.220 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.197 -9.924 10.074 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -2.370 -8.258 13.489 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -3.409 -9.638 13.117 1.00 0.00 H new ATOM 124 N LYS A 114 -6.745 -8.625 8.416 1.00 0.00 N ATOM 125 CA LYS A 114 -7.837 -9.333 7.758 1.00 0.00 C ATOM 126 C LYS A 114 -7.555 -9.507 6.270 1.00 0.00 C ATOM 127 O LYS A 114 -7.023 -8.606 5.620 1.00 0.00 O ATOM 128 CB LYS A 114 -9.153 -8.576 7.954 1.00 0.00 C ATOM 129 CG LYS A 114 -10.319 -9.176 7.187 1.00 0.00 C ATOM 130 CD LYS A 114 -11.653 -8.728 7.761 1.00 0.00 C ATOM 131 CE LYS A 114 -12.128 -7.432 7.122 1.00 0.00 C ATOM 132 NZ LYS A 114 -12.837 -7.676 5.835 1.00 0.00 N ATOM 0 H LYS A 114 -6.826 -7.609 8.390 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.922 -10.321 8.211 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -9.398 -8.559 9.016 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.017 -7.541 7.641 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -10.256 -8.883 6.139 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -10.255 -10.264 7.218 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.398 -9.507 7.603 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -11.559 -8.591 8.838 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -12.793 -6.910 7.810 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -11.273 -6.778 6.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -12.687 -6.868 5.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -12.465 -8.541 5.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -13.855 -7.790 6.016 1.00 0.00 H new ATOM 146 N ILE A 115 -7.915 -10.669 5.736 1.00 0.00 N ATOM 147 CA ILE A 115 -7.703 -10.959 4.323 1.00 0.00 C ATOM 148 C ILE A 115 -9.008 -11.355 3.641 1.00 0.00 C ATOM 149 O ILE A 115 -9.910 -11.904 4.273 1.00 0.00 O ATOM 150 CB ILE A 115 -6.672 -12.087 4.129 1.00 0.00 C ATOM 151 CG1 ILE A 115 -7.244 -13.420 4.618 1.00 0.00 C ATOM 152 CG2 ILE A 115 -5.381 -11.758 4.863 1.00 0.00 C ATOM 153 CD1 ILE A 115 -6.431 -14.621 4.187 1.00 0.00 C ATOM 0 H ILE A 115 -8.355 -11.425 6.260 1.00 0.00 H new ATOM 0 HA ILE A 115 -7.321 -10.046 3.867 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.449 -12.176 3.066 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -7.303 -13.403 5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -8.262 -13.528 4.245 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.663 -12.565 4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -4.967 -10.828 4.472 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -5.586 -11.645 5.927 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -6.895 -15.530 4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.393 -14.663 3.098 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.419 -14.536 4.583 1.00 0.00 H new ATOM 165 N PHE A 116 -9.101 -11.073 2.346 1.00 0.00 N ATOM 166 CA PHE A 116 -10.295 -11.400 1.576 1.00 0.00 C ATOM 167 C PHE A 116 -10.105 -12.702 0.803 1.00 0.00 C ATOM 168 O PHE A 116 -9.356 -12.753 -0.173 1.00 0.00 O ATOM 169 CB PHE A 116 -10.631 -10.263 0.608 1.00 0.00 C ATOM 170 CG PHE A 116 -11.531 -10.682 -0.519 1.00 0.00 C ATOM 171 CD1 PHE A 116 -12.908 -10.635 -0.378 1.00 0.00 C ATOM 172 CD2 PHE A 116 -10.999 -11.122 -1.721 1.00 0.00 C ATOM 173 CE1 PHE A 116 -13.738 -11.021 -1.414 1.00 0.00 C ATOM 174 CE2 PHE A 116 -11.824 -11.509 -2.760 1.00 0.00 C ATOM 175 CZ PHE A 116 -13.195 -11.457 -2.607 1.00 0.00 C ATOM 0 H PHE A 116 -8.363 -10.619 1.808 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.122 -11.530 2.274 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.108 -9.454 1.162 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -9.705 -9.864 0.194 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -13.338 -10.293 0.552 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.927 -11.163 -1.847 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -14.810 -10.982 -1.291 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -11.397 -11.852 -3.691 1.00 0.00 H new ATOM 0 HZ PHE A 116 -13.842 -11.757 -3.418 1.00 0.00 H new ATOM 185 N VAL A 117 -10.788 -13.752 1.247 1.00 0.00 N ATOM 186 CA VAL A 117 -10.696 -15.054 0.597 1.00 0.00 C ATOM 187 C VAL A 117 -11.904 -15.309 -0.297 1.00 0.00 C ATOM 188 O VAL A 117 -13.044 -15.295 0.164 1.00 0.00 O ATOM 189 CB VAL A 117 -10.587 -16.190 1.632 1.00 0.00 C ATOM 190 CG1 VAL A 117 -10.593 -17.545 0.939 1.00 0.00 C ATOM 191 CG2 VAL A 117 -9.334 -16.021 2.478 1.00 0.00 C ATOM 0 H VAL A 117 -11.411 -13.727 2.054 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.793 -15.041 -0.014 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.453 -16.142 2.292 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.515 -18.336 1.685 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.521 -17.664 0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.747 -17.607 0.255 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.273 -16.832 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.455 -16.043 1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.375 -15.067 3.003 1.00 0.00 H new ATOM 201 N GLY A 118 -11.645 -15.544 -1.580 1.00 0.00 N ATOM 202 CA GLY A 118 -12.721 -15.800 -2.519 1.00 0.00 C ATOM 203 C GLY A 118 -12.495 -17.061 -3.330 1.00 0.00 C ATOM 204 O GLY A 118 -11.453 -17.703 -3.214 1.00 0.00 O ATOM 0 H GLY A 118 -10.709 -15.562 -1.985 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -13.661 -15.885 -1.975 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.820 -14.950 -3.194 1.00 0.00 H new ATOM 208 N GLY A 119 -13.477 -17.417 -4.153 1.00 0.00 N ATOM 209 CA GLY A 119 -13.362 -18.609 -4.972 1.00 0.00 C ATOM 210 C GLY A 119 -13.348 -19.881 -4.147 1.00 0.00 C ATOM 211 O GLY A 119 -13.012 -20.953 -4.653 1.00 0.00 O ATOM 0 H GLY A 119 -14.350 -16.901 -4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -14.194 -18.645 -5.675 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -12.448 -18.553 -5.563 1.00 0.00 H new ATOM 215 N ILE A 120 -13.711 -19.763 -2.875 1.00 0.00 N ATOM 216 CA ILE A 120 -13.738 -20.912 -1.979 1.00 0.00 C ATOM 217 C ILE A 120 -14.733 -21.962 -2.461 1.00 0.00 C ATOM 218 O ILE A 120 -15.848 -21.650 -2.881 1.00 0.00 O ATOM 219 CB ILE A 120 -14.103 -20.497 -0.541 1.00 0.00 C ATOM 220 CG1 ILE A 120 -13.176 -19.380 -0.059 1.00 0.00 C ATOM 221 CG2 ILE A 120 -14.027 -21.696 0.392 1.00 0.00 C ATOM 222 CD1 ILE A 120 -13.727 -18.601 1.115 1.00 0.00 C ATOM 0 H ILE A 120 -13.991 -18.883 -2.441 1.00 0.00 H new ATOM 0 HA ILE A 120 -12.734 -21.337 -1.982 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.126 -20.122 -0.535 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -12.215 -19.812 0.221 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -12.988 -18.693 -0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -14.288 -21.387 1.404 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -14.725 -22.463 0.056 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.014 -22.099 0.385 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -13.017 -17.826 1.403 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.674 -18.140 0.833 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.888 -19.276 1.956 1.00 0.00 H new ATOM 234 N PRO A 121 -14.324 -23.238 -2.399 1.00 0.00 N ATOM 235 CA PRO A 121 -15.166 -24.361 -2.823 1.00 0.00 C ATOM 236 C PRO A 121 -16.344 -24.590 -1.882 1.00 0.00 C ATOM 237 O PRO A 121 -16.356 -24.095 -0.754 1.00 0.00 O ATOM 238 CB PRO A 121 -14.210 -25.555 -2.784 1.00 0.00 C ATOM 239 CG PRO A 121 -13.167 -25.173 -1.791 1.00 0.00 C ATOM 240 CD PRO A 121 -13.008 -23.683 -1.909 1.00 0.00 C ATOM 0 HA PRO A 121 -15.614 -24.188 -3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -14.727 -26.467 -2.484 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -13.773 -25.744 -3.764 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -13.468 -25.455 -0.782 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -12.226 -25.683 -1.998 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -12.761 -23.228 -0.950 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.210 -23.418 -2.602 1.00 0.00 H new ATOM 248 N HIS A 122 -17.333 -25.343 -2.352 1.00 0.00 N ATOM 249 CA HIS A 122 -18.516 -25.639 -1.551 1.00 0.00 C ATOM 250 C HIS A 122 -18.215 -26.718 -0.515 1.00 0.00 C ATOM 251 O HIS A 122 -19.093 -27.127 0.242 1.00 0.00 O ATOM 252 CB HIS A 122 -19.668 -26.086 -2.451 1.00 0.00 C ATOM 253 CG HIS A 122 -20.199 -24.996 -3.330 1.00 0.00 C ATOM 254 ND1 HIS A 122 -21.252 -24.183 -2.967 1.00 0.00 N ATOM 255 CD2 HIS A 122 -19.816 -24.586 -4.561 1.00 0.00 C ATOM 256 CE1 HIS A 122 -21.495 -23.321 -3.939 1.00 0.00 C ATOM 257 NE2 HIS A 122 -20.636 -23.544 -4.918 1.00 0.00 N ATOM 0 H HIS A 122 -17.339 -25.759 -3.283 1.00 0.00 H new ATOM 0 HA HIS A 122 -18.807 -24.729 -1.027 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -19.330 -26.913 -3.076 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -20.478 -26.467 -1.829 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -19.014 -25.001 -5.153 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -22.265 -22.563 -3.934 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -20.590 -23.027 -5.796 1.00 0.00 H new ATOM 265 N ASN A 123 -16.967 -27.176 -0.490 1.00 0.00 N ATOM 266 CA ASN A 123 -16.551 -28.209 0.451 1.00 0.00 C ATOM 267 C ASN A 123 -15.682 -27.618 1.558 1.00 0.00 C ATOM 268 O ASN A 123 -15.587 -28.177 2.651 1.00 0.00 O ATOM 269 CB ASN A 123 -15.785 -29.314 -0.278 1.00 0.00 C ATOM 270 CG ASN A 123 -15.814 -30.631 0.474 1.00 0.00 C ATOM 271 OD1 ASN A 123 -16.572 -30.795 1.430 1.00 0.00 O ATOM 272 ND2 ASN A 123 -14.987 -31.576 0.043 1.00 0.00 N ATOM 0 H ASN A 123 -16.227 -26.848 -1.111 1.00 0.00 H new ATOM 0 HA ASN A 123 -17.446 -28.635 0.904 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -16.214 -29.456 -1.270 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -14.750 -29.002 -0.420 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -14.962 -32.483 0.509 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -14.376 -31.395 -0.754 1.00 0.00 H new ATOM 279 N CYS A 124 -15.053 -26.485 1.267 1.00 0.00 N ATOM 280 CA CYS A 124 -14.192 -25.818 2.238 1.00 0.00 C ATOM 281 C CYS A 124 -15.019 -25.019 3.239 1.00 0.00 C ATOM 282 O CYS A 124 -15.931 -24.285 2.861 1.00 0.00 O ATOM 283 CB CYS A 124 -13.203 -24.896 1.524 1.00 0.00 C ATOM 284 SG CYS A 124 -12.286 -23.798 2.630 1.00 0.00 S ATOM 0 H CYS A 124 -15.123 -26.009 0.368 1.00 0.00 H new ATOM 0 HA CYS A 124 -13.637 -26.583 2.781 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -12.493 -25.506 0.965 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -13.746 -24.291 0.798 1.00 0.00 H new ATOM 0 HG CYS A 124 -11.474 -23.059 1.933 1.00 0.00 H new ATOM 290 N GLY A 125 -14.695 -25.169 4.520 1.00 0.00 N ATOM 291 CA GLY A 125 -15.419 -24.456 5.557 1.00 0.00 C ATOM 292 C GLY A 125 -14.496 -23.711 6.501 1.00 0.00 C ATOM 293 O GLY A 125 -13.316 -23.526 6.207 1.00 0.00 O ATOM 0 H GLY A 125 -13.944 -25.771 4.858 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -16.108 -23.749 5.094 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -16.022 -25.163 6.126 1.00 0.00 H new ATOM 297 N GLU A 126 -15.036 -23.282 7.637 1.00 0.00 N ATOM 298 CA GLU A 126 -14.252 -22.550 8.626 1.00 0.00 C ATOM 299 C GLU A 126 -12.982 -23.315 8.987 1.00 0.00 C ATOM 300 O GLU A 126 -11.873 -22.894 8.655 1.00 0.00 O ATOM 301 CB GLU A 126 -15.085 -22.298 9.884 1.00 0.00 C ATOM 302 CG GLU A 126 -14.343 -21.521 10.959 1.00 0.00 C ATOM 303 CD GLU A 126 -15.253 -21.069 12.085 1.00 0.00 C ATOM 304 OE1 GLU A 126 -15.997 -21.915 12.623 1.00 0.00 O ATOM 305 OE2 GLU A 126 -15.221 -19.868 12.427 1.00 0.00 O ATOM 0 H GLU A 126 -16.012 -23.428 7.896 1.00 0.00 H new ATOM 0 HA GLU A 126 -13.967 -21.592 8.191 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -15.987 -21.751 9.609 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.406 -23.255 10.295 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -13.547 -22.143 11.368 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -13.867 -20.650 10.509 1.00 0.00 H new ATOM 312 N THR A 127 -13.152 -24.442 9.671 1.00 0.00 N ATOM 313 CA THR A 127 -12.021 -25.266 10.080 1.00 0.00 C ATOM 314 C THR A 127 -10.953 -25.312 8.993 1.00 0.00 C ATOM 315 O THR A 127 -9.856 -24.782 9.166 1.00 0.00 O ATOM 316 CB THR A 127 -12.463 -26.704 10.411 1.00 0.00 C ATOM 317 OG1 THR A 127 -13.521 -26.681 11.375 1.00 0.00 O ATOM 318 CG2 THR A 127 -11.297 -27.518 10.949 1.00 0.00 C ATOM 0 H THR A 127 -14.062 -24.805 9.954 1.00 0.00 H new ATOM 0 HA THR A 127 -11.604 -24.807 10.976 1.00 0.00 H new ATOM 0 HB THR A 127 -12.819 -27.172 9.493 1.00 0.00 H new ATOM 0 HG1 THR A 127 -13.798 -27.599 11.579 1.00 0.00 H new ATOM 0 HG21 THR A 127 -11.633 -28.530 11.176 1.00 0.00 H new ATOM 0 HG22 THR A 127 -10.505 -27.558 10.201 1.00 0.00 H new ATOM 0 HG23 THR A 127 -10.915 -27.051 11.857 1.00 0.00 H new ATOM 326 N GLU A 128 -11.281 -25.949 7.874 1.00 0.00 N ATOM 327 CA GLU A 128 -10.349 -26.064 6.759 1.00 0.00 C ATOM 328 C GLU A 128 -9.555 -24.773 6.579 1.00 0.00 C ATOM 329 O GLU A 128 -8.328 -24.764 6.688 1.00 0.00 O ATOM 330 CB GLU A 128 -11.100 -26.398 5.469 1.00 0.00 C ATOM 331 CG GLU A 128 -11.652 -27.813 5.435 1.00 0.00 C ATOM 332 CD GLU A 128 -12.876 -27.983 6.313 1.00 0.00 C ATOM 333 OE1 GLU A 128 -13.797 -27.144 6.215 1.00 0.00 O ATOM 334 OE2 GLU A 128 -12.914 -28.954 7.097 1.00 0.00 O ATOM 0 H GLU A 128 -12.185 -26.393 7.715 1.00 0.00 H new ATOM 0 HA GLU A 128 -9.652 -26.871 6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -11.922 -25.693 5.344 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -10.429 -26.258 4.621 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -11.907 -28.075 4.408 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -10.878 -28.509 5.759 1.00 0.00 H new ATOM 341 N LEU A 129 -10.263 -23.684 6.301 1.00 0.00 N ATOM 342 CA LEU A 129 -9.626 -22.386 6.105 1.00 0.00 C ATOM 343 C LEU A 129 -8.504 -22.172 7.116 1.00 0.00 C ATOM 344 O LEU A 129 -7.405 -21.750 6.758 1.00 0.00 O ATOM 345 CB LEU A 129 -10.660 -21.265 6.227 1.00 0.00 C ATOM 346 CG LEU A 129 -11.706 -21.192 5.115 1.00 0.00 C ATOM 347 CD1 LEU A 129 -12.852 -20.278 5.519 1.00 0.00 C ATOM 348 CD2 LEU A 129 -11.072 -20.714 3.817 1.00 0.00 C ATOM 0 H LEU A 129 -11.279 -23.674 6.206 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.196 -22.367 5.104 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.179 -21.379 7.179 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.131 -20.313 6.264 1.00 0.00 H new ATOM 0 HG LEU A 129 -12.107 -22.193 4.953 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -13.587 -20.239 4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -13.324 -20.664 6.423 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -12.468 -19.276 5.709 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -11.831 -20.668 3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -10.643 -19.723 3.965 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.286 -21.408 3.519 1.00 0.00 H new ATOM 360 N ARG A 130 -8.790 -22.467 8.380 1.00 0.00 N ATOM 361 CA ARG A 130 -7.804 -22.307 9.443 1.00 0.00 C ATOM 362 C ARG A 130 -6.693 -23.345 9.314 1.00 0.00 C ATOM 363 O ARG A 130 -5.511 -23.004 9.303 1.00 0.00 O ATOM 364 CB ARG A 130 -8.475 -22.430 10.812 1.00 0.00 C ATOM 365 CG ARG A 130 -9.635 -21.468 11.011 1.00 0.00 C ATOM 366 CD ARG A 130 -10.254 -21.619 12.391 1.00 0.00 C ATOM 367 NE ARG A 130 -9.333 -21.221 13.451 1.00 0.00 N ATOM 368 CZ ARG A 130 -8.423 -22.032 13.978 1.00 0.00 C ATOM 369 NH1 ARG A 130 -8.313 -23.281 13.545 1.00 0.00 N ATOM 370 NH2 ARG A 130 -7.620 -21.596 14.940 1.00 0.00 N ATOM 0 H ARG A 130 -9.695 -22.818 8.693 1.00 0.00 H new ATOM 0 HA ARG A 130 -7.363 -21.314 9.350 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.835 -23.451 10.940 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -7.731 -22.254 11.589 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -9.287 -20.444 10.878 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -10.393 -21.648 10.249 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -11.158 -21.014 12.451 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -10.554 -22.656 12.542 1.00 0.00 H new ATOM 0 HE ARG A 130 -9.392 -20.267 13.807 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -8.928 -23.620 12.806 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -7.613 -23.902 13.951 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -7.701 -20.636 15.276 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -6.922 -22.220 15.344 1.00 0.00 H new ATOM 384 N GLU A 131 -7.082 -24.613 9.217 1.00 0.00 N ATOM 385 CA GLU A 131 -6.118 -25.699 9.091 1.00 0.00 C ATOM 386 C GLU A 131 -5.136 -25.426 7.955 1.00 0.00 C ATOM 387 O GLU A 131 -4.021 -25.949 7.945 1.00 0.00 O ATOM 388 CB GLU A 131 -6.841 -27.026 8.847 1.00 0.00 C ATOM 389 CG GLU A 131 -7.425 -27.641 10.107 1.00 0.00 C ATOM 390 CD GLU A 131 -7.855 -29.082 9.908 1.00 0.00 C ATOM 391 OE1 GLU A 131 -8.279 -29.424 8.784 1.00 0.00 O ATOM 392 OE2 GLU A 131 -7.767 -29.867 10.875 1.00 0.00 O ATOM 0 H GLU A 131 -8.057 -24.913 9.223 1.00 0.00 H new ATOM 0 HA GLU A 131 -5.558 -25.764 10.024 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -7.642 -26.866 8.126 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -6.144 -27.733 8.397 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -6.685 -27.594 10.906 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -8.283 -27.051 10.431 1.00 0.00 H new ATOM 399 N TYR A 132 -5.558 -24.604 7.001 1.00 0.00 N ATOM 400 CA TYR A 132 -4.718 -24.263 5.859 1.00 0.00 C ATOM 401 C TYR A 132 -4.067 -22.897 6.050 1.00 0.00 C ATOM 402 O TYR A 132 -2.967 -22.646 5.557 1.00 0.00 O ATOM 403 CB TYR A 132 -5.544 -24.272 4.571 1.00 0.00 C ATOM 404 CG TYR A 132 -4.706 -24.359 3.316 1.00 0.00 C ATOM 405 CD1 TYR A 132 -4.041 -23.243 2.821 1.00 0.00 C ATOM 406 CD2 TYR A 132 -4.579 -25.557 2.624 1.00 0.00 C ATOM 407 CE1 TYR A 132 -3.276 -23.318 1.674 1.00 0.00 C ATOM 408 CE2 TYR A 132 -3.815 -25.642 1.476 1.00 0.00 C ATOM 409 CZ TYR A 132 -3.165 -24.520 1.005 1.00 0.00 C ATOM 410 OH TYR A 132 -2.403 -24.599 -0.137 1.00 0.00 O ATOM 0 H TYR A 132 -6.477 -24.161 6.996 1.00 0.00 H new ATOM 0 HA TYR A 132 -3.930 -25.013 5.783 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.233 -25.116 4.597 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.150 -23.367 4.531 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.124 -22.301 3.343 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.086 -26.437 2.990 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.767 -22.441 1.302 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.727 -26.581 0.950 