USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 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 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 77 LYS NZ :NH3+ -154:sc= 0.102 (180deg=-0.0233) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.714 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.1 X(o=-2.1,f=-1.8) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.0109 USER MOD Single : A 31 MET CE :methyl -157:sc= -1.44 (180deg=-2.07!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= -2.59! C(o=-2.6!,f=-9.6!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.0211 X(o=-0.021,f=-0.033) USER MOD Single : A 59 SER OG : rot 103:sc= 1.12 USER MOD Single : A 63 GLN : amide:sc= -0.0665 X(o=-0.066,f=-0.56) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -7:sc= 1.72 USER MOD Single : A 78 SER OG : rot 17:sc= 0.175 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.291 K(o=-0.29,f=-2.4!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.753 K(o=-0.75,f=-3.5!) USER MOD Single : A 110 GLN : amide:sc=-0.00718 X(o=-0.0072,f=-0.16) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -135:sc= -2.78 (180deg=-3.34!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -3.64! C(o=-3.6!,f=-13!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= 0 USER MOD Single : A 126 CYS SG : rot 36:sc= -3.05! USER MOD Single : A 127 ASN : amide:sc= -0.449 K(o=-0.45,f=-2.3!) USER MOD Single : A 135 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.132) USER MOD Single : A 136 ASN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 137 LYS NZ :NH3+ -149:sc= -0.247 (180deg=-1.08!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0896 USER MOD Single : A 144 MET CE :methyl -167:sc= 0 (180deg=-0.35) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 CYS SG : rot -115:sc= 1.36 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.084 -9.673 10.702 1.00 0.00 N ATOM 88 CA ASP A 9 -8.033 -8.637 11.094 1.00 0.00 C ATOM 89 C ASP A 9 -8.827 -8.144 9.888 1.00 0.00 C ATOM 90 O ASP A 9 -8.481 -7.135 9.276 1.00 0.00 O ATOM 91 CB ASP A 9 -7.298 -7.466 11.752 1.00 0.00 C ATOM 92 CG ASP A 9 -7.481 -7.445 13.257 1.00 0.00 C ATOM 93 OD1 ASP A 9 -8.600 -7.745 13.724 1.00 0.00 O ATOM 94 OD2 ASP A 9 -6.505 -7.128 13.969 1.00 0.00 O ATOM 0 HA ASP A 9 -8.730 -9.068 11.813 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.235 -7.529 11.518 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.662 -6.529 11.331 1.00 0.00 H new ATOM 99 N ILE A 10 -9.893 -8.864 9.555 1.00 0.00 N ATOM 100 CA ILE A 10 -10.737 -8.500 8.423 1.00 0.00 C ATOM 101 C ILE A 10 -11.693 -7.370 8.793 1.00 0.00 C ATOM 102 O ILE A 10 -12.526 -7.515 9.689 1.00 0.00 O ATOM 103 CB ILE A 10 -11.550 -9.708 7.916 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.341 -9.332 6.662 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.483 -10.218 9.005 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.634 -10.509 5.757 1.00 0.00 C ATOM 0 H ILE A 10 -10.193 -9.702 10.053 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.073 -8.163 7.627 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.856 -10.508 7.657 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.282 -8.870 6.961 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.783 -8.583 6.101 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -13.049 -11.071 8.629 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.897 -10.524 9.872 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.172 -9.425 9.295 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -13.197 -10.169 4.888 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.696 -10.958 5.429 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.219 -11.250 6.302 1.00 0.00 H new ATOM 118 N VAL A 11 -11.567 -6.243 8.099 1.00 0.00 N ATOM 119 CA VAL A 11 -12.420 -5.089 8.354 1.00 0.00 C ATOM 120 C VAL A 11 -13.437 -4.900 7.235 1.00 0.00 C ATOM 121 O VAL A 11 -13.092 -4.474 6.132 1.00 0.00 O ATOM 122 CB VAL A 11 -11.590 -3.800 8.501 1.00 0.00 C ATOM 123 CG1 VAL A 11 -12.469 -2.647 8.961 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.432 -4.016 9.464 1.00 0.00 C ATOM 0 H VAL A 11 -10.882 -6.105 7.356 1.00 0.00 H new ATOM 0 HA VAL A 11 -12.945 -5.283 9.289 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.177 -3.543 7.525 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.865 -1.745 9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.258 -2.477 8.229 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.915 -2.892 9.925 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.857 -3.094 9.555 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -10.820 -4.299 10.442 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.787 -4.810 9.086 1.00 0.00 H new ATOM 134 N GLY A 12 -14.695 -5.221 7.524 1.00 0.00 N ATOM 135 CA GLY A 12 -15.743 -5.079 6.532 1.00 0.00 C ATOM 136 C GLY A 12 -15.525 -5.973 5.326 1.00 0.00 C ATOM 137 O GLY A 12 -16.081 -7.067 5.247 1.00 0.00 O ATOM 0 H GLY A 12 -15.006 -5.577 8.428 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.705 -5.316 6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -15.792 -4.040 6.206 1.00 0.00 H new ATOM 141 N ILE A 13 -14.712 -5.504 4.385 1.00 0.00 N ATOM 142 CA ILE A 13 -14.421 -6.267 3.177 1.00 0.00 C ATOM 143 C ILE A 13 -12.957 -6.122 2.777 1.00 0.00 C ATOM 144 O ILE A 13 -12.620 -6.162 1.592 1.00 0.00 O ATOM 145 CB ILE A 13 -15.311 -5.822 1.999 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.346 -4.295 1.902 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.716 -6.383 2.158 1.00 0.00 C ATOM 148 CD1 ILE A 13 -14.994 -3.770 0.526 1.00 0.00 C ATOM 0 H ILE A 13 -14.243 -4.600 4.436 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.632 -7.312 3.405 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.887 -6.213 1.074 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.342 -3.944 2.172 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.652 -3.876 2.631 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.333 -6.061 1.319 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.673 -7.472 2.180 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.150 -6.019 3.089 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.039 -2.681 0.530 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -13.987 -4.091 0.261 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.703 -4.160 -0.204 1.00 0.00 H new ATOM 160 N TRP A 14 -12.090 -5.954 3.770 1.00 0.00 N ATOM 161 CA TRP A 14 -10.661 -5.804 3.522 1.00 0.00 C ATOM 162 C TRP A 14 -9.847 -6.624 4.517 1.00 0.00 C ATOM 163 O TRP A 14 -9.897 -6.382 5.723 1.00 0.00 O ATOM 164 CB TRP A 14 -10.260 -4.330 3.607 1.00 0.00 C ATOM 165 CG TRP A 14 -11.051 -3.446 2.693 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.325 -2.997 2.887 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.618 -2.901 1.440 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.713 -2.208 1.832 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.682 -2.134 0.931 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.436 -2.988 0.701 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.598 -1.458 -0.284 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.354 -2.318 -0.504 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.428 -1.561 -0.987 1.00 0.00 C ATOM 0 H TRP A 14 -12.353 -5.918 4.755 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.451 -6.173 2.518 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.386 -3.985 4.633 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.201 -4.234 3.367 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -12.939 -3.228 3.745 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.620 -1.752 1.735 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.601 -3.569 1.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.426 -0.874 -0.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.445 -2.379 -1.084 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.332 -1.048 -1.933 1.00 0.00 H new ATOM 184 N TRP A 15 -9.097 -7.595 4.005 1.00 0.00 N ATOM 185 CA TRP A 15 -8.273 -8.450 4.851 1.00 0.00 C ATOM 186 C TRP A 15 -6.805 -8.042 4.769 1.00 0.00 C ATOM 187 O TRP A 15 -6.245 -7.912 3.680 1.00 0.00 O ATOM 188 CB TRP A 15 -8.431 -9.915 4.439 1.00 0.00 C ATOM 189 CG TRP A 15 -8.138 -10.160 2.990 1.00 0.00 C ATOM 190 CD1 TRP A 15 -8.997 -10.000 1.941 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.899 -10.613 2.431 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.369 -10.326 0.763 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.081 -10.704 1.037 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.655 -10.949 2.972 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.063 -11.117 0.180 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.646 -11.358 2.119 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.856 -11.439 0.737 1.00 0.00 C ATOM 0 H TRP A 15 -9.043 -7.809 3.009 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.608 -8.332 5.881 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.766 -10.529 5.046 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.449 -10.238 4.656 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.021 -9.666 2.025 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.793 -10.292 -0.164 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.485 -10.890 4.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.221 -11.181 -0.886 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.680 -11.619 2.526 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.048 -11.762 0.098 1.00 0.00 H new ATOM 208 N THR A 16 -6.187 -7.842 5.929 1.00 0.00 N ATOM 209 CA THR A 16 -4.784 -7.449 5.990 1.00 0.00 C ATOM 210 C THR A 16 -3.895 -8.501 5.335 1.00 0.00 C ATOM 211 O THR A 16 -4.085 -9.700 5.534 1.00 0.00 O ATOM 212 CB THR A 16 -4.356 -7.236 7.442 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.224 -6.323 8.092 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.945 -6.705 7.579 1.00 0.00 C ATOM 0 H THR A 16 -6.636 -7.946 6.839 1.00 0.00 H new ATOM 0 HA THR A 16 -4.671 -6.513 5.444 1.00 0.00 H new ATOM 0 HB THR A 16 -4.402 -8.222 7.904 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.935 -6.201 9.020 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.705 -6.577 8.635 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.246 -7.411 7.131 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.867 -5.744 7.070 1.00 0.00 H new ATOM 222 N VAL A 17 -2.924 -8.043 4.552 1.00 0.00 N ATOM 223 CA VAL A 17 -2.004 -8.944 3.869 1.00 0.00 C ATOM 224 C VAL A 17 -0.958 -9.496 4.829 1.00 0.00 C ATOM 225 O VAL A 17 -0.817 -9.013 5.953 1.00 0.00 O ATOM 226 CB VAL A 17 -1.290 -8.238 2.700 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.257 -7.989 1.554 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.660 -6.936 3.170 1.00 0.00 C ATOM 0 H VAL A 17 -2.754 -7.053 4.375 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.602 -9.767 3.477 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.495 -8.889 2.336 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.734 -7.490 0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.656 -8.940 1.201 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.076 -7.358 1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.160 -6.450 2.332 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.435 -6.277 3.561 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.067 -7.146 3.954 1.00 0.00 H new ATOM 238 N SER A 18 -0.225 -10.511 4.380 1.00 0.00 N ATOM 239 CA SER A 18 0.811 -11.129 5.200 1.00 0.00 C ATOM 240 C SER A 18 2.179 -10.995 4.542 1.00 0.00 C ATOM 241 O SER A 18 3.177 -10.726 5.210 1.00 0.00 O ATOM 242 CB SER A 18 0.489 -12.606 5.438 1.00 0.00 C ATOM 243 OG SER A 18 -0.576 -12.755 6.360 1.00 0.00 O ATOM 0 H SER A 18 -0.330 -10.923 3.453 1.00 0.00 H new ATOM 0 HA SER A 18 0.837 -10.611 6.158 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.225 -13.080 4.493 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.374 -13.118 5.815 1.00 0.00 H new ATOM 0 HG SER A 18 -0.763 -13.708 6.493 1.00 0.00 H new ATOM 249 N ASN A 19 2.219 -11.185 3.227 1.00 0.00 N ATOM 250 CA ASN A 19 3.467 -11.088 2.476 1.00 0.00 C ATOM 251 C ASN A 19 3.275 -10.269 1.204 1.00 0.00 C ATOM 252 O ASN A 19 2.159 -9.865 0.875 1.00 0.00 O ATOM 253 CB ASN A 19 3.989 -12.483 2.126 1.00 0.00 C ATOM 254 CG ASN A 19 2.884 -13.431 1.700 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.209 -14.030 2.536 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.693 -13.570 0.393 1.00 0.00 N ATOM 0 H ASN A 19 1.402 -11.407 2.659 1.00 0.00 H new ATOM 0 HA ASN A 19 4.200 -10.582 3.105 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.722 -12.402 1.323 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.507 -12.900 2.990 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.963 -14.193 0.048 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.276 -13.054 -0.265 1.00 0.00 H new ATOM 263 N PHE A 20 4.371 -10.027 0.491 1.00 0.00 N ATOM 264 CA PHE A 20 4.326 -9.256 -0.746 1.00 0.00 C ATOM 265 C PHE A 20 3.398 -9.913 -1.763 1.00 0.00 C ATOM 266 O PHE A 20 2.596 -9.241 -2.413 1.00 0.00 O ATOM 267 CB PHE