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.429 -25.515 -0.485 1.00 0.00 H new ATOM 420 N PHE A 133 -4.755 -22.017 6.770 1.00 0.00 N ATOM 421 CA PHE A 133 -4.245 -20.675 7.028 1.00 0.00 C ATOM 422 C PHE A 133 -3.505 -20.621 8.361 1.00 0.00 C ATOM 423 O PHE A 133 -3.220 -19.543 8.883 1.00 0.00 O ATOM 424 CB PHE A 133 -5.392 -19.662 7.027 1.00 0.00 C ATOM 425 CG PHE A 133 -5.881 -19.311 5.650 1.00 0.00 C ATOM 426 CD1 PHE A 133 -4.985 -18.986 4.645 1.00 0.00 C ATOM 427 CD2 PHE A 133 -7.236 -19.305 5.363 1.00 0.00 C ATOM 428 CE1 PHE A 133 -5.431 -18.663 3.377 1.00 0.00 C ATOM 429 CE2 PHE A 133 -7.688 -18.983 4.097 1.00 0.00 C ATOM 430 CZ PHE A 133 -6.785 -18.661 3.103 1.00 0.00 C ATOM 0 H PHE A 133 -5.667 -22.209 7.185 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.544 -20.421 6.233 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.222 -20.065 7.607 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.063 -18.753 7.530 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -3.926 -18.985 4.854 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -7.947 -19.555 6.137 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -4.722 -18.413 2.602 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -8.747 -18.983 3.885 1.00 0.00 H new ATOM 0 HZ PHE A 133 -7.137 -18.408 2.114 1.00 0.00 H new ATOM 440 N LYS A 134 -3.198 -21.792 8.908 1.00 0.00 N ATOM 441 CA LYS A 134 -2.490 -21.880 10.180 1.00 0.00 C ATOM 442 C LYS A 134 -0.986 -22.010 9.958 1.00 0.00 C ATOM 443 O LYS A 134 -0.195 -21.845 10.887 1.00 0.00 O ATOM 444 CB LYS A 134 -3.002 -23.074 10.990 1.00 0.00 C ATOM 445 CG LYS A 134 -2.598 -24.419 10.411 1.00 0.00 C ATOM 446 CD LYS A 134 -2.448 -25.471 11.498 1.00 0.00 C ATOM 447 CE LYS A 134 -3.800 -25.903 12.046 1.00 0.00 C ATOM 448 NZ LYS A 134 -3.670 -26.603 13.354 1.00 0.00 N ATOM 0 H LYS A 134 -3.428 -22.694 8.490 1.00 0.00 H new ATOM 0 HA LYS A 134 -2.679 -20.962 10.737 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.625 -22.999 12.010 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.089 -23.024 11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.346 -24.745 9.689 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -1.657 -24.316 9.871 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -1.923 -26.338 11.097 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -1.836 -25.074 12.308 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -4.440 -25.029 12.164 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.289 -26.562 11.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -4.613 -26.881 13.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -3.080 -27.451 13.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -3.227 -25.966 14.046 1.00 0.00 H new ATOM 462 N LYS A 135 -0.599 -22.305 8.722 1.00 0.00 N ATOM 463 CA LYS A 135 0.810 -22.454 8.377 1.00 0.00 C ATOM 464 C LYS A 135 1.470 -21.092 8.182 1.00 0.00 C ATOM 465 O LYS A 135 2.626 -20.892 8.555 1.00 0.00 O ATOM 466 CB LYS A 135 0.959 -23.292 7.105 1.00 0.00 C ATOM 467 CG LYS A 135 -0.067 -22.961 6.035 1.00 0.00 C ATOM 468 CD LYS A 135 0.343 -23.510 4.679 1.00 0.00 C ATOM 469 CE LYS A 135 -0.868 -23.806 3.808 1.00 0.00 C ATOM 470 NZ LYS A 135 -1.576 -25.042 4.244 1.00 0.00 N ATOM 0 H LYS A 135 -1.241 -22.446 7.942 1.00 0.00 H new ATOM 0 HA LYS A 135 1.308 -22.964 9.201 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.959 -23.143 6.697 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.875 -24.348 7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -1.035 -23.374 6.318 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -0.189 -21.880 5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 135 0.988 -22.791 4.174 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.926 -24.421 4.815 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -1.556 -22.961 3.844 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.551 -23.916 2.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.579 -24.980 3.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -1.145 -25.869 3.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -1.499 -25.141 5.276 1.00 0.00 H new ATOM 484 N PHE A 136 0.727 -20.159 7.595 1.00 0.00 N ATOM 485 CA PHE A 136 1.240 -18.816 7.351 1.00 0.00 C ATOM 486 C PHE A 136 1.434 -18.061 8.663 1.00 0.00 C ATOM 487 O PHE A 136 2.353 -17.254 8.798 1.00 0.00 O ATOM 488 CB PHE A 136 0.286 -18.041 6.440 1.00 0.00 C ATOM 489 CG PHE A 136 0.228 -18.577 5.038 1.00 0.00 C ATOM 490 CD1 PHE A 136 1.389 -18.766 4.306 1.00 0.00 C ATOM 491 CD2 PHE A 136 -0.988 -18.893 4.453 1.00 0.00 C ATOM 492 CE1 PHE A 136 1.337 -19.259 3.016 1.00 0.00 C ATOM 493 CE2 PHE A 136 -1.045 -19.387 3.164 1.00 0.00 C ATOM 494 CZ PHE A 136 0.119 -19.571 2.444 1.00 0.00 C ATOM 0 H PHE A 136 -0.232 -20.308 7.280 1.00 0.00 H new ATOM 0 HA PHE A 136 2.208 -18.908 6.858 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -0.715 -18.065 6.871 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.595 -16.996 6.409 1.00 0.00 H new ATOM 0 HD1 PHE A 136 2.345 -18.526 4.748 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.902 -18.751 5.011 1.00 0.00 H new ATOM 0 HE1 PHE A 136 2.249 -19.400 2.455 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -1.999 -19.629 2.720 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.077 -19.958 1.436 1.00 0.00 H new ATOM 504 N GLY A 137 0.560 -18.330 9.629 1.00 0.00 N ATOM 505 CA GLY A 137 0.651 -17.668 10.917 1.00 0.00 C ATOM 506 C GLY A 137 -0.291 -18.265 11.943 1.00 0.00 C ATOM 507 O GLY A 137 -0.157 -19.430 12.317 1.00 0.00 O ATOM 0 H GLY A 137 -0.209 -18.994 9.542 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.675 -17.736 11.285 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.426 -16.609 10.794 1.00 0.00 H new ATOM 511 N VAL A 138 -1.247 -17.464 12.403 1.00 0.00 N ATOM 512 CA VAL A 138 -2.216 -17.919 13.393 1.00 0.00 C ATOM 513 C VAL A 138 -3.576 -17.268 13.171 1.00 0.00 C ATOM 514 O VAL A 138 -3.765 -16.086 13.458 1.00 0.00 O ATOM 515 CB VAL A 138 -1.740 -17.613 14.825 1.00 0.00 C ATOM 516 CG1 VAL A 138 -2.889 -17.757 15.812 1.00 0.00 C ATOM 517 CG2 VAL A 138 -0.581 -18.522 15.207 1.00 0.00 C ATOM 0 H VAL A 138 -1.371 -16.496 12.106 1.00 0.00 H new ATOM 0 HA VAL A 138 -2.310 -18.998 13.272 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.390 -16.581 14.860 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.534 -17.537 16.819 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -3.685 -17.061 15.548 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.273 -18.777 15.778 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -0.257 -18.292 16.222 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -0.902 -19.562 15.156 1.00 0.00 H new ATOM 0 HG23 VAL A 138 0.248 -18.364 14.517 1.00 0.00 H new ATOM 527 N VAL A 139 -4.523 -18.047 12.658 1.00 0.00 N ATOM 528 CA VAL A 139 -5.868 -17.547 12.398 1.00 0.00 C ATOM 529 C VAL A 139 -6.599 -17.237 13.699 1.00 0.00 C ATOM 530 O VAL A 139 -6.878 -18.133 14.497 1.00 0.00 O ATOM 531 CB VAL A 139 -6.696 -18.560 11.585 1.00 0.00 C ATOM 532 CG1 VAL A 139 -8.047 -17.969 11.214 1.00 0.00 C ATOM 533 CG2 VAL A 139 -5.935 -18.994 10.341 1.00 0.00 C ATOM 0 H VAL A 139 -4.384 -19.028 12.414 1.00 0.00 H new ATOM 0 HA VAL A 139 -5.759 -16.630 11.818 1.00 0.00 H new ATOM 0 HB VAL A 139 -6.869 -19.441 12.203 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -8.618 -18.699 10.640 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -8.594 -17.713 12.122 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -7.899 -17.071 10.614 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -6.535 -19.710 9.779 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -5.730 -18.124 9.718 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -4.994 -19.460 10.634 1.00 0.00 H new ATOM 543 N THR A 140 -6.909 -15.961 13.908 1.00 0.00 N ATOM 544 CA THR A 140 -7.608 -15.532 15.113 1.00 0.00 C ATOM 545 C THR A 140 -9.109 -15.426 14.869 1.00 0.00 C ATOM 546 O THR A 140 -9.912 -15.781 15.730 1.00 0.00 O ATOM 547 CB THR A 140 -7.083 -14.172 15.612 1.00 0.00 C ATOM 548 OG1 THR A 140 -7.156 -13.203 14.560 1.00 0.00 O ATOM 549 CG2 THR A 140 -5.647 -14.292 16.099 1.00 0.00 C ATOM 0 H THR A 140 -6.687 -15.207 13.258 1.00 0.00 H new ATOM 0 HA THR A 140 -7.419 -16.288 15.875 1.00 0.00 H new ATOM 0 HB THR A 140 -7.707 -13.850 16.446 1.00 0.00 H new ATOM 0 HG1 THR A 140 -6.822 -12.341 14.885 1.00 0.00 H new ATOM 0 HG21 THR A 140 -5.298 -13.319 16.446 1.00 0.00 H new ATOM 0 HG22 THR A 140 -5.600 -15.009 16.919 1.00 0.00 H new ATOM 0 HG23 THR A 140 -5.013 -14.634 15.281 1.00 0.00 H new ATOM 557 N GLU A 141 -9.479 -14.936 13.690 1.00 0.00 N ATOM 558 CA GLU A 141 -10.885 -14.784 13.335 1.00 0.00 C ATOM 559 C GLU A 141 -11.153 -15.319 11.931 1.00 0.00 C ATOM 560 O GLU A 141 -10.317 -15.192 11.036 1.00 0.00 O ATOM 561 CB GLU A 141 -11.299 -13.313 13.419 1.00 0.00 C ATOM 562 CG GLU A 141 -12.795 -13.111 13.598 1.00 0.00 C ATOM 563 CD GLU A 141 -13.124 -11.850 14.373 1.00 0.00 C ATOM 564 OE1 GLU A 141 -12.903 -10.747 13.832 1.00 0.00 O ATOM 565 OE2 GLU A 141 -13.604 -11.966 15.520 1.00 0.00 O ATOM 0 H GLU A 141 -8.826 -14.638 12.966 1.00 0.00 H new ATOM 0 HA GLU A 141 -11.477 -15.362 14.045 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.775 -12.844 14.252 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -10.978 -12.801 12.512 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.272 -13.066 12.619 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.215 -13.972 14.118 1.00 0.00 H new ATOM 572 N VAL A 142 -12.324 -15.920 11.747 1.00 0.00 N ATOM 573 CA VAL A 142 -12.703 -16.475 10.453 1.00 0.00 C ATOM 574 C VAL A 142 -14.095 -16.008 10.041 1.00 0.00 C ATOM 575 O VAL A 142 -15.101 -16.608 10.421 1.00 0.00 O ATOM 576 CB VAL A 142 -12.676 -18.015 10.473 1.00 0.00 C ATOM 577 CG1 VAL A 142 -13.261 -18.577 9.186 1.00 0.00 C ATOM 578 CG2 VAL A 142 -11.256 -18.519 10.687 1.00 0.00 C ATOM 0 H VAL A 142 -13.027 -16.035 12.477 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.973 -16.115 9.728 1.00 0.00 H new ATOM 0 HB VAL A 142 -13.290 -18.361 11.304 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -13.233 -19.666 9.219 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -14.293 -18.243 9.079 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -12.676 -18.225 8.336 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -11.255 -19.609 10.699 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -10.618 -18.164 9.878 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -10.877 -18.146 11.638 1.00 0.00 H new ATOM 588 N VAL A 143 -14.145 -14.934 9.260 1.00 0.00 N ATOM 589 CA VAL A 143 -15.414 -14.386 8.794 1.00 0.00 C ATOM 590 C VAL A 143 -15.845 -15.036 7.485 1.00 0.00 C ATOM 591 O VAL A 143 -15.019 -15.311 6.615 1.00 0.00 O ATOM 592 CB VAL A 143 -15.327 -12.861 8.593 1.00 0.00 C ATOM 593 CG1 VAL A 143 -16.641 -12.318 8.052 1.00 0.00 C ATOM 594 CG2 VAL A 143 -14.953 -12.173 9.897 1.00 0.00 C ATOM 0 H VAL A 143 -13.322 -14.426 8.936 1.00 0.00 H new ATOM 0 HA VAL A 143 -16.154 -14.602 9.565 1.00 0.00 H new ATOM 0 HB VAL A 143 -14.547 -12.652 7.861 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -16.561 -11.239 7.916 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -16.862 -12.789 7.094 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -17.443 -12.536 8.757 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -14.896 -11.096 9.737 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.709 -12.388 10.652 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -13.985 -12.541 10.238 1.00 0.00 H new ATOM 604 N MET A 144 -17.145 -15.279 7.351 1.00 0.00 N ATOM 605 CA MET A 144 -17.687 -15.896 6.146 1.00 0.00 C ATOM 606 C MET A 144 -19.016 -15.257 5.759 1.00 0.00 C ATOM 607 O MET A 144 -19.864 -15.000 6.614 1.00 0.00 O ATOM 608 CB MET A 144 -17.873 -17.400 6.357 1.00 0.00 C ATOM 609 CG MET A 144 -16.579 -18.191 6.268 1.00 0.00 C ATOM 610 SD MET A 144 -16.856 -19.972 6.202 1.00 0.00 S ATOM 611 CE MET A 144 -16.037 -20.385 4.663 1.00 0.00 C ATOM 0 H MET A 144 -17.842 -15.058 8.062 1.00 0.00 H new ATOM 0 HA MET A 144 -16.977 -15.735 5.335 1.00 0.00 H new ATOM 0 HB2 MET A 144 -18.325 -17.568 7.334 1.00 0.00 H new ATOM 0 HB3 MET A 144 -18.573 -17.779 5.612 1.00 0.00 H new ATOM 0 HG2 MET A 144 -16.028 -17.880 5.381 1.00 0.00 H new ATOM 0 HG3 MET A 144 -15.954 -17.956 7.130 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.779 -20.695 3.927 1.00 0.00 H new ATOM 0 HE2 MET A 144 -15.500 -19.513 4.291 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.333 -21.200 4.833 1.00 0.00 H new ATOM 621 N ILE A 145 -19.191 -15.002 4.466 1.00 0.00 N ATOM 622 CA ILE A 145 -20.417 -14.393 3.967 1.00 0.00 C ATOM 623 C ILE A 145 -21.352 -15.444 3.376 1.00 0.00 C ATOM 624 O ILE A 145 -20.956 -16.225 2.511 1.00 0.00 O ATOM 625 CB ILE A 145 -20.121 -13.326 2.896 1.00 0.00 C ATOM 626 CG1 ILE A 145 -19.294 -12.187 3.496 1.00 0.00 C ATOM 627 CG2 ILE A 145 -21.418 -12.793 2.307 1.00 0.00 C ATOM 628 CD1 ILE A 145 -18.576 -11.352 2.459 1.00 0.00 C ATOM 0 H ILE A 145 -18.499 -15.208 3.746 1.00 0.00 H new ATOM 0 HA ILE A 145 -20.901 -13.916 4.819 1.00 0.00 H new ATOM 0 HB ILE A 145 -19.543 -13.786 2.094 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -19.949 -11.541 4.081 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -18.561 -12.605 4.186 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -21.192 -12.040 1.552 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -21.973 -13.612 1.849 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -22.020 -12.345 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -18.010 -10.564 2.955 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -17.895 -11.985 1.890 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -19.305 -10.905 1.783 1.00 0.00 H new ATOM 640 N TYR A 146 -22.593 -15.456 3.849 1.00 0.00 N ATOM 641 CA TYR A 146 -23.585 -16.411 3.368 1.00 0.00 C ATOM 642 C TYR A 146 -24.986 -16.017 3.824 1.00 0.00 C ATOM 643 O TYR A 146 -25.150 -15.180 4.712 1.00 0.00 O ATOM 644 CB TYR A 146 -23.251 -17.818 3.866 1.00 0.00 C ATOM 645 CG TYR A 146 -22.783 -17.857 5.303 1.00 0.00 C ATOM 646 CD1 TYR A 146 -23.530 -17.263 6.314 1.00 0.00 C ATOM 647 CD2 TYR A 146 -21.594 -18.486 5.651 1.00 0.00 C ATOM 648 CE1 TYR A 146 -23.107 -17.296 7.628 1.00 0.00 C ATOM 649 CE2 TYR A 146 -21.164 -18.524 6.963 1.00 0.00 C ATOM 650 CZ TYR A 146 -21.923 -17.928 7.948 1.00 0.00 C ATOM 651 OH TYR A 146 -21.497 -17.963 9.256 1.00 0.00 O ATOM 0 H TYR A 146 -22.936 -14.816 4.565 1.00 0.00 H new ATOM 0 HA TYR A 146 -23.562 -16.403 2.278 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -24.133 -18.450 3.763 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -22.477 -18.245 3.229 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -24.457 -16.767 6.067 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -20.996 -18.953 4.883 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -23.700 -16.830 8.401 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -20.238 -19.018 7.216 1.00 0.00 H new ATOM 0 HH TYR A 146 -20.646 -18.447 9.310 1.00 0.00 H new ATOM 661 N ASP A 147 -25.994 -16.626 3.210 1.00 0.00 N ATOM 662 CA ASP A 147 -27.383 -16.342 3.552 1.00 0.00 C ATOM 663 C ASP A 147 -27.836 -17.192 4.735 1.00 0.00 C ATOM 664 O ASP A 147 -27.931 -18.414 4.633 1.00 0.00 O ATOM 665 CB ASP A 147 -28.290 -16.597 2.348 1.00 0.00 C ATOM 666 CG ASP A 147 -29.739 -16.252 2.631 1.00 0.00 C ATOM 667 OD1 ASP A 147 -30.227 -16.594 3.728 1.00 0.00 O ATOM 668 OD2 ASP A 147 -30.384 -15.640 1.755 1.00 0.00 O ATOM 0 H ASP A 147 -25.875 -17.320 2.472 1.00 0.00 H new ATOM 0 HA ASP A 147 -27.454 -15.291 3.834 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -27.938 -16.008 1.501 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -28.219 -17.646 2.059 1.00 0.00 H new ATOM 673 N ALA A 148 -28.113 -16.536 5.857 1.00 0.00 N ATOM 674 CA ALA A 148 -28.556 -17.231 7.059 1.00 0.00 C ATOM 675 C ALA A 148 -29.420 -18.437 6.708 1.00 0.00 C ATOM 676 O ALA A 148 -29.093 -19.570 7.062 1.00 0.00 O ATOM 677 CB ALA A 148 -29.320 -16.279 7.968 1.00 0.00 C ATOM 0 H ALA A 148 -28.038 -15.524 5.958 1.00 0.00 H new ATOM 0 HA ALA A 148 -27.673 -17.590 7.587 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -29.645 -16.812 8.862 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -28.672 -15.451 8.255 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -30.191 -15.892 7.440 1.00 0.00 H new ATOM 683 N GLU A 149 -30.524 -18.187 6.010 1.00 0.00 N ATOM 684 CA GLU A 149 -31.434 -19.254 5.614 1.00 0.00 C ATOM 685 C GLU A 149 -30.661 -20.483 5.144 1.00 0.00 C ATOM 686 O GLU A 149 -31.003 -21.615 5.488 1.00 0.00 O ATOM 687 CB GLU A 149 -32.369 -18.771 4.502 1.00 0.00 C ATOM 688 CG GLU A 149 -33.319 -19.843 3.997 1.00 0.00 C ATOM 689 CD GLU A 149 -34.448 -20.128 4.969 1.00 0.00 C ATOM 690 OE1 GLU A 149 -35.165 -19.176 5.342 1.00 0.00 O ATOM 691 OE2 GLU A 149 -34.613 -21.303 5.357 1.00 0.00 O ATOM 0 H GLU A 149 -30.809 -17.255 5.708 1.00 0.00 H new ATOM 0 HA GLU A 149 -32.028 -19.531 6.485 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -32.951 -17.926 4.870 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -31.770 -18.406 3.668 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -33.738 -19.530 3.041 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -32.761 -20.761 3.815 1.00 0.00 H new ATOM 698 N LYS A 150 -29.617 -20.252 4.356 1.00 0.00 N ATOM 699 CA LYS A 150 -28.793 -21.338 3.838 1.00 0.00 C ATOM 700 C LYS A 150 -27.810 -21.827 4.897 1.00 0.00 C ATOM 701 O LYS A 150 -27.589 -23.029 5.043 1.00 0.00 O ATOM 702 CB LYS A 150 -28.031 -20.879 2.593 1.00 0.00 C ATOM 703 CG LYS A 150 -28.796 -21.091 1.299 1.00 0.00 C ATOM 704 CD LYS A 150 -27.857 -21.337 0.130 1.00 0.00 C ATOM 705 CE LYS A 150 -28.620 -21.734 -1.125 1.00 0.00 C ATOM 706 NZ LYS A 150 -29.057 -20.545 -1.908 1.00 0.00 N ATOM 0 H LYS A 150 -29.321 -19.321 4.062 1.00 0.00 H new ATOM 0 HA LYS A 150 -29.452 -22.164 3.569 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -27.791 -19.821 2.694 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -27.084 -21.417 2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -29.471 -21.940 1.409 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -29.414 -20.217 1.093 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -27.275 -20.436 -0.066 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -27.149 -22.123 0.390 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -27.989 -22.367 -1.748 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -29.492 -22.327 -0.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -29.573 -20.858 -2.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -29.680 -19.953 -1.