A 20 5.730 -9.116 -1.336 1.00 0.00 C ATOM 268 CG PHE A 20 5.794 -8.211 -2.534 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.995 -6.848 -2.378 1.00 0.00 C ATOM 270 CD2 PHE A 20 5.652 -8.722 -3.813 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.055 -6.013 -3.478 1.00 0.00 C ATOM 272 CE2 PHE A 20 5.711 -7.891 -4.917 1.00 0.00 C ATOM 273 CZ PHE A 20 5.913 -6.535 -4.749 1.00 0.00 C ATOM 0 H PHE A 20 5.302 -10.354 0.749 1.00 0.00 H new ATOM 0 HA PHE A 20 3.937 -8.265 -0.513 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.401 -8.734 -0.567 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.096 -10.103 -1.617 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.106 -6.434 -1.387 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.493 -9.781 -3.950 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.213 -4.953 -3.344 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.599 -8.302 -5.909 1.00 0.00 H new ATOM 0 HZ PHE A 20 5.960 -5.884 -5.610 1.00 0.00 H new ATOM 283 N GLY A 21 3.515 -11.231 -1.898 1.00 0.00 N ATOM 284 CA GLY A 21 2.681 -11.958 -2.838 1.00 0.00 C ATOM 285 C GLY A 21 1.199 -11.738 -2.597 1.00 0.00 C ATOM 286 O GLY A 21 0.392 -11.844 -3.520 1.00 0.00 O ATOM 0 H GLY A 21 4.172 -11.808 -1.373 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.930 -11.648 -3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.903 -13.023 -2.766 1.00 0.00 H new ATOM 290 N GLU A 22 0.842 -11.432 -1.354 1.00 0.00 N ATOM 291 CA GLU A 22 -0.552 -11.198 -0.996 1.00 0.00 C ATOM 292 C GLU A 22 -1.054 -9.888 -1.595 1.00 0.00 C ATOM 293 O GLU A 22 -2.195 -9.797 -2.049 1.00 0.00 O ATOM 294 CB GLU A 22 -0.713 -11.172 0.525 1.00 0.00 C ATOM 295 CG GLU A 22 -0.487 -12.523 1.183 1.00 0.00 C ATOM 296 CD GLU A 22 -1.362 -13.612 0.593 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.536 -13.717 1.003 1.00 0.00 O ATOM 298 OE2 GLU A 22 -0.872 -14.359 -0.281 1.00 0.00 O ATOM 0 H GLU A 22 1.498 -11.340 -0.578 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.148 -12.015 -1.403 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.011 -10.451 0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.715 -10.821 0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.560 -12.805 1.075 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.686 -12.441 2.251 1.00 0.00 H new ATOM 305 N ILE A 23 -0.194 -8.874 -1.594 1.00 0.00 N ATOM 306 CA ILE A 23 -0.548 -7.570 -2.138 1.00 0.00 C ATOM 307 C ILE A 23 -0.595 -7.605 -3.662 1.00 0.00 C ATOM 308 O ILE A 23 0.418 -7.846 -4.318 1.00 0.00 O ATOM 309 CB ILE A 23 0.450 -6.484 -1.690 1.00 0.00 C ATOM 310 CG1 ILE A 23 0.648 -6.536 -0.174 1.00 0.00 C ATOM 311 CG2 ILE A 23 -0.036 -5.108 -2.119 1.00 0.00 C ATOM 312 CD1 ILE A 23 1.720 -5.594 0.327 1.00 0.00 C ATOM 0 H ILE A 23 0.754 -8.932 -1.222 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.537 -7.324 -1.752 1.00 0.00 H new ATOM 0 HB ILE A 23 1.410 -6.674 -2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -0.295 -6.294 0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.906 -7.555 0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.680 -4.352 -1.795 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.130 -5.077 -3.205 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.006 -4.907 -1.665 1.00 0.00 H new ATOM 0 HD11 ILE A 23 1.806 -5.684 1.410 1.00 0.00 H new ATOM 0 HD12 ILE A 23 2.674 -5.849 -0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.454 -4.569 0.068 1.00 0.00 H new ATOM 324 N SER A 24 -1.778 -7.363 -4.218 1.00 0.00 N ATOM 325 CA SER A 24 -1.955 -7.368 -5.665 1.00 0.00 C ATOM 326 C SER A 24 -3.324 -6.813 -6.048 1.00 0.00 C ATOM 327 O SER A 24 -4.356 -7.400 -5.720 1.00 0.00 O ATOM 328 CB SER A 24 -1.795 -8.786 -6.215 1.00 0.00 C ATOM 329 OG SER A 24 -1.247 -8.768 -7.522 1.00 0.00 O ATOM 0 H SER A 24 -2.627 -7.161 -3.689 1.00 0.00 H new ATOM 0 HA SER A 24 -1.188 -6.728 -6.101 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.149 -9.365 -5.555 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.764 -9.285 -6.231 1.00 0.00 H new ATOM 0 HG SER A 24 -1.153 -9.687 -7.850 1.00 0.00 H new ATOM 335 N GLY A 25 -3.325 -5.682 -6.743 1.00 0.00 N ATOM 336 CA GLY A 25 -4.573 -5.068 -7.160 1.00 0.00 C ATOM 337 C GLY A 25 -4.985 -3.921 -6.258 1.00 0.00 C ATOM 338 O GLY A 25 -4.146 -3.314 -5.592 1.00 0.00 O ATOM 0 H GLY A 25 -2.484 -5.178 -7.026 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.471 -4.704 -8.182 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.361 -5.822 -7.167 1.00 0.00 H new ATOM 342 N THR A 26 -6.280 -3.622 -6.238 1.00 0.00 N ATOM 343 CA THR A 26 -6.802 -2.540 -5.412 1.00 0.00 C ATOM 344 C THR A 26 -6.519 -2.799 -3.935 1.00 0.00 C ATOM 345 O THR A 26 -7.041 -3.747 -3.350 1.00 0.00 O ATOM 346 CB THR A 26 -8.307 -2.382 -5.634 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.631 -2.531 -7.005 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.841 -1.040 -5.179 1.00 0.00 C ATOM 0 H THR A 26 -6.987 -4.114 -6.784 1.00 0.00 H new ATOM 0 HA THR A 26 -6.300 -1.618 -5.704 1.00 0.00 H new ATOM 0 HB THR A 26 -8.771 -3.163 -5.032 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.598 -2.428 -7.126 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.914 -0.993 -5.365 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.652 -0.916 -4.113 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.342 -0.244 -5.731 1.00 0.00 H new ATOM 356 N ILE A 27 -5.688 -1.949 -3.340 1.00 0.00 N ATOM 357 CA ILE A 27 -5.335 -2.087 -1.932 1.00 0.00 C ATOM 358 C ILE A 27 -5.571 -0.784 -1.177 1.00 0.00 C ATOM 359 O ILE A 27 -5.765 0.271 -1.782 1.00 0.00 O ATOM 360 CB ILE A 27 -3.863 -2.506 -1.760 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.940 -1.518 -2.478 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.649 -3.917 -2.286 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.670 -1.213 -1.714 1.00 0.00 C ATOM 0 H ILE A 27 -5.247 -1.159 -3.810 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.977 -2.865 -1.520 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.620 -2.494 -0.698 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.678 -1.923 -3.456 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.482 -0.588 -2.653 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.604 -4.199 -2.157 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.282 -4.611 -1.734 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.907 -3.954 -3.344 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.065 -0.507 -2.282 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.923 -0.779 -0.747 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.107 -2.134 -1.562 1.00 0.00 H new ATOM 375 N ALA A 28 -5.555 -0.865 0.150 1.00 0.00 N ATOM 376 CA ALA A 28 -5.767 0.307 0.990 1.00 0.00 C ATOM 377 C ALA A 28 -4.700 0.404 2.076 1.00 0.00 C ATOM 378 O ALA A 28 -4.337 -0.597 2.693 1.00 0.00 O ATOM 379 CB ALA A 28 -7.155 0.266 1.612 1.00 0.00 C ATOM 0 H ALA A 28 -5.397 -1.731 0.666 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.689 1.194 0.361 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.300 1.147 2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.907 0.253 0.823 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.254 -0.632 2.222 1.00 0.00 H new ATOM 385 N ILE A 29 -4.204 1.615 2.303 1.00 0.00 N ATOM 386 CA ILE A 29 -3.179 1.843 3.314 1.00 0.00 C ATOM 387 C ILE A 29 -3.750 2.584 4.518 1.00 0.00 C ATOM 388 O ILE A 29 -4.611 3.453 4.373 1.00 0.00 O ATOM 389 CB ILE A 29 -1.995 2.646 2.744 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.525 2.035 1.422 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.852 2.693 3.748 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.647 2.960 0.608 1.00 0.00 C ATOM 0 H ILE A 29 -4.495 2.454 1.801 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.823 0.862 3.630 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.327 3.667 2.554 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.977 1.116 1.630 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.396 1.759 0.829 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.023 3.264 3.329 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.194 3.170 4.667 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.519 1.679 3.968 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.351 2.462 -0.315 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.199 3.869 0.369 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.243 3.217 1.183 1.00 0.00 H new ATOM 404 N GLU A 30 -3.268 2.237 5.706 1.00 0.00 N ATOM 405 CA GLU A 30 -3.732 2.869 6.935 1.00 0.00 C ATOM 406 C GLU A 30 -2.556 3.306 7.802 1.00 0.00 C ATOM 407 O GLU A 30 -1.785 2.476 8.284 1.00 0.00 O ATOM 408 CB GLU A 30 -4.630 1.909 7.719 1.00 0.00 C ATOM 409 CG GLU A 30 -5.264 2.537 8.950 1.00 0.00 C ATOM 410 CD GLU A 30 -5.883 1.507 9.875 1.00 0.00 C ATOM 411 OE1 GLU A 30 -6.641 0.644 9.382 1.00 0.00 O ATOM 412 OE2 GLU A 30 -5.610 1.563 11.093 1.00 0.00 O ATOM 0 H GLU A 30 -2.555 1.521 5.844 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.307 3.754 6.663 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.418 1.543 7.061 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.043 1.043 8.025 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.508 3.102 9.495 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.030 3.247 8.638 1.00 0.00 H new ATOM 419 N MET A 31 -2.424 4.614 7.998 1.00 0.00 N ATOM 420 CA MET A 31 -1.342 5.161 8.808 1.00 0.00 C ATOM 421 C MET A 31 -1.786 5.346 10.255 1.00 0.00 C ATOM 422 O MET A 31 -1.065 4.986 11.187 1.00 0.00 O ATOM 423 CB MET A 31 -0.870 6.498 8.234 1.00 0.00 C ATOM 424 CG MET A 31 -0.678 6.479 6.727 1.00 0.00 C ATOM 425 SD MET A 31 0.008 8.023 6.096 1.00 0.00 S ATOM 426 CE MET A 31 1.481 7.427 5.269 1.00 0.00 C ATOM 0 H MET A 31 -3.053 5.315 7.607 1.00 0.00 H new ATOM 0 HA MET A 31 -0.514 4.452 8.787 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.596 7.270 8.490 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.071 6.776 8.708 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.016 5.655 6.459 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.637 6.288 6.245 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.206 8.237 5.188 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.915 6.608 5.843 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.220 7.072 4.272 1.00 0.00 H new ATOM 436 N ASP A 32 -2.975 5.908 10.437 1.00 0.00 N ATOM 437 CA ASP A 32 -3.516 6.142 11.771 1.00 0.00 C ATOM 438 C ASP A 32 -4.648 5.168 12.080 1.00 0.00 C ATOM 439 O ASP A 32 -5.108 4.437 11.203 1.00 0.00 O ATOM 440 CB ASP A 32 -4.018 7.582 11.896 1.00 0.00 C ATOM 441 CG ASP A 32 -3.806 8.150 13.285 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.657 8.112 13.773 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.789 8.631 13.886 1.00 0.00 O ATOM 0 H ASP A 32 -3.584 6.211 9.677 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.715 5.979 12.493 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.502 8.208 11.168 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.079 7.616 11.651 1.00 0.00 H new ATOM 448 N LYS A 33 -5.093 5.165 13.332 1.00 0.00 N ATOM 449 CA LYS A 33 -6.173 4.281 13.758 1.00 0.00 C ATOM 450 C LYS A 33 -7.528 4.832 13.329 1.00 0.00 C ATOM 451 O LYS A 33 -8.198 5.527 14.094 1.00 0.00 O ATOM 452 CB LYS A 33 -6.141 4.100 15.276 1.00 0.00 C ATOM 453 CG LYS A 33 -6.643 2.742 15.738 1.00 0.00 C ATOM 454 CD LYS A 33 -5.980 2.315 17.038 1.00 0.00 C ATOM 455 CE LYS A 33 -6.221 0.844 17.329 1.00 0.00 C ATOM 456 NZ LYS A 33 -5.361 0.349 18.440 1.00 0.00 N ATOM 0 H LYS A 33 -4.723 5.764 14.070 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.027 3.313 13.280 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.119 4.239 15.629 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.747 4.879 15.739 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.724 2.780 15.875 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.445 1.998 14.966 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.908 2.505 16.980 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.367 2.918 17.860 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.269 0.692 17.586 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.025 0.259 16.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.556 -0.659 18.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.360 0.470 18.