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -28.224 -19.993 -2.195 1.00 0.00 H new ATOM 720 N GLN A 151 -27.225 -20.889 5.634 1.00 0.00 N ATOM 721 CA GLN A 151 -26.267 -21.226 6.680 1.00 0.00 C ATOM 722 C GLN A 151 -25.070 -21.973 6.101 1.00 0.00 C ATOM 723 O GLN A 151 -24.683 -23.029 6.603 1.00 0.00 O ATOM 724 CB GLN A 151 -26.938 -22.074 7.762 1.00 0.00 C ATOM 725 CG GLN A 151 -27.546 -21.254 8.888 1.00 0.00 C ATOM 726 CD GLN A 151 -27.537 -21.989 10.215 1.00 0.00 C ATOM 727 OE1 GLN A 151 -26.983 -23.082 10.329 1.00 0.00 O ATOM 728 NE2 GLN A 151 -28.154 -21.390 11.227 1.00 0.00 N ATOM 0 H GLN A 151 -27.398 -19.890 5.526 1.00 0.00 H new ATOM 0 HA GLN A 151 -25.912 -20.297 7.126 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -27.718 -22.681 7.304 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -26.203 -22.762 8.180 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -26.995 -20.319 8.991 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -28.572 -20.992 8.629 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -28.600 -20.484 11.088 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -28.181 -21.836 12.144 1.00 0.00 H new ATOM 737 N ARG A 152 -24.488 -21.418 5.043 1.00 0.00 N ATOM 738 CA ARG A 152 -23.336 -22.033 4.395 1.00 0.00 C ATOM 739 C ARG A 152 -22.611 -21.027 3.506 1.00 0.00 C ATOM 740 O ARG A 152 -23.227 -20.241 2.786 1.00 0.00 O ATOM 741 CB ARG A 152 -23.775 -23.240 3.564 1.00 0.00 C ATOM 742 CG ARG A 152 -22.900 -23.493 2.347 1.00 0.00 C ATOM 743 CD ARG A 152 -23.040 -24.922 1.848 1.00 0.00 C ATOM 744 NE ARG A 152 -22.246 -25.858 2.639 1.00 0.00 N ATOM 745 CZ ARG A 152 -20.918 -25.861 2.660 1.00 0.00 C ATOM 746 NH1 ARG A 152 -20.238 -24.982 1.937 1.00 0.00 N ATOM 747 NH2 ARG A 152 -20.267 -26.745 3.406 1.00 0.00 N ATOM 0 H ARG A 152 -24.795 -20.544 4.617 1.00 0.00 H new ATOM 0 HA ARG A 152 -22.649 -22.366 5.173 1.00 0.00 H new ATOM 0 HB2 ARG A 152 -23.768 -24.128 4.197 1.00 0.00 H new ATOM 0 HB3 ARG A 152 -24.804 -23.090 3.236 1.00 0.00 H new ATOM 0 HG2 ARG A 152 -23.173 -22.800 1.551 1.00 0.00 H new ATOM 0 HG3 ARG A 152 -21.858 -23.295 2.599 1.00 0.00 H new ATOM 0 HD2 ARG A 152 -24.089 -25.217 1.883 1.00 0.00 H new ATOM 0 HD3 ARG A 152 -22.729 -24.974 0.805 1.00 0.00 H new ATOM 0 HE ARG A 152 -22.738 -26.548 3.207 1.00 0.00 H new ATOM 0 HH11 ARG A 152 -20.735 -24.301 1.363 1.00 0.00 H new ATOM 0 HH12 ARG A 152 -19.218 -24.987 1.955 1.00 0.00 H new ATOM 0 HH21 ARG A 152 -20.787 -27.423 3.964 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -19.247 -26.747 3.422 1.00 0.00 H new ATOM 761 N PRO A 153 -21.271 -21.050 3.555 1.00 0.00 N ATOM 762 CA PRO A 153 -20.433 -20.147 2.761 1.00 0.00 C ATOM 763 C PRO A 153 -20.481 -20.471 1.272 1.00 0.00 C ATOM 764 O PRO A 153 -19.993 -21.515 0.838 1.00 0.00 O ATOM 765 CB PRO A 153 -19.027 -20.387 3.316 1.00 0.00 C ATOM 766 CG PRO A 153 -19.071 -21.767 3.874 1.00 0.00 C ATOM 767 CD PRO A 153 -20.470 -21.961 4.391 1.00 0.00 C ATOM 0 HA PRO A 153 -20.764 -19.111 2.837 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -18.273 -20.300 2.534 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.775 -19.657 4.085 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -18.832 -22.505 3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -18.340 -21.888 4.673 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -20.798 -22.995 4.286 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -20.547 -21.708 5.448 1.00 0.00 H new ATOM 775 N ARG A 154 -21.072 -19.571 0.493 1.00 0.00 N ATOM 776 CA ARG A 154 -21.184 -19.762 -0.948 1.00 0.00 C ATOM 777 C ARG A 154 -19.821 -20.066 -1.563 1.00 0.00 C ATOM 778 O ARG A 154 -19.637 -21.094 -2.213 1.00 0.00 O ATOM 779 CB ARG A 154 -21.786 -18.518 -1.604 1.00 0.00 C ATOM 780 CG ARG A 154 -23.123 -18.104 -1.012 1.00 0.00 C ATOM 781 CD ARG A 154 -23.535 -16.718 -1.481 1.00 0.00 C ATOM 782 NE ARG A 154 -23.745 -16.669 -2.926 1.00 0.00 N ATOM 783 CZ ARG A 154 -24.180 -15.591 -3.569 1.00 0.00 C ATOM 784 NH1 ARG A 154 -24.448 -14.479 -2.900 1.00 0.00 N ATOM 785 NH2 ARG A 154 -24.346 -15.625 -4.885 1.00 0.00 N ATOM 0 H ARG A 154 -21.481 -18.702 0.836 1.00 0.00 H new ATOM 0 HA ARG A 154 -21.842 -20.612 -1.127 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -21.083 -17.690 -1.507 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -21.913 -18.705 -2.670 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -23.887 -18.827 -1.296 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -23.060 -18.117 0.076 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -24.451 -16.420 -0.971 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -22.766 -15.997 -1.202 1.00 0.00 H new ATOM 0 HE ARG A 154 -23.547 -17.508 -3.471 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -24.320 -14.449 -1.888 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -24.782 -13.653 -3.397 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -24.140 -16.479 -5.403 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -24.680 -14.797 -5.378 1.00 0.00 H new ATOM 799 N GLY A 155 -18.868 -19.162 -1.354 1.00 0.00 N ATOM 800 CA GLY A 155 -17.535 -19.352 -1.896 1.00 0.00 C ATOM 801 C GLY A 155 -16.676 -18.109 -1.768 1.00 0.00 C ATOM 802 O GLY A 155 -15.929 -17.765 -2.684 1.00 0.00 O ATOM 0 H GLY A 155 -18.995 -18.303 -0.820 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -17.050 -20.180 -1.379 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -17.610 -19.632 -2.947 1.00 0.00 H new ATOM 806 N PHE A 156 -16.782 -17.433 -0.629 1.00 0.00 N ATOM 807 CA PHE A 156 -16.010 -16.220 -0.385 1.00 0.00 C ATOM 808 C PHE A 156 -16.162 -15.760 1.062 1.00 0.00 C ATOM 809 O PHE A 156 -17.052 -16.216 1.779 1.00 0.00 O ATOM 810 CB PHE A 156 -16.456 -15.107 -1.336 1.00 0.00 C ATOM 811 CG PHE A 156 -17.938 -14.863 -1.320 1.00 0.00 C ATOM 812 CD1 PHE A 156 -18.781 -15.585 -2.150 1.00 0.00 C ATOM 813 CD2 PHE A 156 -18.489 -13.913 -0.475 1.00 0.00 C ATOM 814 CE1 PHE A 156 -20.145 -15.362 -2.139 1.00 0.00 C ATOM 815 CE2 PHE A 156 -19.852 -13.687 -0.459 1.00 0.00 C ATOM 816 CZ PHE A 156 -20.681 -14.413 -1.291 1.00 0.00 C ATOM 0 H PHE A 156 -17.395 -17.704 0.140 1.00 0.00 H new ATOM 0 HA PHE A 156 -14.959 -16.445 -0.567 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -15.941 -14.184 -1.069 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -16.149 -15.362 -2.350 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -18.367 -16.330 -2.813 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -17.846 -13.343 0.179 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -20.791 -15.929 -2.793 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -20.269 -12.943 0.204 1.00 0.00 H new ATOM 0 HZ PHE A 156 -21.747 -14.239 -1.279 1.00 0.00 H new ATOM 826 N GLY A 157 -15.286 -14.853 1.483 1.00 0.00 N ATOM 827 CA GLY A 157 -15.339 -14.346 2.842 1.00 0.00 C ATOM 828 C GLY A 157 -14.062 -13.637 3.247 1.00 0.00 C ATOM 829 O GLY A 157 -13.338 -13.116 2.399 1.00 0.00 O ATOM 0 H GLY A 157 -14.541 -14.460 0.908 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -16.179 -13.658 2.937 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -15.525 -15.173 3.528 1.00 0.00 H new ATOM 833 N PHE A 158 -13.785 -13.615 4.546 1.00 0.00 N ATOM 834 CA PHE A 158 -12.588 -12.962 5.062 1.00 0.00 C ATOM 835 C PHE A 158 -12.016 -13.732 6.248 1.00 0.00 C ATOM 836 O PHE A 158 -12.711 -14.532 6.876 1.00 0.00 O ATOM 837 CB PHE A 158 -12.905 -11.524 5.478 1.00 0.00 C ATOM 838 CG PHE A 158 -13.443 -10.680 4.358 1.00 0.00 C ATOM 839 CD1 PHE A 158 -14.772 -10.774 3.979 1.00 0.00 C ATOM 840 CD2 PHE A 158 -12.619 -9.793 3.684 1.00 0.00 C ATOM 841 CE1 PHE A 158 -15.269 -9.999 2.948 1.00 0.00 C ATOM 842 CE2 PHE A 158 -13.111 -9.016 2.652 1.00 0.00 C ATOM 843 CZ PHE A 158 -14.438 -9.118 2.285 1.00 0.00 C ATOM 0 H PHE A 158 -14.374 -14.042 5.261 1.00 0.00 H new ATOM 0 HA PHE A 158 -11.842 -12.947 4.268 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -13.631 -11.541 6.290 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -12.000 -11.060 5.870 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -15.427 -11.460 4.495 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -11.581 -9.708 3.968 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -16.307 -10.083 2.661 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -12.458 -8.330 2.133 1.00 0.00 H new ATOM 0 HZ PHE A 158 -14.825 -8.510 1.481 1.00 0.00 H new ATOM 853 N ILE A 159 -10.745 -13.486 6.549 1.00 0.00 N ATOM 854 CA ILE A 159 -10.080 -14.155 7.660 1.00 0.00 C ATOM 855 C ILE A 159 -9.023 -13.255 8.291 1.00 0.00 C ATOM 856 O ILE A 159 -8.247 -12.605 7.590 1.00 0.00 O ATOM 857 CB ILE A 159 -9.417 -15.470 7.209 1.00 0.00 C ATOM 858 CG1 ILE A 159 -10.422 -16.340 6.451 1.00 0.00 C ATOM 859 CG2 ILE A 159 -8.858 -16.220 8.409 1.00 0.00 C ATOM 860 CD1 ILE A 159 -9.952 -17.763 6.242 1.00 0.00 C ATOM 0 H ILE A 159 -10.155 -12.828 6.039 1.00 0.00 H new ATOM 0 HA ILE A 159 -10.849 -14.380 8.399 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.592 -15.232 6.537 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.364 -16.354 6.999 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -10.624 -15.886 5.481 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -8.393 -17.147 8.074 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.114 -15.601 8.911 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -9.666 -16.450 9.103 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -10.714 -18.322 5.698 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -9.026 -17.760 5.668 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -9.777 -18.234 7.209 1.00 0.00 H new ATOM 872 N THR A 160 -8.996 -13.224 9.620 1.00 0.00 N ATOM 873 CA THR A 160 -8.034 -12.405 10.345 1.00 0.00 C ATOM 874 C THR A 160 -6.909 -13.258 10.921 1.00 0.00 C ATOM 875 O THR A 160 -7.136 -14.383 11.367 1.00 0.00 O ATOM 876 CB THR A 160 -8.709 -11.626 11.490 1.00 0.00 C ATOM 877 OG1 THR A 160 -9.808 -10.862 10.981 1.00 0.00 O ATOM 878 CG2 THR A 160 -7.715 -10.701 12.176 1.00 0.00 C ATOM 0 H THR A 160 -9.630 -13.757 10.216 1.00 0.00 H new ATOM 0 HA THR A 160 -7.619 -11.696 9.628 1.00 0.00 H new ATOM 0 HB THR A 160 -9.075 -12.345 12.223 1.00 0.00 H new ATOM 0 HG1 THR A 160 -10.233 -10.371 11.715 1.00 0.00 H new ATOM 0 HG21 THR A 160 -8.215 -10.162 12.981 1.00 0.00 H new ATOM 0 HG22 THR A 160 -6.895 -11.289 12.588 1.00 0.00 H new ATOM 0 HG23 THR A 160 -7.322 -9.988 11.451 1.00 0.00 H new ATOM 886 N PHE A 161 -5.696 -12.716 10.908 1.00 0.00 N ATOM 887 CA PHE A 161 -4.535 -13.428 11.429 1.00 0.00 C ATOM 888 C PHE A 161 -4.006 -12.756 12.693 1.00 0.00 C ATOM 889 O PHE A 161 -4.405 -11.642 13.028 1.00 0.00 O ATOM 890 CB PHE A 161 -3.432 -13.491 10.371 1.00 0.00 C ATOM 891 CG PHE A 161 -3.736 -14.433 9.242 1.00 0.00 C ATOM 892 CD1 PHE A 161 -4.641 -14.082 8.254 1.00 0.00 C ATOM 893 CD2 PHE A 161 -3.117 -15.671 9.169 1.00 0.00 C ATOM 894 CE1 PHE A 161 -4.924 -14.948 7.214 1.00 0.00 C ATOM 895 CE2 PHE A 161 -3.396 -16.541 8.131 1.00 0.00 C ATOM 896 CZ PHE A 161 -4.299 -16.178 7.152 1.00 0.00 C ATOM 0 H PHE A 161 -5.491 -11.786 10.542 1.00 0.00 H new ATOM 0 HA PHE A 161 -4.845 -14.442 11.681 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -3.271 -12.492 9.966 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -2.500 -13.796 10.847 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -5.131 -13.121 8.296 1.00 0.00 H new ATOM 0 HD2 PHE A 161 -2.409 -15.959 9.932 1.00 0.00 H new ATOM 0 HE1 PHE A 161 -5.633 -14.663 6.451 1.00 0.00 H new ATOM 0 HE2 PHE A 161 -2.908 -17.503 8.086 1.00 0.00 H new ATOM 0 HZ PHE A 161 -4.516 -16.855 6.339 1.00 0.00 H new ATOM 906 N GLU A 162 -3.106 -13.443 13.389 1.00 0.00 N ATOM 907 CA GLU A 162 -2.523 -12.913 14.616 1.00 0.00 C ATOM 908 C GLU A 162 -1.595 -11.740 14.315 1.00 0.00 C ATOM 909 O GLU A 162 -1.557 -10.759 15.058 1.00 0.00 O ATOM 910 CB GLU A 162 -1.754 -14.009 15.357 1.00 0.00 C ATOM 911 CG GLU A 162 -1.083 -13.527 16.632 1.00 0.00 C ATOM 912 CD GLU A 162 -0.162 -14.568 17.237 1.00 0.00 C ATOM 913 OE1 GLU A 162 -0.394 -15.773 17.003 1.00 0.00 O ATOM 914 OE2 GLU A 162 0.790 -14.178 17.944 1.00 0.00 O ATOM 0 H GLU A 162 -2.765 -14.367 13.124 1.00 0.00 H new ATOM 0 HA GLU A 162 -3.336 -12.558 15.250 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -2.440 -14.820 15.602 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -0.996 -14.422 14.692 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -0.513 -12.623 16.418 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -1.847 -13.257 17.360 1.00 0.00 H new ATOM 921 N ASP A 163 -0.848 -11.849 13.222 1.00 0.00 N ATOM 922 CA ASP A 163 0.080 -10.798 12.822 1.00 0.00 C ATOM 923 C ASP A 163 -0.100 -10.447 11.348 1.00 0.00 C ATOM 924 O ASP A 163 -0.369 -11.317 10.522 1.00 0.00 O ATOM 925 CB ASP A 163 1.522 -11.235 13.082 1.00 0.00 C ATOM 926 CG ASP A 163 1.953 -10.986 14.514 1.00 0.00 C ATOM 927 OD1 ASP A 163 1.752 -9.856 15.006 1.00 0.00 O ATOM 928 OD2 ASP A 163 2.490 -11.921 15.143 1.00 0.00 O ATOM 0 H ASP A 163 -0.867 -12.655 12.597 1.00 0.00 H new ATOM 0 HA ASP A 163 -0.135 -9.911 13.418 1.00 0.00 H new ATOM 0 HB2 ASP A 163 1.624 -12.296 12.854 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.189 -10.699 12.407 1.00 0.00 H new ATOM 933 N GLU A 164 0.050 -9.165 11.028 1.00 0.00 N ATOM 934 CA GLU A 164 -0.098 -8.699 9.654 1.00 0.00 C ATOM 935 C GLU A 164 0.747 -9.540 8.701 1.00 0.00 C ATOM 936 O GLU A 164 0.287 -9.930 7.629 1.00 0.00 O ATOM 937 CB GLU A 164 0.303 -7.227 9.546 1.00 0.00 C ATOM 938 CG GLU A 164 0.032 -6.622 8.178 1.00 0.00 C ATOM 939 CD GLU A 164 0.944 -5.450 7.868 1.00 0.00 C ATOM 940 OE1 GLU A 164 0.757 -4.375 8.475 1.00 0.00 O ATOM 941 OE2 GLU A 164 1.845 -5.609 7.018 1.00 0.00 O ATOM 0 H GLU A 164 0.274 -8.432 11.701 1.00 0.00 H new ATOM 0 HA GLU A 164 -1.146 -8.804 9.372 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.237 -6.655 10.300 1.00 0.00 H new ATOM 0 HB3 GLU A 164 1.365 -7.131 9.773 1.00 0.00 H new ATOM 0 HG2 GLU A 164 0.159 -7.389 7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -1.006 -6.293 8.129 1.00 0.00 H new ATOM 948 N GLN A 165 1.985 -9.812 9.101 1.00 0.00 N ATOM 949 CA GLN A 165 2.894 -10.605 8.282 1.00 0.00 C ATOM 950 C GLN A 165 2.143 -11.709 7.546 1.00 0.00 C ATOM 951 O GLN A 165 2.250 -11.840 6.327 1.00 0.00 O ATOM 952 CB GLN A 165 3.997 -11.213 9.150 1.00 0.00 C ATOM 953 CG GLN A 165 5.167 -11.763 8.350 1.00 0.00 C ATOM 954 CD GLN A 165 6.394 -12.010 9.206 1.00 0.00 C ATOM 955 OE1 GLN A 165 6.374 -12.842 10.114 1.00 0.00 O ATOM 956 NE2 GLN A 165 7.471 -11.288 8.920 1.00 0.00 N ATOM 0 H GLN A 165 2.381 -9.495 9.986 1.00 0.00 H new ATOM 0 HA GLN A 165 3.346 -9.944 7.542 1.00 0.00 H new ATOM 0 HB2 GLN A 165 4.365 -10.454 9.840 1.00 0.00 H new ATOM 0 HB3 GLN A 165 3.572 -12.014 9.754 1.00 0.00 H new ATOM 0 HG2 GLN A 165 4.869 -12.696 7.872 1.00 0.00 H new ATOM 0 HG3 GLN A 165 5.419 -11.063 7.554 1.00 0.00 H new ATOM 0 HE21 GLN A 165 7.443 -10.610 8.159 1.00 0.00 H new ATOM 0 HE22 GLN A 165 8.326 -11.412 9.462 1.00 0.00 H new ATOM 965 N SER A 166 1.381 -12.500 8.295 1.00 0.00 N ATOM 966 CA SER A 166 0.615 -13.596 7.714 1.00 0.00 C ATOM 967 C SER A 166 -0.127 -13.137 6.462 1.00 0.00 C ATOM 968 O SER A 166 0.029 -13.715 5.387 1.00 0.00 O ATOM 969 CB SER A 166 -0.380 -14.148 8.736 1.00 0.00 C ATOM 970 OG SER A 166 0.200 -14.217 10.027 1.00 0.00 O ATOM 0 H SER A 166 1.278 -12.402 9.305 1.00 0.00 H new ATOM 0 HA SER A 166 1.313 -14.385 7.433 1.00 0.00 H new ATOM 0 HB2 SER A 166 -1.266 -13.513 8.765 1.00 0.00 H new ATOM 0 HB3 SER A 166 -0.709 -15.141 8.428 1.00 0.00 H new ATOM 0 HG SER A 166 0.038 -13.376 10.504 1.00 0.00 H new ATOM 976 N VAL A 167 -0.935 -12.092 6.611 1.00 0.00 N ATOM 977 CA VAL A 167 -1.701 -11.553 5.494 1.00 0.00 C ATOM 978 C VAL A 167 -0.886 -11.579 4.205 1.00 0.00 C ATOM 979 O VAL A 167 -1.305 -12.162 3.206 1.00 0.00 O ATOM 980 CB VAL A 167 -2.157 -10.108 5.771 1.00 0.00 C ATOM 981 CG1 VAL A 167 -2.658 -9.452 4.494 1.00 0.00 C ATOM 982 CG2 VAL A 167 -3.230 -10.086 6.849 1.00 0.00 C ATOM 0 H VAL A 167 -1.076 -11.602 7.494 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.580 -12.187 5.378 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.301 -9.538 6.131 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -2.976 -8.432 4.709 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -1.856 -9.434 3.756 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -3.501 -10.019 4.100 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.541 -9.057 7.032 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.089 -10.671 6.520 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -2.831 -10.514 7.769 1.00 0.00 H new ATOM 992 N ASP A 168 0.280 -10.943 4.237 1.00 0.00 N ATOM 993 CA ASP A 168 1.156 -10.895 3.072 1.00 0.00 C ATOM 994 C ASP A 168 1.425 -12.297 2.536 1.00 0.00 C ATOM 995 O ASP A 168 1.127 -12.598 1.380 1.00 0.00 O ATOM 996 CB ASP A 168 2.475 -10.209 3.427 1.00 0.00 C ATOM 997 CG ASP A 168 3.486 -10.278 2.300 1.00 0.00 C ATOM 998 OD1 ASP A 168 3.310 -9.551 1.300 1.00 0.00 O ATOM 999 OD2 ASP A 168 4.453 -11.060 2.416 1.00 0.00 O ATOM 0 H ASP A 168 0.640 -10.454 5.056 1.00 0.00 H new ATOM 0 HA ASP A 168 0.654 -10.319 2.295 1.00 0.00 H new ATOM 0 HB2 ASP A 168 2.283 -9.165 3.675 1.00 0.00 H new ATOM 0 HB3 ASP A 168 2.896 -10.676 4.317 1.00 0.00 H new ATOM 1004 N GLN A 169 1.993 -13.150 3.383 1.00 0.00 N ATOM 1005 CA GLN A 169 2.304 -14.520 2.993 1.00 0.00 C ATOM 1006 C GLN A 169 1.198 -15.102 2.118 1.00 0.00 C ATOM 1007 O GLN A 169 1.467 -15.834 1.167 1.00 0.00 O ATOM 1008 CB GLN A 169 2.502 -15.393 4.233 1.00 0.00 C ATOM 1009 CG GLN A 169 3.858 -15.209 4.896 1.00 0.00 C ATOM 1010 CD GLN A 169 4.174 -16.307 5.893 1.00 0.00 C ATOM 1011 OE1 GLN A 169 3.273 -16.907 6.479 1.00 0.00 O ATOM 1012 NE2 GLN A 169 5.459 -16.575 6.091 1.00 0.00 N ATOM 0 H GLN A 169 2.247 -12.916 4.343 1.00 0.00 H new ATOM 0 HA GLN A 169 3.229 -14.506 2.416 1.00 0.00 H new ATOM 0 HB2 GLN A 169 1.719 -15.165 4.956 1.00 0.00 H new ATOM 0 HB3 GLN A 169 2.383 -16.440 3.953 1.00 0.00 H new ATOM 0 HG2 GLN A 169 4.633 -15.185 4.130 1.00 0.00 H new ATOM 0 HG3 GLN A 169 3.882 -14.245 5.403 1.00 0.00 H new ATOM 0 HE21 GLN A 169 6.173 -16.053 5.583 1.00 0.00 H new ATOM 0 HE22 GLN A 169 5.732 -17.303 6.751 1.00 0.00 H new ATOM 1021 N ALA A 170 -0.046 -14.771 2.448 1.00 0.00 N ATOM 1022 CA ALA A 170 -1.192 -15.259 1.692 1.00 0.00 C ATOM 1023 C ALA A 170 -1.361 -14.484 0.389 1.00 0.00 C ATOM 1024 O ALA A 170 -1.218 -15.041 -0.699 1.00 0.00 O ATOM 1025 CB ALA A 170 -2.457 -15.166 2.532 1.00 0.00 C ATOM 0 H ALA A 170 -0.286 -14.167 3.234 1.00 0.00 H new ATOM 0 HA ALA A 170 -1.012 -16.304 1.441 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -3.305 -15.534 1.955 