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.566 0.889 19.305 1.00 0.00 H new ATOM 470 N GLY A 34 -7.928 4.518 12.101 1.00 0.00 N ATOM 471 CA GLY A 34 -9.202 4.990 11.591 1.00 0.00 C ATOM 472 C GLY A 34 -9.044 5.920 10.404 1.00 0.00 C ATOM 473 O GLY A 34 -9.907 5.971 9.527 1.00 0.00 O ATOM 0 H GLY A 34 -7.392 3.945 11.450 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.812 4.135 11.300 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.738 5.509 12.386 1.00 0.00 H new ATOM 477 N ALA A 35 -7.939 6.658 10.376 1.00 0.00 N ATOM 478 CA ALA A 35 -7.672 7.591 9.288 1.00 0.00 C ATOM 479 C ALA A 35 -6.965 6.894 8.131 1.00 0.00 C ATOM 480 O ALA A 35 -6.153 5.992 8.338 1.00 0.00 O ATOM 481 CB ALA A 35 -6.838 8.761 9.790 1.00 0.00 C ATOM 0 H ALA A 35 -7.215 6.628 11.094 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.627 7.969 8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.646 9.450 8.968 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.379 9.281 10.580 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.891 8.391 10.182 1.00 0.00 H new ATOM 487 N TYR A 36 -7.280 7.318 6.910 1.00 0.00 N ATOM 488 CA TYR A 36 -6.674 6.735 5.719 1.00 0.00 C ATOM 489 C TYR A 36 -6.021 7.811 4.859 1.00 0.00 C ATOM 490 O TYR A 36 -6.215 9.005 5.086 1.00 0.00 O ATOM 491 CB TYR A 36 -7.727 5.982 4.903 1.00 0.00 C ATOM 492 CG TYR A 36 -8.115 4.647 5.498 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.780 4.575 6.715 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.814 3.459 4.843 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.136 3.357 7.264 1.00 0.00 C ATOM 496 CE2 TYR A 36 -8.167 2.237 5.385 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.827 2.191 6.594 1.00 0.00 C ATOM 498 OH TYR A 36 -9.180 0.977 7.137 1.00 0.00 O ATOM 0 H TYR A 36 -7.951 8.063 6.721 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.903 6.034 6.039 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.618 6.603 4.814 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.347 5.824 3.894 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.023 5.486 7.242 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -7.296 3.491 3.896 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -9.653 3.318 8.212 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.927 1.322 4.863 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.891 0.255 6.540 1.00 0.00 H new ATOM 508 N ILE A 37 -5.246 7.379 3.869 1.00 0.00 N ATOM 509 CA ILE A 37 -4.565 8.306 2.973 1.00 0.00 C ATOM 510 C ILE A 37 -5.539 8.927 1.980 1.00 0.00 C ATOM 511 O ILE A 37 -6.094 8.237 1.124 1.00 0.00 O ATOM 512 CB ILE A 37 -3.432 7.607 2.197 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.548 6.805 3.152 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.605 8.630 1.432 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.438 6.047 2.455 1.00 0.00 C ATOM 0 H ILE A 37 -5.074 6.394 3.667 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.137 9.091 3.596 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.876 6.917 1.479 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.110 7.483 3.885 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.169 6.099 3.703 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.809 8.121 0.889 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.244 9.160 0.726 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.169 9.342 2.132 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.851 5.501 3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.869 5.344 1.742 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.793 6.750 1.927 1.00 0.00 H new ATOM 527 N HIS A 38 -5.746 10.235 2.099 1.00 0.00 N ATOM 528 CA HIS A 38 -6.655 10.949 1.211 1.00 0.00 C ATOM 529 C HIS A 38 -5.882 11.717 0.144 1.00 0.00 C ATOM 530 O HIS A 38 -4.774 12.194 0.389 1.00 0.00 O ATOM 531 CB HIS A 38 -7.534 11.910 2.013 1.00 0.00 C ATOM 532 CG HIS A 38 -8.821 12.257 1.330 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.882 11.389 1.204 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.207 13.411 0.727 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.859 12.026 0.544 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.499 13.257 0.233 1.00 0.00 N ATOM 0 H HIS A 38 -5.296 10.821 2.802 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.290 10.215 0.715 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.756 11.463 2.982 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.975 12.826 2.204 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.607 14.305 0.644 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.816 11.589 0.299 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.053 13.952 -0.267 1.00 0.00 H new ATOM 544 N ALA A 39 -6.476 11.835 -1.040 1.00 0.00 N ATOM 545 CA ALA A 39 -5.844 12.546 -2.145 1.00 0.00 C ATOM 546 C ALA A 39 -6.649 13.780 -2.536 1.00 0.00 C ATOM 547 O ALA A 39 -7.879 13.750 -2.554 1.00 0.00 O ATOM 548 CB ALA A 39 -5.678 11.620 -3.341 1.00 0.00 C ATOM 0 H ALA A 39 -7.394 11.447 -1.258 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.859 12.877 -1.816 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.205 12.163 -4.159 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.054 10.771 -3.060 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.656 11.261 -3.662 1.00 0.00 H new ATOM 554 N LEU A 40 -5.946 14.865 -2.846 1.00 0.00 N ATOM 555 CA LEU A 40 -6.597 16.110 -3.236 1.00 0.00 C ATOM 556 C LEU A 40 -6.628 16.255 -4.754 1.00 0.00 C ATOM 557 O LEU A 40 -5.808 15.669 -5.460 1.00 0.00 O ATOM 558 CB LEU A 40 -5.875 17.305 -2.612 1.00 0.00 C ATOM 559 CG LEU A 40 -6.182 17.547 -1.132 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.222 18.571 -0.549 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.623 18.001 -0.957 1.00 0.00 C ATOM 0 H LEU A 40 -4.927 14.907 -2.835 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.624 16.084 -2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.801 17.161 -2.726 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.137 18.202 -3.173 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.049 16.609 -0.593 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.455 18.730 0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.199 18.206 -0.643 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.322 19.512 -1.089 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.826 18.169 0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.782 18.928 -1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.295 17.232 -1.338 1.00 0.00 H new ATOM 573 N ASP A 41 -7.579 17.042 -5.248 1.00 0.00 N ATOM 574 CA ASP A 41 -7.716 17.266 -6.683 1.00 0.00 C ATOM 575 C ASP A 41 -6.510 18.022 -7.231 1.00 0.00 C ATOM 576 O ASP A 41 -6.116 17.829 -8.382 1.00 0.00 O ATOM 577 CB ASP A 41 -8.999 18.044 -6.979 1.00 0.00 C ATOM 578 CG ASP A 41 -9.434 17.914 -8.426 1.00 0.00 C ATOM 579 OD1 ASP A 41 -8.746 18.475 -9.305 1.00 0.00 O ATOM 580 OD2 ASP A 41 -10.461 17.251 -8.679 1.00 0.00 O ATOM 0 H ASP A 41 -8.265 17.535 -4.676 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.768 16.295 -7.175 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.797 17.684 -6.329 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.845 19.097 -6.742 1.00 0.00 H new ATOM 585 N ASN A 42 -5.931 18.882 -6.402 1.00 0.00 N ATOM 586 CA ASN A 42 -4.770 19.668 -6.803 1.00 0.00 C ATOM 587 C ASN A 42 -3.557 18.771 -7.026 1.00 0.00 C ATOM 588 O ASN A 42 -2.700 19.064 -7.860 1.00 0.00 O ATOM 589 CB ASN A 42 -4.451 20.724 -5.743 1.00 0.00 C ATOM 590 CG ASN A 42 -4.395 20.142 -4.345 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.504 19.356 -4.022 1.00 0.00 O ATOM 592 ND2 ASN A 42 -5.350 20.525 -3.506 1.00 0.00 N ATOM 0 H ASN A 42 -6.246 19.053 -5.447 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.007 20.167 -7.742 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.495 21.192 -5.977 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -5.207 21.509 -5.777 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -5.364 20.166 -2.551 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -6.069 21.179 -3.816 1.00 0.00 H new ATOM 599 N GLY A 43 -3.490 17.676 -6.276 1.00 0.00 N ATOM 600 CA GLY A 43 -2.378 16.753 -6.406 1.00 0.00 C ATOM 601 C GLY A 43 -1.767 16.385 -5.068 1.00 0.00 C ATOM 602 O GLY A 43 -1.167 15.320 -4.925 1.00 0.00 O ATOM 0 H GLY A 43 -4.187 17.411 -5.580 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.719 15.847 -6.907 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.612 17.199 -7.041 1.00 0.00 H new ATOM 606 N LEU A 44 -1.917 17.268 -4.086 1.00 0.00 N ATOM 607 CA LEU A 44 -1.374 17.030 -2.754 1.00 0.00 C ATOM 608 C LEU A 44 -2.161 15.941 -2.033 1.00 0.00 C ATOM 609 O LEU A 44 -3.216 15.511 -2.500 1.00 0.00 O ATOM 610 CB LEU A 44 -1.397 18.320 -1.932 1.00 0.00 C ATOM 611 CG LEU A 44 -0.647 19.499 -2.557 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.312 20.814 -2.180 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.811 19.492 -2.120 1.00 0.00 C ATOM 0 H LEU A 44 -2.410 18.155 -4.188 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.342 16.696 -2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.435 18.613 -1.772 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.969 18.115 -0.951 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.682 19.396 -3.642 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.765 21.641 -2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.341 20.818 -2.541 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.307 20.926 -1.096 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.331 20.336 -2.573 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.866 19.572 -1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.282 18.562 -2.439 1.00 0.00 H new ATOM 625 N PHE A 45 -1.640 15.498 -0.893 1.00 0.00 N ATOM 626 CA PHE A 45 -2.294 14.458 -0.107 1.00 0.00 C ATOM 627 C PHE A 45 -2.328 14.834 1.371 1.00 0.00 C ATOM 628 O PHE A 45 -1.413 15.484 1.878 1.00 0.00 O ATOM 629 CB PHE A 45 -1.571 13.123 -0.289 1.00 0.00 C ATOM 630 CG PHE A 45 -1.800 12.494 -1.633 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.297 13.083 -2.783 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.518 11.315 -1.748 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.505 12.506 -4.021 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.730 10.734 -2.984 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.223 11.331 -4.122 1.00 0.00 C ATOM 0 H PHE A 45 -0.767 15.843 -0.493 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.320 14.359 -0.462 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.501 13.276 -0.146 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.900 12.432 0.487 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.736 14.003 -2.710 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.917 10.844 -0.862 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.106 12.974 -4.909 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.291 9.814 -3.060 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.388 10.879 -5.089 1.00 0.00 H new ATOM 645 N THR A 46 -3.389 14.423 2.057 1.00 0.00 N ATOM 646 CA THR A 46 -3.543 14.717 3.477 1.00 0.00 C ATOM 647 C THR A 46 -4.231 13.564 4.201 1.00 0.00 C ATOM 648 O THR A 46 -5.002 12.813 3.603 1.00 0.00 O ATOM 649 CB THR A 46 -4.347 16.004 3.668 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.430 16.343 5.042 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.758 15.913 3.132 1.00 0.00 C ATOM 0 H THR A 46 -4.155 13.885 1.652 1.00 0.00 H new ATOM 0 HA THR A 46 -2.549 14.849 3.904 1.00 0.00 H new ATOM 0 HB THR A 46 -3.810 16.767 3.104 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.946 17.170 5.144 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.273 16.859 3.300 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.728 15.700 2.063 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.292 15.114 3.646 1.00 0.00 H new ATOM 659 N LEU A 47 -3.948 13.430 5.492 1.00 0.00 N ATOM 660 CA LEU A 47 -4.542 12.369 6.299 1.00 0.00 C ATOM 661 C LEU A 47 -6.053 12.542 6.395 1.00 0.00 C ATOM 662 O LEU A 47 -6.543 13.454 7.061 1.00 0.00 O ATOM 663 CB LEU A 47 -3.926 12.361 7.699 1.00 0.00 C ATOM 664 CG LEU A 47 -4.433 11.251 8.622 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.923 9.895 8.157 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.010 11.517 10.059 1.00 0.00 C ATOM 0 H LEU A 47 -3.311 14.042 6.002 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.334 11.415 5.813 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.844 12.267 7.603 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.122 13.324 8.171 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.522 11.241 8.581 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.294 9.118 8.826 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.276 9.701 7.144 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.833 9.893 8.168 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.379 10.717 10.701 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.922 11.556 10.117 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.425 12.469 10.390 1.00 0.00 H new ATOM 678 N GLY A 48 -6.789 11.661 5.724 1.00 0.00 N ATOM 679 CA GLY A 48 -8.238 11.736 5.747 1.00 0.00 C ATOM 680 C GLY A 48 -8.804 11.596 7.147 1.00 0.00 C ATOM 681 O GLY A 48 -8.070 11.330 8.098 1.00 0.00 O ATOM 0 H GLY A 48 -6.408 10.897 5.165 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.556 12.689 5.323 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.649 10.951 5.112 1.00 0.00 H new ATOM 685 N ALA A 49 -10.115 11.776 7.272 1.00 0.00 N ATOM 686 CA ALA A 49 -10.780 11.670 8.565 1.00 0.00 C ATOM 687 C ALA A 49 -11.279 10.248 8.811 1.00 0.00 C ATOM 688 O ALA A 49 -11.609 9.526 7.871 1.00 0.00 O ATOM 689 CB ALA A 49 -11.934 12.658 8.646 1.00 0.00 C ATOM 0 H ALA A 49 -10.737 11.996 6.494 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.054 11.911 9.341 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.422 12.569 9.616 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.554 13.672 8.523 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.654 12.442 7.857 1.00 0.00 H new ATOM 695 N PRO A 50 -11.342 9.829 10.087 1.00 0.00 N ATOM 696 CA PRO A 50 -11.805 8.486 10.453 1.00 0.00 C ATOM 697 C PRO A 50 -13.300 8.305 10.216 1.00 0.00 C ATOM 698 O PRO A 50 -14.051 9.278 10.157 1.00 0.00 O ATOM 699 CB PRO A 50 -11.486 8.395 11.948 1.00 0.00 C ATOM 700 CG PRO A 50 -11.480 9.807 12.421 1.00 0.00 C ATOM 701 CD PRO A 50 -10.968 10.628 11.269 1.00 0.00 C ATOM 0 HA PRO A 50 -11.326 7.712 9.853 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -12.233 7.804 12.477 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.522 7.916 12.119 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.481 10.125 12.712 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.841 9.922 13.297 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.425 11.617 11.246 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.890 10.776 11.329 1.00 0.00 H new ATOM 709 N HIS A 51 -13.725 7.053 10.079 1.00 0.00 N ATOM 710 CA HIS A 51 -15.131 6.745 9.847 1.00 0.00 C ATOM 711 C HIS A 51 -15.870 6.547 11.167 1.00 0.00 C ATOM 712 O HIS A 51 -15.257 6.289 12.201 1.00 0.00 O ATOM 713 CB HIS A 51 -15.264 5.491 8.981 1.00 0.00 C ATOM 714 CG HIS A 51 -14.707 5.655 7.602 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.528 5.783 6.507 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.416 5.706 7.193 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.728 5.909 5.465 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.437 5.867 5.832 1.00 0.00 N ATOM 0 H HIS A 51 -13.116 6.236 10.125 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.580 7.589 9.323 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.754 4.663 9.474 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -16.317 5.219 8.909 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.539 5.634 7.819 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -15.068 6.030 4.447 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.627 5.941 5.216 1.00 0.00 H new ATOM 726 N ARG A 52 -17.194 6.670 11.122 1.00 0.00 N ATOM 727 CA ARG A 52 -18.017 6.505 12.314 1.00 0.00 C ATOM 728 C ARG A 52 -17.920 5.079 12.850 1.00 0.00 C ATOM 729 O ARG A 52 -17.457 4.856 13.969 1.00 0.00 O ATOM 730 CB ARG A 52 -19.476 6.853 12.003 1.00 0.00 C ATOM 731 CG ARG A 52 -20.047 7.937 12.903 1.00 0.00 C ATOM 732 CD ARG A 52 -20.894 8.929 12.121 1.00 0.00 C ATOM 733 NE ARG A 52 -22.305 8.856 12.492 1.00 0.00 N ATOM 734 CZ ARG A 52 -23.292 9.357 11.754 1.00 0.00 C ATOM 735 NH1 ARG A 52 -23.028 9.969 10.605 1.00 0.00 N ATOM 736 NH2 ARG A 52 -24.549 9.247 12.164 1.00 0.00 N ATOM 0 H ARG A 52 -17.718 6.883 10.273 1.00 0.00 H new ATOM 0 HA ARG A 52 -17.646 7.185 13.081 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -19.550 7.177 10.965 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -20.084 5.954 12.100 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -20.652 7.479 13.685 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -19.232 8.465 13.398 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.525 9.939 12.297 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.789 8.733 11.054 1.00 0.00 H new ATOM 0 HE ARG A 52 -22.548 8.394 13.368 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -22.064 10.057 10.284 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.789 10.351 10.044 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -24.759 8.778 13.045 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -25.306 9.631 11.598 1.00 0.00 H new ATOM 750 N GLU A 53 -18.359 4.118 12.044 1.00 0.00 N ATOM 751 CA GLU A 53 -18.321 2.714 12.437 1.00 0.00 C ATOM 752 C GLU A 53 -16.883 2.211 12.518 1.00 0.00 C ATOM 753 O GLU A 53 -15.970 2.820 11.959 1.00 0.00 O ATOM 754 CB GLU A 53 -19.116 1.864 11.445 1.00 0.00 C ATOM 755 CG GLU A 53 -20.623 1.976 11.619 1.00 0.00 C ATOM 756 CD GLU A 53 -21.261 2.889 10.591 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.752 2.947 9.452 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.270 3.545 10.924 1.00 0.00 O ATOM 0 H GLU A 53 -18.745 4.286 11.115 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.774 2.626 13.425 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.852 2.163 10.430 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.822 0.820 11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -21.069 0.984 11.545 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.843 2.350 12.619 1.00 0.00 H new ATOM 765 N VAL A 54 -16.688 1.097 13.217 1.00 0.00 N ATOM 766 CA VAL A 54 -15.362 0.514 13.371 1.00 0.00 C ATOM 767 C VAL A 54 -15.028 -0.411 12.203 1.00 0.00 C ATOM 768 O VAL A 54 -13.868 -0.539 11.812 1.00 0.00 O ATOM 769 CB VAL A 54 -15.245 -0.274 14.692 1.00 0.00 C ATOM 770 CG1 VAL A 54 -16.233 -1.431 14.717 1.00 0.00 C ATOM 771 CG2 VAL A 54 -13.822 -0.774 14.894 1.00 0.00 C ATOM 0 H VAL A 54 -17.433 0.581 13.685 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.652 1.341 13.388 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.489 0.398 15.514 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -16.134 -1.974 15.657 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -17.248 -1.045 14.626 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -16.026 -2.105 13.886 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -13.760 -1.327 15.831 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.546 -1.428 14.067 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -13.139 0.075 14.928 1.00 0.00 H new ATOM 781 N ASP A 55 -16.053 -1.052 11.651 1.00 0.00 N ATOM 782 CA ASP A 55 -15.869 -1.964 10.529 1.00 0.00 C ATOM 783 C ASP A 55 -16.450 -1.374 9.247 1.00 0.00 C ATOM 784 O ASP A 55 -17.603 -1.633 8.901 1.00 0.00 O ATOM 785 CB ASP A 55 -16.527 -3.313 10.826 1.00 0.00 C ATOM 786 CG ASP A 55 -15.785 -4.093 11.893 1.00 0.00 C ATOM 787 OD1 ASP A 55 -14.548 -4.219 11.785 1.00 0.00 O ATOM 788 OD2 ASP A 55 -16.443 -4.580 12.837 1.00 0.00 O ATOM 0 H ASP A 55 -17.019 -0.956 11.963 1.00 0.00 H new ATOM 0 HA ASP A 55 -14.799 -2.113 10.387 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -17.556 -3.150 11.148 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -16.569 -3.903 9.911 1.00 0.00 H new ATOM 793 N GLU A 56 -15.645 -0.581 8.549 1.00 0.00 N ATOM 794 CA GLU A 56 -16.080 0.046 7.305 1.00 0.00 C ATOM 795 C GLU A 56 -14.910 0.213 6.342 1.00 0.00 C ATOM 796 O GLU A 56 -13.806 0.575 6.746 1.00 0.00 O ATOM 797 CB GLU A 56 -16.718 1.407 7.592 1.00 0.00 C ATOM 798 CG GLU A 56 -18.202 1.328 7.911 1.00 0.00 C ATOM 799 CD GLU A 56 -18.996 0.629 6.824 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.360 1.297 5.833 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.251 -0.585 6.962 1.00 0.00 O ATOM 0 H GLU A 56 -14.688 -0.357 8.823 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.821 -0.604 6.839 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.199 1.873 8.430 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.575 2.056 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -18.339 0.798 8.854 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -18.594 2.335 8.051 1.00 0.00 H new ATOM 808 N GLY A 57 -15.162 -0.051 5.063 1.00 0.00 N ATOM 809 CA GLY A 57 -14.120 0.077 4.061 1.00 0.00 C ATOM 810 C GLY A 57 -13.834 1.524 3.705 1.00 0.00 C ATOM 811 O GLY A 57 -14.663 2.400 3.951 1.00 0.00 O ATOM 0 H GLY A 57 -16.068 -0.351 4.704 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.207 -0.391 4.429 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.416 -0.464 3.162 1.00 0.00 H new ATOM 815 N PRO A 58 -12.658 1.808 3.120 1.00 0.00 N ATOM 816 CA PRO A 58 -12.278 3.172 2.734 1.00 0.00 C ATOM 817 C PRO A 58 -13.100 3.691 1.561 1.00 0.00 C ATOM 818 O PRO A 58 -13.942 2.979 1.014 1.00 0.00 O ATOM 819 CB PRO A 58 -10.807 3.033 2.337 1.00 0.00 C ATOM 820 CG PRO A 58 -10.658 1.610 1.926 1.00 0.00 C ATOM 821 CD PRO A 58 -11.608 0.826 2.789 1.00 0.00 C ATOM 0 HA PRO A 58 -12.449 3.886 3.539 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.552 3.709 1.521 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.148 3.275 3.170 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -10.895 1.482 0.870 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.632 1.269 2.066 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.015 -0.035 2.259 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.117 0.446 3.685 1.00 0.00 H new ATOM 829 N SER A 59 -12.851 4.939 1.179 1.00 0.00 N ATOM 830 CA SER A 59 -13.567 5.558 0.069 1.00 0.00 C ATOM 831 C SER A 59 -12.777 5.424 -1.232 1.00 0.00 C ATOM 832 O SER A 59 -11.622 4.999 -1.223 1.00 0.00 O ATOM 833 CB SER A 59 -13.833 7.034 0.372 1.00 0.00 C ATOM 834 OG SER A 59 -13.958 7.254 1.767 1.00 0.00 O ATOM 0 H SER A 59 -12.158 5.542 1.622 1.00 0.00 H new ATOM 0 HA SER A 59 -14.519 5.041 -0.054 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.020 7.642 -0.024 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.745 7.354 -0.133 1.00 0.00 H new ATOM 0 HG SER A 59 -13.131 7.652 2.111 1.00 0.00 H new ATOM 840 N PRO A 60 -13.392 5.785 -2.373 1.00 0.00 N ATOM 841 CA PRO A 60 -12.739 5.700 -3.682 1.00 0.00 C ATOM 842 C PRO A 60 -11.357 6.356 -3.698 1.00 0.00 C ATOM 843 O PRO A 60 -10.385 5.746 -4.144 1.00 0.00 O ATOM 844 CB PRO A 60 -13.700 6.441 -4.611 1.00 0.00 C ATOM 845 CG PRO A 60 -15.032 6.314 -3.956 1.00 0.00 C ATOM 846 CD PRO A 60 -14.770 6.302 -2.476 1.00 0.00 C ATOM 0 HA PRO A 60 -12.557 4.666 -3.975 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.413 7.486 -4.726 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.705 6.001 -5.608 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.682 7.145 -4.230 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.535 5.399 -4.270 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.857 7.299 -2.045 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.479 5.663 -1.948 1.00 0.00 H new ATOM 854 N PRO A 61 -11.241 7.609 -3.214 1.00 0.00 N ATOM 855 CA PRO A 61 -9.957 8.320 -3.188 1.00 0.00 C ATOM 856 C PRO A 61 -8.954 7.668 -2.242 1.00 0.00 C ATOM 857 O PRO A 61 -7.743 7.811 -2.412 1.00 0.00 O ATOM 858 CB PRO A 61 -10.327 9.721 -2.694 1.00 0.00 C ATOM 859 CG PRO A 61 -11.608 9.542 -1.957 1.00 0.00 C ATOM 860 CD PRO A 61 -12.335 8.429 -2.658 1.00 0.00 C ATOM 0 HA PRO A 61 -9.473 8.317 -4.165 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.552 10.129 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.444 10.415 -3.526 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.426 9.292 -0.912 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.196 10.460 -1.967 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -12.957 7.857 -1.969 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.992 8.808 -3.441 1.00 0.00 H new ATOM 868 N GLU A 62 -9.464 6.949 -1.248 1.00 0.00 N ATOM 869 CA GLU A 62 -8.612 6.273 -0.277 1.00 0.00 C ATOM 870 C GLU A 62 -8.095 4.950 -0.835 1.00 0.00 C ATOM 871 O GLU A 62 -6.997 4.508 -0.497 1.00 0.00 O ATOM 872 CB GLU A 62 -9.379 6.026 1.023 1.00 0.00 C ATOM 873 CG GLU A 62 -9.387 7.223 1.961 1.00 0.00 C ATOM 874 CD GLU A 62 -10.688 7.352 2.730 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.928 6.523 3.632 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.465 8.282 2.430 1.00 0.00 O ATOM 0 H GLU A 62 -10.464 6.819 -1.094 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.758 6.918 -0.069 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.407 5.756 0.783 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.938 5.173 1.539 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.560 7.134 2.665 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.218 8.133 1.385 1.00 0.00 H new ATOM 883 N GLN A 63 -8.895 4.323 -1.693 1.00 0.00 N ATOM 884 CA GLN A 63 -8.519 3.051 -2.299 1.00 0.00 C ATOM 885 C GLN A 63 -7.488 3.259 -3.404 1.00 0.00 C ATOM 886 O GLN A 63 -7.726 4.001 -4.357 1.00 0.00 O ATOM 887 CB GLN A 63 -9.754 2.347 -2.864 1.00 0.00 C ATOM 888 CG GLN A 63 -10.852 2.126 -1.836 1.00 0.00 C ATOM 889 CD GLN A 63 -12.238 2.132 -2.454 1.00 0.00 C ATOM 890 OE1 GLN A 63 -12.400 1.868 -3.645 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.245 2.434 -1.643 1.00 0.00 N ATOM 0 H GLN A 63 -9.807 4.675 -1.984 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.075 2.425 -1.525 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.153 2.938 -3.688 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.455 1.384 -3.277 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.687 1.174 -1.332 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -10.794 2.904 -1.075 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.064 2.646 -0.662 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.200 2.454 -2.001 1.00 0.00 H new ATOM 900 N PHE A 64 -6.342 2.599 -3.269 1.00 0.00 N ATOM 901 CA PHE A 64 -5.274 2.711 -4.256 1.00 0.00 C ATOM 902 C PHE A 64 -5.120 1.412 -5.042 1.00 0.00 C ATOM 903 O PHE A 64 -5.592 0.358 -4.616 1.00 0.00 O ATOM 904 CB PHE A 64 -3.954 3.066 -3.571 1.00 0.00 C ATOM 905 CG PHE A 64 -4.006 4.353 -2.798 1.00 0.00 C