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -2.341 -15.770 3.432 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.632 -14.127 2.812 1.00 0.00 H new ATOM 1031 N VAL A 171 -1.667 -13.196 0.508 1.00 0.00 N ATOM 1032 CA VAL A 171 -1.855 -12.344 -0.660 1.00 0.00 C ATOM 1033 C VAL A 171 -0.769 -12.592 -1.702 1.00 0.00 C ATOM 1034 O VAL A 171 -1.062 -12.896 -2.857 1.00 0.00 O ATOM 1035 CB VAL A 171 -1.850 -10.853 -0.274 1.00 0.00 C ATOM 1036 CG1 VAL A 171 -1.986 -9.981 -1.513 1.00 0.00 C ATOM 1037 CG2 VAL A 171 -2.961 -10.557 0.722 1.00 0.00 C ATOM 0 H VAL A 171 -1.790 -12.720 1.402 1.00 0.00 H new ATOM 0 HA VAL A 171 -2.826 -12.598 -1.084 1.00 0.00 H new ATOM 0 HB VAL A 171 -0.897 -10.621 0.201 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -1.981 -8.931 -1.221 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -1.152 -10.175 -2.187 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -2.923 -10.212 -2.019 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -2.943 -9.499 0.984 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -3.925 -10.804 0.276 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -2.813 -11.156 1.621 1.00 0.00 H new ATOM 1047 N ASN A 172 0.485 -12.461 -1.284 1.00 0.00 N ATOM 1048 CA ASN A 172 1.616 -12.671 -2.181 1.00 0.00 C ATOM 1049 C ASN A 172 1.310 -13.771 -3.193 1.00 0.00 C ATOM 1050 O ASN A 172 1.332 -13.540 -4.401 1.00 0.00 O ATOM 1051 CB ASN A 172 2.869 -13.032 -1.380 1.00 0.00 C ATOM 1052 CG ASN A 172 4.144 -12.593 -2.073 1.00 0.00 C ATOM 1053 OD1 ASN A 172 4.774 -11.612 -1.675 1.00 0.00 O ATOM 1054 ND2 ASN A 172 4.531 -13.318 -3.116 1.00 0.00 N ATOM 0 H ASN A 172 0.744 -12.210 -0.330 1.00 0.00 H new ATOM 0 HA ASN A 172 1.795 -11.743 -2.723 1.00 0.00 H new ATOM 0 HB2 ASN A 172 2.815 -12.566 -0.396 1.00 0.00 H new ATOM 0 HB3 ASN A 172 2.898 -14.110 -1.221 1.00 0.00 H new ATOM 0 HD21 ASN A 172 5.381 -13.070 -3.622 1.00 0.00 H new ATOM 0 HD22 ASN A 172 3.978 -14.123 -3.411 1.00 0.00 H new ATOM 1061 N MET A 173 1.026 -14.968 -2.690 1.00 0.00 N ATOM 1062 CA MET A 173 0.714 -16.103 -3.550 1.00 0.00 C ATOM 1063 C MET A 173 -0.587 -15.868 -4.311 1.00 0.00 C ATOM 1064 O MET A 173 -0.729 -16.284 -5.461 1.00 0.00 O ATOM 1065 CB MET A 173 0.608 -17.384 -2.720 1.00 0.00 C ATOM 1066 CG MET A 173 1.879 -17.720 -1.956 1.00 0.00 C ATOM 1067 SD MET A 173 1.580 -18.828 -0.565 1.00 0.00 S ATOM 1068 CE MET A 173 0.986 -20.287 -1.416 1.00 0.00 C ATOM 0 H MET A 173 1.006 -15.177 -1.692 1.00 0.00 H new ATOM 0 HA MET A 173 1.522 -16.212 -4.273 1.00 0.00 H new ATOM 0 HB2 MET A 173 -0.215 -17.282 -2.013 1.00 0.00 H new ATOM 0 HB3 MET A 173 0.360 -18.215 -3.380 1.00 0.00 H new ATOM 0 HG2 MET A 173 2.596 -18.181 -2.636 1.00 0.00 H new ATOM 0 HG3 MET A 173 2.333 -16.799 -1.591 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.842 -21.094 -0.697 1.00 0.00 H new ATOM 0 HE2 MET A 173 0.038 -20.062 -1.905 1.00 0.00 H new ATOM 0 HE3 MET A 173 1.716 -20.594 -2.165 1.00 0.00 H new ATOM 1078 N HIS A 174 -1.535 -15.199 -3.661 1.00 0.00 N ATOM 1079 CA HIS A 174 -2.824 -14.908 -4.278 1.00 0.00 C ATOM 1080 C HIS A 174 -3.486 -16.187 -4.782 1.00 0.00 C ATOM 1081 O HIS A 174 -4.273 -16.159 -5.729 1.00 0.00 O ATOM 1082 CB HIS A 174 -2.651 -13.920 -5.432 1.00 0.00 C ATOM 1083 CG HIS A 174 -3.933 -13.579 -6.126 1.00 0.00 C ATOM 1084 ND1 HIS A 174 -3.994 -13.198 -7.450 1.00 0.00 N ATOM 1085 CD2 HIS A 174 -5.208 -13.563 -5.673 1.00 0.00 C ATOM 1086 CE1 HIS A 174 -5.251 -12.962 -7.781 1.00 0.00 C ATOM 1087 NE2 HIS A 174 -6.008 -13.176 -6.720 1.00 0.00 N ATOM 0 H HIS A 174 -1.434 -14.849 -2.708 1.00 0.00 H new ATOM 0 HA HIS A 174 -3.468 -14.460 -3.521 1.00 0.00 H new ATOM 0 HB2 HIS A 174 -2.199 -13.004 -5.051 1.00 0.00 H new ATOM 0 HB3 HIS A 174 -1.955 -14.340 -6.158 1.00 0.00 H new ATOM 0 HD1 HIS A 174 -3.193 -13.112 -8.076 1.00 0.00 H new ATOM 0 HD2 HIS A 174 -5.536 -13.809 -4.674 1.00 0.00 H new ATOM 0 HE1 HIS A 174 -5.600 -12.648 -8.753 1.00 0.00 H new ATOM 1095 N PHE A 175 -3.161 -17.306 -4.144 1.00 0.00 N ATOM 1096 CA PHE A 175 -3.723 -18.596 -4.530 1.00 0.00 C ATOM 1097 C PHE A 175 -3.429 -19.655 -3.471 1.00 0.00 C ATOM 1098 O PHE A 175 -2.434 -19.570 -2.751 1.00 0.00 O ATOM 1099 CB PHE A 175 -3.158 -19.039 -5.881 1.00 0.00 C ATOM 1100 CG PHE A 175 -3.834 -18.390 -7.055 1.00 0.00 C ATOM 1101 CD1 PHE A 175 -5.216 -18.386 -7.160 1.00 0.00 C ATOM 1102 CD2 PHE A 175 -3.088 -17.784 -8.053 1.00 0.00 C ATOM 1103 CE1 PHE A 175 -5.840 -17.791 -8.240 1.00 0.00 C ATOM 1104 CE2 PHE A 175 -3.707 -17.187 -9.135 1.00 0.00 C ATOM 1105 CZ PHE A 175 -5.085 -17.189 -9.228 1.00 0.00 C ATOM 0 H PHE A 175 -2.512 -17.346 -3.358 1.00 0.00 H new ATOM 0 HA PHE A 175 -4.804 -18.483 -4.616 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -2.093 -18.810 -5.913 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -3.254 -20.121 -5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -5.812 -18.853 -6.390 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -2.010 -17.778 -7.985 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -6.918 -17.797 -8.312 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -3.114 -16.719 -9.907 1.00 0.00 H new ATOM 0 HZ PHE A 175 -5.571 -16.721 -10.071 1.00 0.00 H new ATOM 1115 N HIS A 176 -4.303 -20.652 -3.382 1.00 0.00 N ATOM 1116 CA HIS A 176 -4.139 -21.729 -2.411 1.00 0.00 C ATOM 1117 C HIS A 176 -4.944 -22.958 -2.822 1.00 0.00 C ATOM 1118 O HIS A 176 -6.009 -22.840 -3.428 1.00 0.00 O ATOM 1119 CB HIS A 176 -4.572 -21.262 -1.021 1.00 0.00 C ATOM 1120 CG HIS A 176 -3.875 -20.017 -0.564 1.00 0.00 C ATOM 1121 ND1 HIS A 176 -4.273 -18.723 -0.581 1.00 0.00 N flip ATOM 1122 CD2 HIS A 176 -2.612 -20.021 -0.012 1.00 0.00 C flip ATOM 1123 CE1 HIS A 176 -3.253 -17.977 -0.043 1.00 0.00 C flip ATOM 1124 NE2 HIS A 176 -2.263 -18.784 0.293 1.00 0.00 N flip ATOM 0 H HIS A 176 -5.132 -20.737 -3.970 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.084 -22.001 -2.382 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.648 -21.086 -1.024 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.382 -22.060 -0.303 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -2.003 -20.899 0.146 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -3.259 -16.905 0.085 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -1.379 -18.500 0.716 1.00 0.00 H new ATOM 1132 N ASP A 177 -4.428 -24.136 -2.488 1.00 0.00 N ATOM 1133 CA ASP A 177 -5.099 -25.387 -2.821 1.00 0.00 C ATOM 1134 C ASP A 177 -5.779 -25.983 -1.592 1.00 0.00 C ATOM 1135 O ASP A 177 -5.134 -26.626 -0.764 1.00 0.00 O ATOM 1136 CB ASP A 177 -4.099 -26.388 -3.402 1.00 0.00 C ATOM 1137 CG ASP A 177 -3.429 -25.873 -4.660 1.00 0.00 C ATOM 1138 OD1 ASP A 177 -2.387 -25.195 -4.542 1.00 0.00 O ATOM 1139 OD2 ASP A 177 -3.947 -26.148 -5.763 1.00 0.00 O ATOM 0 H ASP A 177 -3.547 -24.251 -1.987 1.00 0.00 H new ATOM 0 HA ASP A 177 -5.863 -25.173 -3.569 1.00 0.00 H new ATOM 0 HB2 ASP A 177 -3.338 -26.612 -2.654 1.00 0.00 H new ATOM 0 HB3 ASP A 177 -4.613 -27.323 -3.624 1.00 0.00 H new ATOM 1144 N ILE A 178 -7.085 -25.764 -1.481 1.00 0.00 N ATOM 1145 CA ILE A 178 -7.852 -26.279 -0.354 1.00 0.00 C ATOM 1146 C ILE A 178 -8.969 -27.204 -0.825 1.00 0.00 C ATOM 1147 O ILE A 178 -9.804 -26.818 -1.643 1.00 0.00 O ATOM 1148 CB ILE A 178 -8.464 -25.138 0.480 1.00 0.00 C ATOM 1149 CG1 ILE A 178 -7.372 -24.169 0.938 1.00 0.00 C ATOM 1150 CG2 ILE A 178 -9.217 -25.700 1.676 1.00 0.00 C ATOM 1151 CD1 ILE A 178 -7.910 -22.860 1.472 1.00 0.00 C ATOM 0 H ILE A 178 -7.634 -25.234 -2.158 1.00 0.00 H new ATOM 0 HA ILE A 178 -7.156 -26.841 0.269 1.00 0.00 H new ATOM 0 HB ILE A 178 -9.170 -24.591 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -6.773 -24.649 1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -6.705 -23.964 0.100 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -9.643 -24.881 2.255 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -10.017 -26.353 1.328 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.531 -26.269 2.303 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -7.080 -22.223 1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -8.485 -22.358 0.694 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -8.554 -23.054 2.330 1.00 0.00 H new ATOM 1163 N MET A 179 -8.977 -28.426 -0.304 1.00 0.00 N ATOM 1164 CA MET A 179 -9.994 -29.406 -0.669 1.00 0.00 C ATOM 1165 C MET A 179 -10.006 -29.639 -2.177 1.00 0.00 C ATOM 1166 O MET A 179 -11.060 -29.864 -2.771 1.00 0.00 O ATOM 1167 CB MET A 179 -11.374 -28.939 -0.202 1.00 0.00 C ATOM 1168 CG MET A 179 -11.565 -29.018 1.304 1.00 0.00 C ATOM 1169 SD MET A 179 -11.778 -30.710 1.889 1.00 0.00 S ATOM 1170 CE MET A 179 -12.968 -30.465 3.206 1.00 0.00 C ATOM 0 H MET A 179 -8.291 -28.762 0.372 1.00 0.00 H new ATOM 0 HA MET A 179 -9.751 -30.347 -0.175 1.00 0.00 H new ATOM 0 HB2 MET A 179 -11.529 -27.910 -0.526 1.00 0.00 H new ATOM 0 HB3 MET A 179 -12.138 -29.545 -0.689 1.00 0.00 H new ATOM 0 HG2 MET A 179 -10.703 -28.572 1.800 1.00 0.00 H new ATOM 0 HG3 MET A 179 -12.436 -28.427 1.587 1.00 0.00 H new ATOM 0 HE1 MET A 179 -13.748 -31.224 3.138 1.00 0.00 H new ATOM 0 HE2 MET A 179 -12.466 -30.546 4.170 1.00 0.00 H new ATOM 0 HE3 MET A 179 -13.416 -29.476 3.112 1.00 0.00 H new ATOM 1180 N GLY A 180 -8.828 -29.584 -2.790 1.00 0.00 N ATOM 1181 CA GLY A 180 -8.726 -29.791 -4.222 1.00 0.00 C ATOM 1182 C GLY A 180 -9.384 -28.680 -5.017 1.00 0.00 C ATOM 1183 O GLY A 180 -10.168 -28.940 -5.930 1.00 0.00 O ATOM 0 H GLY A 180 -7.942 -29.400 -2.320 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -7.675 -29.860 -4.502 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -9.189 -30.743 -4.482 1.00 0.00 H new ATOM 1187 N LYS A 181 -9.066 -27.438 -4.669 1.00 0.00 N ATOM 1188 CA LYS A 181 -9.631 -26.282 -5.355 1.00 0.00 C ATOM 1189 C LYS A 181 -8.788 -25.036 -5.106 1.00 0.00 C ATOM 1190 O LYS A 181 -8.154 -24.901 -4.059 1.00 0.00 O ATOM 1191 CB LYS A 181 -11.068 -26.040 -4.890 1.00 0.00 C ATOM 1192 CG LYS A 181 -11.951 -25.401 -5.948 1.00 0.00 C ATOM 1193 CD LYS A 181 -11.902 -23.884 -5.873 1.00 0.00 C ATOM 1194 CE LYS A 181 -13.051 -23.251 -6.643 1.00 0.00 C ATOM 1195 NZ LYS A 181 -12.990 -23.574 -8.095 1.00 0.00 N ATOM 0 H LYS A 181 -8.419 -27.206 -3.915 1.00 0.00 H new ATOM 0 HA LYS A 181 -9.632 -26.490 -6.425 1.00 0.00 H new ATOM 0 HB2 LYS A 181 -11.508 -26.990 -4.587 1.00 0.00 H new ATOM 0 HB3 LYS A 181 -11.052 -25.401 -4.007 1.00 0.00 H new ATOM 0 HG2 LYS A 181 -11.630 -25.728 -6.937 1.00 0.00 H new ATOM 0 HG3 LYS A 181 -12.979 -25.740 -5.818 1.00 0.00 H new ATOM 0 HD2 LYS A 181 -11.944 -23.569 -4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 181 -10.953 -23.529 -6.276 1.00 0.00 H new ATOM 0 HE2 LYS A 181 -13.999 -23.600 -6.233 1.00 0.00 H new ATOM 0 HE3 LYS A 181 -13.025 -22.169 -6.