ATOM 906 CD1 PHE A 64 -4.423 4.367 -1.476 1.00 0.00 C ATOM 907 CD2 PHE A 64 -3.641 5.549 -3.394 1.00 0.00 C ATOM 908 CE1 PHE A 64 -4.472 5.549 -0.763 1.00 0.00 C ATOM 909 CE2 PHE A 64 -3.688 6.735 -2.685 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.105 6.735 -1.369 1.00 0.00 C ATOM 0 H PHE A 64 -6.129 1.981 -2.486 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.539 3.506 -4.953 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.675 2.257 -2.896 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.170 3.136 -4.325 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.713 3.443 -0.998 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.316 5.555 -4.424 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.797 5.546 0.267 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -3.399 7.661 -3.160 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.144 7.661 -0.814 1.00 0.00 H new ATOM 920 N THR A 65 -4.460 1.496 -6.192 1.00 0.00 N ATOM 921 CA THR A 65 -4.245 0.327 -7.038 1.00 0.00 C ATOM 922 C THR A 65 -2.772 -0.066 -7.059 1.00 0.00 C ATOM 923 O THR A 65 -1.918 0.707 -7.493 1.00 0.00 O ATOM 924 CB THR A 65 -4.730 0.607 -8.461 1.00 0.00 C ATOM 925 OG1 THR A 65 -6.048 1.127 -8.448 1.00 0.00 O ATOM 926 CG2 THR A 65 -4.731 -0.621 -9.345 1.00 0.00 C ATOM 0 H THR A 65 -4.065 2.361 -6.560 1.00 0.00 H new ATOM 0 HA THR A 65 -4.817 -0.502 -6.622 1.00 0.00 H new ATOM 0 HB THR A 65 -4.024 1.329 -8.870 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.340 1.301 -9.367 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.086 -0.353 -10.340 1.00 0.00 H new ATOM 0 HG22 THR A 65 -3.719 -1.019 -9.416 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.389 -1.377 -8.917 1.00 0.00 H new ATOM 934 N ALA A 66 -2.481 -1.276 -6.589 1.00 0.00 N ATOM 935 CA ALA A 66 -1.111 -1.773 -6.555 1.00 0.00 C ATOM 936 C ALA A 66 -0.766 -2.521 -7.839 1.00 0.00 C ATOM 937 O ALA A 66 -1.558 -3.324 -8.332 1.00 0.00 O ATOM 938 CB ALA A 66 -0.908 -2.674 -5.347 1.00 0.00 C ATOM 0 H ALA A 66 -3.176 -1.929 -6.227 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.441 -0.917 -6.474 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.119 -3.038 -5.333 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -1.105 -2.110 -4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.592 -3.520 -5.405 1.00 0.00 H new ATOM 944 N VAL A 67 0.419 -2.251 -8.375 1.00 0.00 N ATOM 945 CA VAL A 67 0.867 -2.898 -9.602 1.00 0.00 C ATOM 946 C VAL A 67 2.250 -3.515 -9.423 1.00 0.00 C ATOM 947 O VAL A 67 3.207 -2.826 -9.066 1.00 0.00 O ATOM 948 CB VAL A 67 0.909 -1.905 -10.780 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.229 -2.629 -12.080 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.408 -1.152 -10.893 1.00 0.00 C ATOM 0 H VAL A 67 1.086 -1.589 -7.979 1.00 0.00 H new ATOM 0 HA VAL A 67 0.146 -3.684 -9.826 1.00 0.00 H new ATOM 0 HB VAL A 67 1.701 -1.180 -10.590 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.254 -1.911 -12.900 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.200 -3.117 -11.995 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.462 -3.378 -12.277 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.358 -0.456 -11.730 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.219 -1.861 -11.058 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.591 -0.599 -9.972 1.00 0.00 H new ATOM 960 N LYS A 68 2.350 -4.816 -9.674 1.00 0.00 N ATOM 961 CA LYS A 68 3.617 -5.525 -9.542 1.00 0.00 C ATOM 962 C LYS A 68 4.581 -5.127 -10.656 1.00 0.00 C ATOM 963 O LYS A 68 4.169 -4.887 -11.791 1.00 0.00 O ATOM 964 CB LYS A 68 3.384 -7.038 -9.567 1.00 0.00 C ATOM 965 CG LYS A 68 3.414 -7.681 -8.190 1.00 0.00 C ATOM 966 CD LYS A 68 3.622 -9.185 -8.281 1.00 0.00 C ATOM 967 CE LYS A 68 5.071 -9.564 -8.020 1.00 0.00 C ATOM 968 NZ LYS A 68 5.541 -10.631 -8.947 1.00 0.00 N ATOM 0 H LYS A 68 1.568 -5.401 -9.970 1.00 0.00 H new ATOM 0 HA LYS A 68 4.062 -5.250 -8.586 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.420 -7.241 -10.033 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.145 -7.504 -10.193 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.214 -7.237 -7.598 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.479 -7.473 -7.670 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.978 -9.687 -7.559 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.326 -9.535 -9.270 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.703 -8.683 -8.131 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.177 -9.905 -6.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.533 -10.861 -8.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.955 -11.481 -8.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.464 -10.297 -9.929 1.00 0.00 H new ATOM 982 N LEU A 69 5.866 -5.057 -10.323 1.00 0.00 N ATOM 983 CA LEU A 69 6.887 -4.686 -11.297 1.00 0.00 C ATOM 984 C LEU A 69 8.072 -5.646 -11.237 1.00 0.00 C ATOM 985 O LEU A 69 8.251 -6.482 -12.123 1.00 0.00 O ATOM 986 CB LEU A 69 7.360 -3.252 -11.051 1.00 0.00 C ATOM 987 CG LEU A 69 6.270 -2.186 -11.156 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.793 -0.839 -10.684 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.758 -2.090 -12.585 1.00 0.00 C ATOM 0 H LEU A 69 6.225 -5.252 -9.388 1.00 0.00 H new ATOM 0 HA LEU A 69 6.445 -4.748 -12.291 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.806 -3.198 -10.058 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.147 -3.017 -11.767 1.00 0.00 H new ATOM 0 HG LEU A 69 5.440 -2.476 -10.511 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.003 -0.093 -10.766 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.112 -0.917 -9.645 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.640 -0.540 -11.302 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.982 -1.326 -12.643 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.580 -1.823 -13.249 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.344 -3.052 -12.889 1.00 0.00 H new ATOM 1001 N SER A 70 8.880 -5.520 -10.187 1.00 0.00 N ATOM 1002 CA SER A 70 10.047 -6.377 -10.014 1.00 0.00 C ATOM 1003 C SER A 70 10.795 -6.021 -8.733 1.00 0.00 C ATOM 1004 O SER A 70 10.678 -4.906 -8.224 1.00 0.00 O ATOM 1005 CB SER A 70 10.984 -6.251 -11.218 1.00 0.00 C ATOM 1006 OG SER A 70 11.405 -7.525 -11.672 1.00 0.00 O ATOM 0 H SER A 70 8.747 -4.833 -9.445 1.00 0.00 H new ATOM 0 HA SER A 70 9.702 -7.408 -9.939 1.00 0.00 H new ATOM 0 HB2 SER A 70 10.475 -5.724 -12.025 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.854 -5.653 -10.945 1.00 0.00 H new ATOM 0 HG SER A 70 12.001 -7.417 -12.442 1.00 0.00 H new ATOM 1012 N ASP A 71 11.566 -6.974 -8.219 1.00 0.00 N ATOM 1013 CA ASP A 71 12.335 -6.760 -6.998 1.00 0.00 C ATOM 1014 C ASP A 71 11.421 -6.402 -5.831 1.00 0.00 C ATOM 1015 O ASP A 71 11.808 -5.658 -4.931 1.00 0.00 O ATOM 1016 CB ASP A 71 13.369 -5.652 -7.209 1.00 0.00 C ATOM 1017 CG ASP A 71 14.697 -6.187 -7.703 1.00 0.00 C ATOM 1018 OD1 ASP A 71 14.712 -7.289 -8.291 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.724 -5.505 -7.502 1.00 0.00 O ATOM 0 H ASP A 71 11.675 -7.902 -8.629 1.00 0.00 H new ATOM 0 HA ASP A 71 12.851 -7.690 -6.758 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.982 -4.930 -7.927 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.522 -5.118 -6.271 1.00 0.00 H new ATOM 1024 N SER A 72 10.204 -6.938 -5.853 1.00 0.00 N ATOM 1025 CA SER A 72 9.234 -6.676 -4.796 1.00 0.00 C ATOM 1026 C SER A 72 8.886 -5.193 -4.732 1.00 0.00 C ATOM 1027 O SER A 72 8.629 -4.652 -3.656 1.00 0.00 O ATOM 1028 CB SER A 72 9.779 -7.143 -3.445 1.00 0.00 C ATOM 1029 OG SER A 72 8.740 -7.633 -2.616 1.00 0.00 O ATOM 0 H SER A 72 9.867 -7.556 -6.591 1.00 0.00 H new ATOM 0 HA SER A 72 8.326 -7.234 -5.025 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.523 -7.924 -3.600 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.285 -6.315 -2.948 1.00 0.00 H new ATOM 0 HG SER A 72 7.874 -7.459 -3.040 1.00 0.00 H new ATOM 1035 N ARG A 73 8.880 -4.541 -5.890 1.00 0.00 N ATOM 1036 CA ARG A 73 8.564 -3.119 -5.964 1.00 0.00 C ATOM 1037 C ARG A 73 7.241 -2.893 -6.690 1.00 0.00 C ATOM 1038 O ARG A 73 7.173 -2.972 -7.916 1.00 0.00 O ATOM 1039 CB ARG A 73 9.685 -2.361 -6.677 1.00 0.00 C ATOM 1040 CG ARG A 73 11.077 -2.718 -6.177 1.00 0.00 C ATOM 1041 CD ARG A 73 11.194 -2.541 -4.671 1.00 0.00 C ATOM 1042 NE ARG A 73 12.409 -1.823 -4.297 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.615 -0.531 -4.544 1.00 0.00 C ATOM 1044 NH1 ARG A 73 11.687 0.188 -5.164 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.750 0.044 -4.170 1.00 0.00 N ATOM 0 H ARG A 73 9.090 -4.974 -6.789 1.00 0.00 H new ATOM 0 HA ARG A 73 8.470 -2.741 -4.946 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.628 -2.567 -7.746 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.526 -1.290 -6.550 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.305 -3.751 -6.441 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.815 -2.090 -6.676 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.324 -1.998 -4.301 1.00 0.00 H new ATOM 0 HD3 ARG A 73 11.188 -3.519 -4.190 1.00 0.00 H new ATOM 0 HE ARG A 73 13.144 -2.342 -3.818 1.00 0.00 H new ATOM 0 HH11 ARG A 73 10.812 -0.249 -5.453 1.00 0.00 H new ATOM 0 HH12 ARG A 73 11.849 1.177 -5.351 1.00 0.00 H new ATOM 0 HH21 ARG A 73 14.466 -0.504 -3.693 1.00 0.00 H new ATOM 0 HH22 ARG A 73 13.907 1.034 -4.360 1.00 0.00 H new ATOM 1059 N ILE A 74 6.192 -2.611 -5.922 1.00 0.00 N ATOM 1060 CA ILE A 74 4.872 -2.373 -6.492 1.00 0.00 C ATOM 1061 C ILE A 74 4.616 -0.882 -6.685 1.00 0.00 C ATOM 1062 O ILE A 74 5.190 -0.048 -5.985 1.00 0.00 O ATOM 1063 CB ILE A 74 3.759 -2.960 -5.602 1.00 0.00 C ATOM 1064 CG1 ILE A 74 3.942 -2.505 -4.154 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.753 -4.481 -5.692 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.735 -2.772 -3.280 1.00 0.00 C ATOM 0 H ILE A 74 6.232 -2.542 -4.905 1.00 0.00 H new ATOM 0 HA ILE A 74 4.854 -2.872 -7.461 1.00 0.00 H new ATOM 0 HB ILE A 74 2.797 -2.593 -5.959 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.808 -3.012 -3.729 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.160 -1.437 -4.142 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.961 -4.880 -5.058 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.578 -4.784 -6.724 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.715 -4.869 -5.358 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.935 -2.424 -2.267 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.871 -2.243 -3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.529 -3.842 -3.262 1.00 0.00 H new ATOM 1078 N ALA A 75 3.750 -0.553 -7.638 1.00 0.00 N ATOM 1079 CA ALA A 75 3.417 0.837 -7.922 1.00 0.00 C ATOM 1080 C ALA A 75 2.001 1.166 -7.459 1.00 0.00 C ATOM 1081 O ALA A 75 1.045 0.481 -7.819 1.00 0.00 O ATOM 1082 CB ALA A 75 3.568 1.122 -9.408 1.00 0.00 C ATOM 0 H ALA A 75 3.266 -1.231 -8.227 1.00 0.00 H new ATOM 0 HA ALA A 75 4.109 1.472 -7.370 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.316 2.164 -9.606 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.598 0.934 -9.712 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.899 0.473 -9.973 1.00 0.00 H new ATOM 1088 N LEU A 76 1.876 2.220 -6.660 1.00 0.00 N ATOM 1089 CA LEU A 76 0.576 2.640 -6.148 1.00 0.00 C ATOM 1090 C LEU A 76 -0.091 3.628 -7.098 1.00 0.00 C ATOM 1091 O LEU A 76 0.557 4.187 -7.984 1.00 0.00 O ATOM 1092 CB LEU A 76 0.729 3.271 -4.762 1.00 0.00 C ATOM 1093 CG LEU A 76 1.217 2.320 -3.668 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.942 3.089 -2.575 1.00 0.00 C ATOM 1095 CD2 LEU A 76 0.049 1.537 -3.087 1.00 0.00 C ATOM 0 H LEU A 76 2.658 2.799 -6.353 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.057 1.756 -6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.427 4.105 -4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.233 3.685 -4.460 1.00 0.00 H new ATOM 0 HG LEU A 76 1.919 1.614 -4.112 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.282 2.395 -1.806 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.801 3.606 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.264 3.818 -2.132 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.412 0.865 -2.310 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.676 2.229 -2.658 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.428 0.955 -3.876 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.389 3.840 -6.908 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.146 4.760 -7.748 1.00 0.00 C ATOM 1109 C LYS A 77 -3.398 5.250 -7.027 1.00 0.00 C ATOM 1110 O LYS A 77 -4.217 4.451 -6.574 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.533 4.084 -9.064 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.302 4.989 -10.011 1.00 0.00 C ATOM 1113 CD LYS A 77 -3.971 4.195 -11.122 1.00 0.00 C ATOM 1114 CE LYS A 77 -5.358 4.732 -11.434 1.00 0.00 C ATOM 1115 NZ LYS A 77 -6.341 4.385 -10.370 1.00 0.00 N ATOM 0 H LYS A 77 -1.939 3.386 -6.179 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.512 5.620 -7.963 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.629 3.735 -9.563 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.137 3.203 -8.846 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.057 5.543 -9.453 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.624 5.723 -10.445 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.354 4.234 -12.020 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.043 3.147 -10.829 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.311 5.815 -11.545 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.698 4.328 -12.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.298 4.357 -10.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.107 3.453 -9.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.305 5.102 -9.617 1.00 0.00 H new ATOM 1129 N SER A 78 -3.538 6.567 -6.925 1.00 0.00 N ATOM 1130 CA SER A 78 -4.691 7.163 -6.260 1.00 0.00 C ATOM 1131 C SER A 78 -5.968 6.912 -7.055 1.00 0.00 C ATOM 1132 O SER A 78 -5.943 6.846 -8.284 1.00 0.00 O ATOM 1133 CB SER A 78 -4.479 8.667 -6.074 1.00 0.00 C ATOM 1134 OG SER A 78 -3.664 9.199 -7.105 1.00 0.00 O ATOM 0 H SER A 78 -2.868 7.242 -7.294 1.00 0.00 H new ATOM 0 HA SER A 78 -4.796 6.695 -5.281 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.443 9.175 -6.069 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.015 8.855 -5.106 1.00 0.00 H new ATOM 0 HG SER A 78 -3.633 8.569 -7.855 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.084 6.774 -6.345 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.355 6.531 -7.002 1.00 0.00 C ATOM 1142 C GLY A 79 -8.733 7.642 -7.962 1.00 0.00 C ATOM 1143 O GLY A 79 -9.437 7.408 -8.945 1.00 0.00 O ATOM 0 H GLY A 79 -7.130 6.826 -5.327 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.305 5.587 -7.545 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.136 6.425 -6.249 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.263 8.852 -7.680 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.556 10.002 -8.527 1.00 0.00 C ATOM 1149 C TYR A 80 -8.031 9.783 -9.941 1.00 0.00 C ATOM 1150 O TYR A 80 -8.670 10.174 -10.919 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.941 11.270 -7.931 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.871 12.018 -7.003 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.829 12.890 -7.505 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.791 11.851 -5.627 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.681 13.576 -6.660 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -9.640 12.533 -4.775 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.583 13.394 -5.297 1.00 0.00 C ATOM 1158 OH TYR A 80 -11.429 14.074 -4.452 1.00 0.00 O ATOM 0 H TYR A 80 -7.678 9.062 -6.872 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.638 10.121 -8.576 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -7.036 11.003 -7.386 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.640 11.933 -8.742 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.909 13.034 -8.572 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -8.054 11.178 -5.216 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.420 14.251 -7.066 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.565 12.392 -3.707 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.229 13.832 -3.524 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.863 9.158 -10.043 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.271 8.898 -11.343 1.00 0.00 C ATOM 1170 C GLY A 81 -4.849 9.415 -11.447 1.00 0.00 C ATOM 1171 O GLY A 81 -4.488 10.061 -12.430 1.00 0.00 O ATOM 0 H GLY A 81 -6.315 8.827 -9.249 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.279 7.825 -11.534 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.881 9.364 -12.116 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.043 9.132 -10.429 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.654 9.573 -10.410 1.00 0.00 C ATOM 1177 C LYS A 82 -1.780 8.585 -9.645 1.00 0.00 C ATOM 1178 O LYS A 82 -2.240 7.924 -8.714 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.546 10.962 -9.778 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.681 12.098 -10.778 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.191 13.366 -10.114 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.801 14.320 -11.128 1.00 0.00 C ATOM 1183 NZ LYS A 82 -3.684 15.740 -10.696 1.00 0.00 N ATOM 0 H LYS A 82 -4.328 8.600 -9.607 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.301 9.622 -11.440 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.318 11.066 -9.016 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.585 11.048 -9.271 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.714 12.293 -11.242 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.364 11.803 -11.575 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.936 13.109 -9.361 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.370 13.861 -9.595 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.306 14.192 -12.091 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.852 14.071 -11.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.112 16.358 -11.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.178 15.869 -9.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.680 15.986 -10.581 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.515 8.487 -10.045 1.00 0.00 N ATOM 1198 CA TYR A 83 0.424 7.579 -9.397 1.00 0.00 C ATOM 1199 C TYR A 83 1.120 8.263 -8.224 1.00 0.00 C ATOM 1200 O TYR A 83 1.499 9.430 -8.309 1.00 0.00 O ATOM 1201 CB TYR A 83 1.464 7.084 -10.403 1.00 0.00 C ATOM 1202 CG TYR A 83 1.070 5.800 -11.098 1.00 0.00 C ATOM 1203 CD1 TYR A 83 0.182 5.810 -12.166 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.588 4.578 -10.687 1.00 0.00 C ATOM 1205 CE1 TYR A 83 -0.181 4.639 -12.803 1.00 0.00 C ATOM 1206 CE2 TYR A 83 1.231 3.403 -11.321 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.347 3.438 -12.378 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.012 2.270 -13.010 1.00 0.00 O ATOM 0 H TYR A 83 -0.118 9.026 -10.815 1.00 0.00 H new ATOM 0 HA TYR A 83 -0.138 6.726 -9.016 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.629 7.858 -11.153 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.412 6.932 -9.888 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -0.232 6.749 -12.504 1.00 0.00 H new ATOM 0 HD2 TYR A 83 2.281 4.546 -9.859 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -0.875 4.664 -13.630 1.00 0.00 H new ATOM 0 HE2 TYR A 83 1.643 2.461 -10.990 1.00 0.00 H new ATOM 0 HH TYR A 83 0.450 1.515 -12.589 1.00 0.00 H new ATOM 1218 N LEU A 84 1.285 7.525 -7.131 1.00 0.00 N ATOM 1219 CA LEU A 84 1.937 8.061 -5.941 1.00 0.00 C ATOM 1220 C LEU A 84 3.452 8.085 -6.115 1.00 0.00 C ATOM 1221 O LEU A 84 4.097 7.038 -6.175 1.00 0.00 O ATOM 1222 CB LEU A 84 1.568 7.226 -4.713 1.00 0.00 C ATOM 1223 CG LEU A 84 0.077 7.194 -4.375 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.219 6.095 -3.368 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.377 8.545 -3.841 1.00 0.00 C ATOM 0 H LEU A 84 0.977 6.556 -7.044 1.00 0.00 H new ATOM 0 HA LEU A 84 1.589 9.084 -5.796 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.911 6.204 -4.872 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.112 7.614 -3.852 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.478 6.980 -5.288 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.285 6.088 -3.140 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.069 5.131 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.346 6.277 -2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.440 8.504 -3.606 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.185 8.787 -2.939 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.201 9.312 -4.595 1.00 0.00 H new ATOM 1237 N GLY A 85 4.013 9.286 -6.198 1.00 0.00 N ATOM 1238 CA GLY A 85 5.449 9.424 -6.365 1.00 0.00 C ATOM 1239 C GLY A 85 6.044 10.464 -5.436 1.00 0.00 C ATOM 1240 O GLY A 85 5.583 11.605 -5.394 1.00 0.00 O ATOM 0 H GLY A 85 3.500 10.166 -6.153 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.927 8.462 -6.182 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.667 9.697 -7.398 1.00 0.00 H new ATOM 1244 N ILE A 86 7.069 10.069 -4.689 1.00 0.00 N ATOM 1245 CA ILE A 86 7.727 10.975 -3.756 1.00 0.00 C ATOM 1246 C ILE A 86 8.512 12.051 -4.497 1.00 0.00 C ATOM 1247 O ILE A 86 8.984 11.833 -5.613 1.00 0.00 O ATOM 1248 CB ILE A 86 8.681 10.217 -2.813 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.692 9.397 -3.621 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.892 9.319 -1.871 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.092 9.969 -3.592 1.00 0.00 C ATOM 0 H ILE A 86 7.462 9.128 -4.712 1.00 0.00 H new ATOM 0 HA ILE A 86 6.941 11.444 -3.164 1.00 0.00 H new ATOM 0 HB ILE A 86 9.230 10.945 -2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.716 8.379 -3.232 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.354 9.336 -4.656 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.580 8.790 -1.211 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.211 9.926 -1.274 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.319 8.596 -2.452 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.755 9.338 -4.184 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.082 10.976 -4.008 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.449 10.005 -2.563 1.00 0.00 H new ATOM 1263 N ASN A 87 8.649 13.215 -3.869 1.00 0.00 N ATOM 1264 CA ASN A 87 9.377 14.327 -4.469 1.00 0.00 C ATOM 1265 C ASN A 87 10.867 14.236 -4.151 1.00 0.00 C ATOM 1266 O ASN A 87 11.280 13.469 -3.282 1.00 0.00 O ATOM 1267 CB ASN A 87 8.813 15.661 -3.971 1.00 0.00 C ATOM 1268 CG ASN A 87 8.342 16.549 -5.106 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.669 16.315 -6.270 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.569 17.576 -4.773 1.00 0.00 N ATOM 0 H ASN A 87 8.265 13.412 -2.945 1.00 0.00 H new ATOM 0 HA ASN A 87 9.253 14.271 -5.550 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.981 15.470 -3.293 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.578 16.184 -3.397 1.00 0.00 H new ATOM 0 HD21 ASN A 87 7.222 18.208 -5.494 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.322 17.733 -3.796 1.00 0.00 H new ATOM 1277 N SER A 88 11.667 15.025 -4.862 1.00 0.00 N ATOM 1278 CA SER A 88 13.111 15.033 -4.655 1.00 0.00 C ATOM 1279 C SER A 88 13.455 15.466 -3.234 1.00 0.00 C ATOM 1280 O SER A 88 14.446 15.015 -2.660 1.00 0.00 O ATOM 1281 CB SER A 88 13.784 15.967 -5.663 1.00 0.00 C ATOM 1282 OG SER A 88 13.255 17.278 -5.577 1.00 0.00 O ATOM 0 H SER A 88 11.340 15.666 -5.585 1.00 0.00 H new ATOM 0 HA SER A 88 13.481 14.019 -4.805 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.858 15.992 -5.479 1.00 0.00 H new ATOM 0 HB3 SER A 88 13.643 15.580 -6.672 1.00 0.00 H new ATOM 0 HG SER A 88 13.703 17.855 -6.230 1.00 0.00 H new ATOM 1288 N ASP A 89 12.631 16.344 -2.672 1.00 0.00 N ATOM 1289 CA ASP A 89 12.848 16.839 -1.317 1.00 0.00 C ATOM 1290 C ASP A 89 12.534 15.758 -0.287 1.00 0.00 C ATOM 1291 O ASP A 89 13.135 15.717 0.786 1.00 0.00 O ATOM 1292 CB ASP A 89 11.984 18.074 -1.057 1.00 0.00 C ATOM 1293 CG ASP A 89 12.693 19.363 -1.424 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.782 19.668 -2.632 1.00 0.00 O ATOM 1295 OD2 ASP A 89 13.160 20.066 -0.504 1.00 0.00 O ATOM 0 H ASP A 89 11.806 16.728 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 89 13.898 17.114 -1.221 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.060 17.995 -1.630 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.704 18.103 -0.004 1.00 0.00 H new ATOM 1300 N GLY A 90 11.588 14.887 -0.620 1.00 0.00 N ATOM 1301 CA GLY A 90 11.210 13.818 0.286 1.00 0.00 C ATOM 1302 C GLY A 90 9.761 13.912 0.723 1.00 0.00 C ATOM 1303 O GLY A 90 9.425 13.582 1.861 1.00 0.00 O ATOM 0 H GLY A 90 11.076 14.902 -1.502 1.00 0.00 H new ATOM 0 HA2 GLY A 90 11.378 12.857 -0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.854 13.847 1.165 1.00 0.00 H new ATOM 1307 N LEU A 91 8.900 14.365 -0.183 1.00 0.00 N ATOM 1308 CA LEU A 91 7.479 14.502 0.114 1.00 0.00 C ATOM 1309 C LEU A 91 6.651 13.542 -0.733 1.00 0.00 C ATOM 1310 O LEU A 91 6.959 13.304 -1.901 1.00 0.00 O ATOM 1311 CB LEU A 91 7.021 15.941 -0.134 1.00 0.00 C ATOM 1312 CG LEU A 91 5.703 16.326 0.543 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.968 17.085 1.834 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.842 17.157 -0.398 1.00 0.00 C ATOM 0 H LEU A 91 9.162 14.643 -1.129 1.00 0.00 H new ATOM 0 HA LEU A 91 7.328 14.255 1.165 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.801 16.619 0.211 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.918 16.094 -1.208 1.00 0.00 H new ATOM 0 HG LEU A 91 5.162 15.412 0.787 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.020 17.350 2.301 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.544 16.457 2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.530 17.992 1.614 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.909 17.421 0.100 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.377 18.066 -0.673 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.623 16.579 -1.296 1.00 0.00 H new ATOM 1326 N VAL A 92 5.598 12.993 -0.137 1.00 0.00 N ATOM 1327 CA VAL A 92 4.725 12.059 -0.837 1.00 0.00 C ATOM 1328 C VAL