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 -13.770 -23.097 -8.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 -12.082 -23.249 -8.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 -13.075 -24.602 -8.226 1.00 0.00 H new ATOM 1209 N LYS A 182 -8.785 -24.126 -6.074 1.00 0.00 N ATOM 1210 CA LYS A 182 -8.022 -22.889 -5.960 1.00 0.00 C ATOM 1211 C LYS A 182 -8.799 -21.842 -5.168 1.00 0.00 C ATOM 1212 O LYS A 182 -9.946 -21.530 -5.489 1.00 0.00 O ATOM 1213 CB LYS A 182 -7.683 -22.344 -7.350 1.00 0.00 C ATOM 1214 CG LYS A 182 -6.436 -21.478 -7.376 1.00 0.00 C ATOM 1215 CD LYS A 182 -5.176 -22.319 -7.509 1.00 0.00 C ATOM 1216 CE LYS A 182 -4.873 -22.641 -8.964 1.00 0.00 C ATOM 1217 NZ LYS A 182 -5.814 -23.655 -9.515 1.00 0.00 N ATOM 0 H LYS A 182 -9.303 -24.222 -6.947 1.00 0.00 H new ATOM 0 HA LYS A 182 -7.097 -23.110 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 182 -7.549 -23.180 -8.036 1.00 0.00 H new ATOM 0 HB3 LYS A 182 -8.527 -21.762 -7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 182 -6.496 -20.777 -8.208 1.00 0.00 H new ATOM 0 HG3 LYS A 182 -6.384 -20.885 -6.463 1.00 0.00 H new ATOM 0 HD2 LYS A 182 -4.333 -21.785 -7.070 1.00 0.00 H new ATOM 0 HD3 LYS A 182 -5.294 -23.245 -6.947 1.00 0.00 H new ATOM 0 HE2 LYS A 182 -4.933 -21.729 -9.558 1.00 0.00 H new ATOM 0 HE3 LYS A 182 -3.851 -23.010 -9.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 -5.350 -24.177 -10.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 -6.089 -24.319 -8.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 -6.662 -23.178 -9.883 1.00 0.00 H new ATOM 1231 N VAL A 183 -8.166 -21.301 -4.132 1.00 0.00 N ATOM 1232 CA VAL A 183 -8.797 -20.287 -3.295 1.00 0.00 C ATOM 1233 C VAL A 183 -8.084 -18.946 -3.425 1.00 0.00 C ATOM 1234 O VAL A 183 -6.949 -18.790 -2.974 1.00 0.00 O ATOM 1235 CB VAL A 183 -8.809 -20.709 -1.814 1.00 0.00 C ATOM 1236 CG1 VAL A 183 -9.763 -19.832 -1.016 1.00 0.00 C ATOM 1237 CG2 VAL A 183 -9.184 -22.177 -1.682 1.00 0.00 C ATOM 0 H VAL A 183 -7.217 -21.548 -3.852 1.00 0.00 H new ATOM 0 HA VAL A 183 -9.825 -20.184 -3.643 1.00 0.00 H new ATOM 0 HB VAL A 183 -7.806 -20.576 -1.408 1.00 0.00 H new ATOM 0 HG11 VAL A 183 -9.758 -20.145 0.028 1.00 0.00 H new ATOM 0 HG12 VAL A 183 -9.444 -18.792 -1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 183 -10.771 -19.930 -1.419 1.00 0.00 H new ATOM 0 HG21 VAL A 183 -9.188 -22.458 -0.629 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -10.176 -22.339 -2.104 1.00 0.00 H new ATOM 0 HG23 VAL A 183 -8.458 -22.788 -2.218 1.00 0.00 H new ATOM 1247 N GLU A 184 -8.757 -17.980 -4.043 1.00 0.00 N ATOM 1248 CA GLU A 184 -8.186 -16.652 -4.232 1.00 0.00 C ATOM 1249 C GLU A 184 -8.105 -15.901 -2.906 1.00 0.00 C ATOM 1250 O GLU A 184 -8.981 -16.033 -2.050 1.00 0.00 O ATOM 1251 CB GLU A 184 -9.022 -15.851 -5.233 1.00 0.00 C ATOM 1252 CG GLU A 184 -8.218 -14.822 -6.010 1.00 0.00 C ATOM 1253 CD GLU A 184 -9.018 -14.179 -7.127 1.00 0.00 C ATOM 1254 OE1 GLU A 184 -10.180 -13.796 -6.879 1.00 0.00 O ATOM 1255 OE2 GLU A 184 -8.481 -14.059 -8.248 1.00 0.00 O ATOM 0 H GLU A 184 -9.698 -18.093 -4.421 1.00 0.00 H new ATOM 0 HA GLU A 184 -7.176 -16.771 -4.625 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.491 -16.540 -5.936 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.826 -15.344 -4.699 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -7.868 -14.048 -5.327 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -7.333 -15.300 -6.430 1.00 0.00 H new ATOM 1262 N VAL A 185 -7.047 -15.114 -2.742 1.00 0.00 N ATOM 1263 CA VAL A 185 -6.850 -14.341 -1.522 1.00 0.00 C ATOM 1264 C VAL A 185 -6.233 -12.981 -1.826 1.00 0.00 C ATOM 1265 O VAL A 185 -5.243 -12.884 -2.551 1.00 0.00 O ATOM 1266 CB VAL A 185 -5.948 -15.090 -0.522 1.00 0.00 C ATOM 1267 CG1 VAL A 185 -5.482 -14.154 0.582 1.00 0.00 C ATOM 1268 CG2 VAL A 185 -6.680 -16.291 0.058 1.00 0.00 C ATOM 0 H VAL A 185 -6.312 -14.995 -3.440 1.00 0.00 H new ATOM 0 HA VAL A 185 -7.834 -14.198 -1.076 1.00 0.00 H new ATOM 0 HB VAL A 185 -5.067 -15.452 -1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 185 -4.846 -14.701 1.278 1.00 0.00 H new ATOM 0 HG12 VAL A 185 -4.918 -13.330 0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 185 -6.348 -13.760 1.114 1.00 0.00 H new ATOM 0 HG21 VAL A 185 -6.029 -16.809 0.762 1.00 0.00 H new ATOM 0 HG22 VAL A 185 -7.579 -15.955 0.575 1.00 0.00 H new ATOM 0 HG23 VAL A 185 -6.958 -16.971 -0.747 1.00 0.00 H new ATOM 1278 N LYS A 186 -6.824 -11.931 -1.266 1.00 0.00 N ATOM 1279 CA LYS A 186 -6.332 -10.574 -1.474 1.00 0.00 C ATOM 1280 C LYS A 186 -6.530 -9.725 -0.223 1.00 0.00 C ATOM 1281 O LYS A 186 -7.524 -9.873 0.488 1.00 0.00 O ATOM 1282 CB LYS A 186 -7.049 -9.926 -2.661 1.00 0.00 C ATOM 1283 CG LYS A 186 -6.732 -10.581 -3.994 1.00 0.00 C ATOM 1284 CD LYS A 186 -5.444 -10.037 -4.591 1.00 0.00 C ATOM 1285 CE LYS A 186 -5.670 -8.699 -5.277 1.00 0.00 C ATOM 1286 NZ LYS A 186 -4.415 -7.902 -5.366 1.00 0.00 N ATOM 0 H LYS A 186 -7.645 -11.994 -0.664 1.00 0.00 H new ATOM 0 HA LYS A 186 -5.265 -10.631 -1.688 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -8.125 -9.968 -2.492 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -6.775 -8.872 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -6.645 -11.659 -3.859 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -7.555 -10.412 -4.688 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -4.697 -9.923 -3.805 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -5.044 -10.753 -5.309 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -6.065 -8.867 -6.279 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -6.422 -8.132 -4.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -4.611 -6.997 -5.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -4.051 -7.720 -4.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -3.705 -8.432 -5.911 1.00 0.00 H new ATOM 1300 N ARG A 187 -5.578 -8.835 0.040 1.00 0.00 N ATOM 1301 CA ARG A 187 -5.649 -7.962 1.206 1.00 0.00 C ATOM 1302 C ARG A 187 -7.023 -7.308 1.312 1.00 0.00 C ATOM 1303 O ARG A 187 -7.491 -6.669 0.371 1.00 0.00 O ATOM 1304 CB ARG A 187 -4.564 -6.887 1.130 1.00 0.00 C ATOM 1305 CG ARG A 187 -3.252 -7.298 1.780 1.00 0.00 C ATOM 1306 CD ARG A 187 -2.477 -6.090 2.282 1.00 0.00 C ATOM 1307 NE ARG A 187 -3.182 -5.393 3.355 1.00 0.00 N ATOM 1308 CZ ARG A 187 -2.627 -4.449 4.106 1.00 0.00 C ATOM 1309 NH1 ARG A 187 -1.368 -4.089 3.903 1.00 0.00 N ATOM 1310 NH2 ARG A 187 -3.334 -3.861 5.064 1.00 0.00 N ATOM 0 H ARG A 187 -4.749 -8.700 -0.538 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.486 -8.570 2.096 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -4.380 -6.642 0.084 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -4.929 -5.980 1.611 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -3.453 -7.974 2.611 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -2.645 -7.848 1.061 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -1.499 -6.410 2.640 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -2.304 -5.401 1.455 1.00 0.00 H new ATOM 0 HE ARG A 187 -4.153 -5.645 3.537 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -0.822 -4.537 3.168 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -0.945 -3.363 4.482 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -4.304 -4.134 5.223 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -2.907 -3.136 5.641 1.00 0.00 H new ATOM 1324 N ALA A 188 -7.663 -7.472 2.465 1.00 0.00 N ATOM 1325 CA ALA A 188 -8.982 -6.896 2.695 1.00 0.00 C ATOM 1326 C ALA A 188 -8.876 -5.441 3.140 1.00 0.00 C ATOM 1327 O ALA A 188 -7.778 -4.898 3.258 1.00 0.00 O ATOM 1328 CB ALA A 188 -9.741 -7.713 3.730 1.00 0.00 C ATOM 0 H ALA A 188 -7.289 -7.999 3.254 1.00 0.00 H new ATOM 0 HA ALA A 188 -9.532 -6.921 1.754 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -10.724 -7.272 3.892 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -9.857 -8.736 3.372 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -9.186 -7.717 4.668 1.00 0.00 H new