A 92 3.629 12.798 -1.598 1.00 0.00 C ATOM 1329 O VAL A 92 2.840 13.537 -1.007 1.00 0.00 O ATOM 1330 CB VAL A 92 4.074 11.060 0.137 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.326 9.977 -0.626 1.00 0.00 C ATOM 1332 CG2 VAL A 92 5.123 10.449 1.054 1.00 0.00 C ATOM 0 H VAL A 92 5.329 13.179 0.829 1.00 0.00 H new ATOM 0 HA VAL A 92 5.349 11.511 -1.543 1.00 0.00 H new ATOM 0 HB VAL A 92 3.354 11.599 0.753 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.873 9.281 0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.546 10.434 -1.236 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.022 9.439 -1.270 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.645 9.745 1.736 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.869 9.925 0.456 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.608 11.238 1.629 1.00 0.00 H new ATOM 1342 N VAL A 93 3.585 12.595 -2.911 1.00 0.00 N ATOM 1343 CA VAL A 93 2.587 13.245 -3.751 1.00 0.00 C ATOM 1344 C VAL A 93 2.048 12.286 -4.807 1.00 0.00 C ATOM 1345 O VAL A 93 2.459 11.127 -4.873 1.00 0.00 O ATOM 1346 CB VAL A 93 3.165 14.488 -4.451 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.523 15.558 -3.431 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.378 14.113 -5.289 1.00 0.00 C ATOM 0 H VAL A 93 4.229 11.986 -3.415 1.00 0.00 H new ATOM 0 HA VAL A 93 1.774 13.553 -3.094 1.00 0.00 H new ATOM 0 HB VAL A 93 2.403 14.894 -5.117 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.930 16.429 -3.945 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.629 15.848 -2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 93 4.267 15.165 -2.738 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.773 15.004 -5.776 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.145 13.681 -4.646 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.086 13.385 -6.046 1.00 0.00 H new ATOM 1358 N GLY A 94 1.128 12.776 -5.629 1.00 0.00 N ATOM 1359 CA GLY A 94 0.549 11.950 -6.672 1.00 0.00 C ATOM 1360 C GLY A 94 0.019 12.767 -7.834 1.00 0.00 C ATOM 1361 O GLY A 94 -1.165 13.100 -7.878 1.00 0.00 O ATOM 0 H GLY A 94 0.772 13.731 -5.592 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.302 11.251 -7.037 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.261 11.355 -6.251 1.00 0.00 H new ATOM 1365 N ARG A 95 0.898 13.090 -8.777 1.00 0.00 N ATOM 1366 CA ARG A 95 0.513 13.873 -9.944 1.00 0.00 C ATOM 1367 C ARG A 95 1.470 13.622 -11.106 1.00 0.00 C ATOM 1368 O ARG A 95 1.719 14.510 -11.920 1.00 0.00 O ATOM 1369 CB ARG A 95 0.489 15.364 -9.601 1.00 0.00 C ATOM 1370 CG ARG A 95 1.734 15.840 -8.870 1.00 0.00 C ATOM 1371 CD ARG A 95 1.669 17.330 -8.573 1.00 0.00 C ATOM 1372 NE ARG A 95 2.995 17.908 -8.378 1.00 0.00 N ATOM 1373 CZ ARG A 95 3.254 19.212 -8.450 1.00 0.00 C ATOM 1374 NH1 ARG A 95 2.281 20.075 -8.714 1.00 0.00 N ATOM 1375 NH2 ARG A 95 4.490 19.653 -8.258 1.00 0.00 N ATOM 0 H ARG A 95 1.882 12.821 -8.755 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.487 13.562 -10.245 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.376 15.938 -10.521 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -0.386 15.573 -8.985 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.844 15.286 -7.938 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.616 15.626 -9.474 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.168 17.842 -9.395 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.067 17.496 -7.680 1.00 0.00 H new ATOM 0 HE ARG A 95 3.769 17.276 -8.175 1.00 0.00 H new ATOM 0 HH11 ARG A 95 1.329 19.740 -8.863 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.485 21.073 -8.768 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.241 18.993 -8.055 1.00 0.00 H new ATOM 0 HH22 ARG A 95 4.689 20.652 -8.313 1.00 0.00 H new ATOM 1389 N SER A 96 2.003 12.406 -11.174 1.00 0.00 N ATOM 1390 CA SER A 96 2.932 12.038 -12.235 1.00 0.00 C ATOM 1391 C SER A 96 2.259 11.129 -13.258 1.00 0.00 C ATOM 1392 O SER A 96 2.494 11.251 -14.461 1.00 0.00 O ATOM 1393 CB SER A 96 4.160 11.341 -11.646 1.00 0.00 C ATOM 1394 OG SER A 96 5.347 11.767 -12.291 1.00 0.00 O ATOM 0 H SER A 96 1.807 11.660 -10.507 1.00 0.00 H new ATOM 0 HA SER A 96 3.247 12.951 -12.740 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.226 11.554 -10.579 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.054 10.261 -11.750 1.00 0.00 H new ATOM 0 HG SER A 96 6.117 11.308 -11.895 1.00 0.00 H new ATOM 1400 N ASP A 97 1.421 10.219 -12.773 1.00 0.00 N ATOM 1401 CA ASP A 97 0.713 9.289 -13.644 1.00 0.00 C ATOM 1402 C ASP A 97 1.696 8.419 -14.422 1.00 0.00 C ATOM 1403 O ASP A 97 1.424 8.016 -15.553 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.192 10.055 -14.613 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.656 9.710 -14.431 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.051 8.584 -14.797 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.409 10.567 -13.920 1.00 0.00 O ATOM 0 H ASP A 97 1.216 10.106 -11.780 1.00 0.00 H new ATOM 0 HA ASP A 97 0.097 8.640 -13.021 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.053 11.126 -14.466 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.106 9.832 -15.637 1.00 0.00 H new ATOM 1412 N ALA A 98 2.839 8.133 -13.808 1.00 0.00 N ATOM 1413 CA ALA A 98 3.863 7.311 -14.441 1.00 0.00 C ATOM 1414 C ALA A 98 4.593 6.454 -13.413 1.00 0.00 C ATOM 1415 O ALA A 98 4.839 6.891 -12.289 1.00 0.00 O ATOM 1416 CB ALA A 98 4.850 8.189 -15.196 1.00 0.00 C ATOM 0 H ALA A 98 3.079 8.459 -12.872 1.00 0.00 H new ATOM 0 HA ALA A 98 3.372 6.643 -15.148 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.610 7.563 -15.664 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.321 8.754 -15.964 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.327 8.880 -14.501 1.00 0.00 H new ATOM 1422 N ILE A 99 4.938 5.232 -13.805 1.00 0.00 N ATOM 1423 CA ILE A 99 5.640 4.313 -12.918 1.00 0.00 C ATOM 1424 C ILE A 99 7.143 4.570 -12.939 1.00 0.00 C ATOM 1425 O ILE A 99 7.901 3.836 -13.574 1.00 0.00 O ATOM 1426 CB ILE A 99 5.374 2.846 -13.302 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.874 2.606 -13.484 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.941 1.910 -12.245 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.552 1.310 -14.194 1.00 0.00 C ATOM 0 H ILE A 99 4.742 4.855 -14.732 1.00 0.00 H new ATOM 0 HA ILE A 99 5.258 4.490 -11.913 1.00 0.00 H new ATOM 0 HB ILE A 99 5.873 2.639 -14.249 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.393 2.604 -12.506 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.447 3.436 -14.048 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.745 0.877 -12.531 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.017 2.065 -12.161 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.468 2.117 -11.285 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.471 1.206 -14.288 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.004 1.317 -15.186 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.949 0.472 -13.620 1.00 0.00 H new ATOM 1441 N GLY A 100 7.568 5.618 -12.240 1.00 0.00 N ATOM 1442 CA GLY A 100 8.979 5.954 -12.191 1.00 0.00 C ATOM 1443 C GLY A 100 9.649 5.466 -10.921 1.00 0.00 C ATOM 1444 O GLY A 100 8.978 4.962 -10.019 1.00 0.00 O ATOM 0 H GLY A 100 6.961 6.240 -11.707 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.483 5.519 -13.054 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.094 7.035 -12.266 1.00 0.00 H new ATOM 1448 N PRO A 101 10.981 5.602 -10.818 1.00 0.00 N ATOM 1449 CA PRO A 101 11.732 5.166 -9.635 1.00 0.00 C ATOM 1450 C PRO A 101 11.152 5.729 -8.342 1.00 0.00 C ATOM 1451 O PRO A 101 11.139 5.055 -7.311 1.00 0.00 O ATOM 1452 CB PRO A 101 13.136 5.723 -9.878 1.00 0.00 C ATOM 1453 CG PRO A 101 13.241 5.851 -11.359 1.00 0.00 C ATOM 1454 CD PRO A 101 11.860 6.192 -11.845 1.00 0.00 C ATOM 0 HA PRO A 101 11.705 4.083 -9.512 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.270 6.687 -9.387 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.901 5.055 -9.483 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.954 6.628 -11.634 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.594 4.922 -11.807 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.717 7.270 -11.925 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.665 5.770 -12.831 1.00 0.00 H new ATOM 1462 N ARG A 102 10.674 6.967 -8.402 1.00 0.00 N ATOM 1463 CA ARG A 102 10.092 7.620 -7.234 1.00 0.00 C ATOM 1464 C ARG A 102 8.737 7.009 -6.888 1.00 0.00 C ATOM 1465 O ARG A 102 8.382 6.887 -5.717 1.00 0.00 O ATOM 1466 CB ARG A 102 9.934 9.120 -7.488 1.00 0.00 C ATOM 1467 CG ARG A 102 11.253 9.846 -7.700 1.00 0.00 C ATOM 1468 CD ARG A 102 11.048 11.348 -7.828 1.00 0.00 C ATOM 1469 NE ARG A 102 11.332 11.826 -9.180 1.00 0.00 N ATOM 1470 CZ ARG A 102 10.816 12.939 -9.698 1.00 0.00 C ATOM 1471 NH1 ARG A 102 9.994 13.697 -8.982 1.00 0.00 N ATOM 1472 NH2 ARG A 102 11.125 13.297 -10.937 1.00 0.00 N ATOM 0 H ARG A 102 10.678 7.539 -9.247 1.00 0.00 H new ATOM 0 HA ARG A 102 10.767 7.469 -6.391 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.304 9.267 -8.365 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.414 9.570 -6.643 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.922 9.639 -6.865 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.738 9.466 -8.599 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.020 11.598 -7.564 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.694 11.864 -7.118 1.00 0.00 H new ATOM 0 HE ARG A 102 11.963 11.274 -9.761 1.00 0.00 H new ATOM 0 HH11 ARG A 102 9.754 13.428 -8.028 1.00 0.00 H new ATOM 0 HH12 ARG A 102 9.603 14.548 -9.386 1.00 0.00 H new ATOM 0 HH21 ARG A 102 11.757 12.720 -11.492 1.00 0.00 H new ATOM 0 HH22 ARG A 102 10.730 14.149 -11.335 1.00 0.00 H new ATOM 1486 N GLU A 103 7.986 6.631 -7.917 1.00 0.00 N ATOM 1487 CA GLU A 103 6.668 6.035 -7.724 1.00 0.00 C ATOM 1488 C GLU A 103 6.778 4.627 -7.147 1.00 0.00 C ATOM 1489 O GLU A 103 5.844 4.132 -6.515 1.00 0.00 O ATOM 1490 CB GLU A 103 5.906 5.998 -9.049 1.00 0.00 C ATOM 1491 CG GLU A 103 5.266 7.325 -9.421 1.00 0.00 C ATOM 1492 CD GLU A 103 6.239 8.270 -10.101 1.00 0.00 C ATOM 1493 OE1 GLU A 103 6.931 7.832 -11.044 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.308 9.448 -9.690 1.00 0.00 O ATOM 0 H GLU A 103 8.267 6.726 -8.893 1.00 0.00 H new ATOM 0 HA GLU A 103 6.121 6.653 -7.012 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.590 5.699 -9.843 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.131 5.234 -8.991 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.419 7.143 -10.083 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.872 7.799 -8.522 1.00 0.00 H new ATOM 1501 N GLN A 104 7.920 3.983 -7.368 1.00 0.00 N ATOM 1502 CA GLN A 104 8.145 2.631 -6.869 1.00 0.00 C ATOM 1503 C GLN A 104 7.978 2.570 -5.353 1.00 0.00 C ATOM 1504 O GLN A 104 8.229 3.550 -4.651 1.00 0.00 O ATOM 1505 CB GLN A 104 9.543 2.147 -7.258 1.00 0.00 C ATOM 1506 CG GLN A 104 9.736 1.991 -8.757 1.00 0.00 C ATOM 1507 CD GLN A 104 10.521 0.746 -9.118 1.00 0.00 C ATOM 1508 OE1 GLN A 104 10.197 -0.356 -8.674 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.561 0.914 -9.927 1.00 0.00 N ATOM 0 H GLN A 104 8.704 4.376 -7.889 1.00 0.00 H new ATOM 0 HA GLN A 104 7.400 1.978 -7.323 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.282 2.851 -6.876 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.735 1.190 -6.774 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.761 1.955 -9.243 1.00 0.00 H new ATOM 0 HG3 GLN A 104 10.254 2.868 -9.146 1.00 0.00 H new ATOM 0 HE21 GLN A 104 11.794 1.845 -10.272 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.127 0.112 -10.204 1.00 0.00 H new ATOM 1518 N TRP A 105 7.552 1.412 -4.856 1.00 0.00 N ATOM 1519 CA TRP A 105 7.351 1.220 -3.425 1.00 0.00 C ATOM 1520 C TRP A 105 7.859 -0.149 -2.986 1.00 0.00 C ATOM 1521 O TRP A 105 7.603 -1.156 -3.644 1.00 0.00 O ATOM 1522 CB TRP A 105 5.869 1.364 -3.072 1.00 0.00 C ATOM 1523 CG TRP A 105 5.336 2.746 -3.299 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.530 3.155 -4.321 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.571 3.901 -2.486 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.249 4.494 -4.194 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.877 4.974 -3.075 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.301 4.132 -1.316 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.891 6.257 -2.534 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.315 5.407 -0.780 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.614 6.454 -1.389 1.00 0.00 C ATOM 0 H TRP A 105 7.339 0.592 -5.425 1.00 0.00 H new ATOM 0 HA TRP A 105 7.918 1.986 -2.897 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.291 0.657 -3.667 1.00 0.00 H new ATOM 0 HB3 TRP A 105 5.724 1.094 -2.026 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.166 2.519 -5.114 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.668 5.041 -4.829 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.844 3.329 -0.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.351 7.067 -3.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.876 5.598 0.123 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.644 7.438 -0.946 1.00 0.00 H new ATOM 1542 N GLU A 106 8.580 -0.178 -1.869 1.00 0.00 N ATOM 1543 CA GLU A 106 9.126 -1.425 -1.343 1.00 0.00 C ATOM 1544 C GLU A 106 8.682 -1.650 0.101 1.00 0.00 C ATOM 1545 O GLU A 106 9.304 -1.141 1.034 1.00 0.00 O ATOM 1546 CB GLU A 106 10.653 -1.409 -1.421 1.00 0.00 C ATOM 1547 CG GLU A 106 11.283 -2.786 -1.286 1.00 0.00 C ATOM 1548 CD GLU A 106 12.538 -2.770 -0.435 1.00 0.00 C ATOM 1549 OE1 GLU A 106 12.413 -2.727 0.807 1.00 0.00 O ATOM 1550 OE2 GLU A 106 13.646 -2.802 -1.011 1.00 0.00 O ATOM 0 H GLU A 106 8.800 0.647 -1.311 1.00 0.00 H new ATOM 0 HA GLU A 106 8.745 -2.244 -1.953 1.00 0.00 H new ATOM 0 HB2 GLU A 106 10.955 -0.972 -2.373 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.042 -0.762 -0.635 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.559 -3.472 -0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.525 -3.170 -2.277 1.00 0.00 H new ATOM 1557 N PRO A 107 7.598 -2.420 0.308 1.00 0.00 N ATOM 1558 CA PRO A 107 7.081 -2.707 1.649 1.00 0.00 C ATOM 1559 C PRO A 107 8.013 -3.612 2.447 1.00 0.00 C ATOM 1560 O PRO A 107 8.659 -4.500 1.889 1.00 0.00 O ATOM 1561 CB PRO A 107 5.753 -3.417 1.376 1.00 0.00 C ATOM 1562 CG PRO A 107 5.913 -4.015 0.022 1.00 0.00 C ATOM 1563 CD PRO A 107 6.794 -3.069 -0.745 1.00 0.00 C ATOM 0 HA PRO A 107 6.980 -1.802 2.248 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.552 -4.183 2.125 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.917 -2.718 1.403 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.364 -5.006 0.083 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.947 -4.134 -0.469 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.422 -3.597 -1.462 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.209 -2.343 -1.309 1.00 0.00 H new ATOM 1571 N VAL A 108 8.082 -3.380 3.753 1.00 0.00 N ATOM 1572 CA VAL A 108 8.937 -4.174 4.626 1.00 0.00 C ATOM 1573 C VAL A 108 8.172 -4.664 5.852 1.00 0.00 C ATOM 1574 O VAL A 108 7.486 -3.889 6.517 1.00 0.00 O ATOM 1575 CB VAL A 108 10.167 -3.371 5.089 1.00 0.00 C ATOM 1576 CG1 VAL A 108 11.146 -4.270 5.829 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.841 -2.697 3.904 1.00 0.00 C ATOM 0 H VAL A 108 7.556 -2.648 4.230 1.00 0.00 H new ATOM 0 HA VAL A 108 9.271 -5.033 4.044 1.00 0.00 H new ATOM 0 HB VAL A 108 9.833 -2.595 5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 108 12.008 -3.684 6.148 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.656 -4.700 6.703 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.476 -5.071 5.167 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.708 -2.134 4.250 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.162 -3.454 3.189 1.00 0.00 H new ATOM 0 HG23 VAL A 108 10.137 -2.019 3.422 1.00 0.00 H new ATOM 1587 N PHE A 109 8.297 -5.954 6.143 1.00 0.00 N ATOM 1588 CA PHE A 109 7.617 -6.548 7.289 1.00 0.00 C ATOM 1589 C PHE A 109 8.619 -6.940 8.372 1.00 0.00 C ATOM 1590 O PHE A 109 9.524 -7.739 8.133 1.00 0.00 O ATOM 1591 CB PHE A 109 6.816 -7.776 6.853 1.00 0.00 C ATOM 1592 CG PHE A 109 5.854 -7.497 5.733 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.293 -7.467 4.418 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.513 -7.266 5.993 1.00 0.00 C ATOM 1595 CE1 PHE A 109 5.411 -7.211 3.385 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.627 -7.009 4.964 1.00 0.00 C ATOM 1597 CZ PHE A 109 4.078 -6.982 3.659 1.00 0.00 C ATOM 0 H PHE A 109 8.862 -6.608 5.602 1.00 0.00 H new ATOM 0 HA PHE A 109 6.935 -5.804 7.701 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.507 -8.559 6.541 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.263 -8.162 7.709 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.335 -7.646 4.199 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.156 -7.287 7.012 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.765 -7.190 2.365 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.584 -6.830 5.180 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.388 -6.782 2.853 1.00 0.00 H new ATOM 1607 N GLN A 110 8.451 -6.372 9.561 1.00 0.00 N ATOM 1608 CA GLN A 110 9.341 -6.663 10.679 1.00 0.00 C ATOM 1609 C GLN A 110 8.606 -6.539 12.010 1.00 0.00 C ATOM 1610 O GLN A 110 7.877 -5.574 12.239 1.00 0.00 O ATOM 1611 CB GLN A 110 10.546 -5.721 10.656 1.00 0.00 C ATOM 1612 CG GLN A 110 11.855 -6.396 11.032 1.00 0.00 C ATOM 1613 CD GLN A 110 13.063 -5.702 10.434 1.00 0.00 C ATOM 1614 OE1 GLN A 110 13.133 -5.487 9.223 1.00 0.00 O ATOM 1615 NE2 GLN A 110 14.021 -5.346 11.281 1.00 0.00 N ATOM 0 H GLN A 110 7.707 -5.708 9.776 1.00 0.00 H new ATOM 0 HA GLN A 110 9.690 -7.690 10.575 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.642 -5.292 9.659 1.00 0.00 H new ATOM 0 HB3 GLN A 110 10.363 -4.894 11.342 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.951 -6.414 12.118 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.834 -7.433 10.697 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.921 -5.544 12.277 1.00 0.00 H new ATOM 0 HE22 GLN A 110 14.857 -4.874 10.936 1.00 0.00 H new ATOM 1624 N ASP A 111 8.806 -7.521 12.883 1.00 0.00 N ATOM 1625 CA ASP A 111 8.165 -7.522 14.193 1.00 0.00 C ATOM 1626 C ASP A 111 6.645 -7.500 14.057 1.00 0.00 C ATOM 1627 O ASP A 111 5.962 -6.716 14.717 1.00 0.00 O ATOM 1628 CB ASP A 111 8.635 -6.319 15.015 1.00 0.00 C ATOM 1629 CG ASP A 111 9.897 -6.615 15.801 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.872 -7.542 16.639 1.00 0.00 O ATOM 1631 OD2 ASP A 111 10.910 -5.918 15.582 1.00 0.00 O ATOM 0 H ASP A 111 9.407 -8.326 12.707 1.00 0.00 H new ATOM 0 HA ASP A 111 8.451 -8.439 14.709 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.814 -5.475 14.349 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.844 -6.020 15.702 1.00 0.00 H new ATOM 1636 N GLY A 112 6.120 -8.367 13.197 1.00 0.00 N ATOM 1637 CA GLY A 112 4.685 -8.432 12.989 1.00 0.00 C ATOM 1638 C GLY A 112 4.100 -7.106 12.543 1.00 0.00 C ATOM 1639 O GLY A 112 2.921 -6.834 12.768 1.00 0.00 O ATOM 0 H GLY A 112 6.663 -9.026 12.640 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.464 -9.193 12.240 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.201 -8.746 13.914 1.00 0.00 H new ATOM 1643 N LYS A 113 4.926 -6.278 11.910 1.00 0.00 N ATOM 1644 CA LYS A 113 4.482 -4.975 11.432 1.00 0.00 C ATOM 1645 C LYS A 113 4.808 -4.799 9.953 1.00 0.00 C ATOM 1646 O LYS A 113 5.421 -5.669 9.334 1.00 0.00 O ATOM 1647 CB LYS A 113 5.140 -3.859 12.246 1.00 0.00 C ATOM 1648 CG LYS A 113 4.737 -3.857 13.712 1.00 0.00 C ATOM 1649 CD LYS A 113 5.759 -3.127 14.568 1.00 0.00 C ATOM 1650 CE LYS A 113 5.184 -2.750 15.924 1.00 0.00 C ATOM 1651 NZ LYS A 113 5.581 -3.717 16.984 1.00 0.00 N ATOM 0 H LYS A 113 5.905 -6.487 11.717 1.00 0.00 H new ATOM 0 HA LYS A 113 3.401 -4.919 11.557 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.223 -3.959 12.176 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.880 -2.897 11.805 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.762 -3.382 13.822 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.633 -4.883 14.063 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.636 -3.759 14.707 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.092 -2.228 14.050 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.525 -1.751 16.198 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.097 -2.709 15.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 5.169 -3.424 17.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.234 -4.666 16.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.618 -3.737 17.065 1.00 0.00 H new ATOM 1665 N MET A 114 4.393 -3.668 9.390 1.00 0.00 N ATOM 1666 CA MET A 114 4.641 -3.378 7.983 1.00 0.00 C ATOM 1667 C MET A 114 4.697 -1.875 7.738 1.00 0.00 C ATOM 1668 O MET A 114 3.801 -1.135 8.143 1.00 0.00 O ATOM 1669 CB MET A 114 3.553 -4.009 7.112 1.00 0.00 C ATOM 1670 CG MET A 114 2.143 -3.736 7.609 1.00 0.00 C ATOM 1671 SD MET A 114 1.096 -5.204 7.579 1.00 0.00 S ATOM 1672 CE MET A 114 0.358 -5.061 5.953 1.00 0.00 C ATOM 0 H MET A 114 3.883 -2.938 9.887 1.00 0.00 H new ATOM 0 HA MET A 114 5.606 -3.807 7.714 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.650 -3.632 6.094 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.712 -5.086 7.070 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.190 -3.349 8.627 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.690 -2.959 6.993 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.711 -5.261 6.020 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.516 -4.053 5.569 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.820 -5.782 5.279 1.00 0.00 H new ATOM 1682 N ALA A 115 5.758 -1.429 7.073 1.00 0.00 N ATOM 1683 CA ALA A 115 5.934 -0.013 6.773 1.00 0.00 C ATOM 1684 C ALA A 115 6.416 0.188 5.340 1.00 0.00 C ATOM 1685 O ALA A 115 7.440 -0.365 4.937 1.00 0.00 O ATOM 1686 CB ALA A 115 6.910 0.618 7.753 1.00 0.00 C ATOM 0 H ALA A 115 6.509 -2.029 6.732 1.00 0.00 H new ATOM 0 HA ALA A 115 4.966 0.477 6.876 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.031 1.675 7.516 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.525 0.515 8.767 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.875 0.117 7.679 1.00 0.00 H new ATOM 1692 N LEU A 116 5.673 0.980 4.575 1.00 0.00 N ATOM 1693 CA LEU A 116 6.026 1.252 3.187 1.00 0.00 C ATOM 1694 C LEU A 116 7.302 2.084 3.103 1.00 0.00 C ATOM 1695 O LEU A 116 7.439 3.099 3.784 1.00 0.00 O ATOM 1696 CB LEU A 116 4.878 1.977 2.480 1.00 0.00 C ATOM 1697 CG LEU A 116 4.569 1.476 1.068 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.282 -0.018 1.083 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.392 2.240 0.479 1.00 0.00 C ATOM 0 H LEU A 116 4.823 1.445 4.893 1.00 0.00 H new ATOM 0 HA LEU A 116 6.204 0.299 2.689 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.979 1.881 3.088 1.00 0.00 H new ATOM 0 HB3 LEU A 116 5.116 3.039 2.428 1.00 0.00 H new ATOM 0 HG LEU A 116 5.443 1.651 0.440 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.064 -0.357 0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.152 -0.552 1.465 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.424 -0.217 1.725 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.185 1.871 -0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.513 2.095 1.107 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.634 3.302 0.433 1.00 0.00 H new ATOM 1711 N LEU A 117 8.234 1.644 2.264 1.00 0.00 N ATOM 1712 CA LEU A 117 9.501 2.345 2.092 1.00 0.00 C ATOM 1713 C LEU A 117 9.508 3.150 0.797 1.00 0.00 C ATOM 1714 O LEU A 117 9.215 2.623 -0.276 1.00 0.00 O ATOM 1715 CB LEU A 117 10.663 1.350 2.092 1.00 0.00 C ATOM 1716 CG LEU A 117 12.058 1.981 2.079 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.647 2.003 3.480 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.974 1.230 1.125 1.00 0.00 C ATOM 0 H LEU A 117 8.136 0.805 1.692 1.00 0.00 H new ATOM 0 HA LEU A 117 9.621 3.034 2.928 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.577 0.714 2.973 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.566 0.702 1.221 1.00 0.00 H new ATOM 0 HG LEU A 117 11.967 3.009 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.638 2.455 3.451 1.00 0.00 H new ATOM 0 HD12 LEU A 117 12.002 2.586 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.724 0.984 3.858 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.961 1.692 1.129 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.059 0.191 1.444 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.560 1.267 0.118 1.00 0.00 H new ATOM 1730 N ALA A 118 9.847 4.431 0.904 1.00 0.00 N ATOM 1731 CA ALA A 118 9.895 5.310 -0.258 1.00 0.00 C ATOM 1732 C ALA A 118 11.169 5.085 -1.063 1.00 0.00 C ATOM 1733 O ALA A 118 12.129 4.493 -0.570 1.00 0.00 O ATOM 1734 CB ALA A 118 9.793 6.765 0.177 1.00 0.00 C ATOM 0 H ALA A 118 10.093 4.883 1.785 1.00 0.00 H new ATOM 0 HA ALA A 118 9.045 5.073 -0.898 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.830 7.411 -0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.852 6.922 0.704 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.624 7.006 0.840 1.00 0.00 H new ATOM 1740 N SER A 119 11.172 5.565 -2.301 1.00 0.00 N ATOM 1741 CA SER A 119 12.331 5.419 -3.175 1.00 0.00 C ATOM 1742 C SER A 119 13.572 6.052 -2.548 1.00 0.00 C ATOM 1743 O SER A 119 14.699 5.722 -2.915 1.00 0.00 O ATOM 1744 CB SER A 119 12.052 6.056 -4.537 1.00 0.00 C ATOM 1745 OG SER A 119 13.251 6.243 -5.269 1.00 0.00 O ATOM 0 H SER A 119 10.385 6.059 -2.723 1.00 0.00 H new ATOM 0 HA SER A 119 12.519 4.354 -3.311 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.371 5.423 -5.105 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.554 7.016 -4.398 1.00 0.00 H new ATOM 0 HG SER A 119 13.045 6.650 -6.136 1.00 0.00 H new ATOM 1751 N ASN A 120 13.357 6.964 -1.602 1.00 0.00 N ATOM 1752 CA ASN A 120 14.460 7.640 -0.928 1.00 0.00 C ATOM 1753 C ASN A 120 14.794 6.960 0.398 1.00 0.00 C ATOM 1754 O ASN A 120 15.351 7.584 1.301 1.00 0.00 O ATOM 1755 CB ASN A 120 14.109 9.109 -0.684 1.00 0.00 C ATOM 1756 CG ASN A 120 12.803 9.272 0.067 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.122 8.292 0.371 1.00 0.00 O ATOM 1758 ND2 ASN A 120 12.445 10.513 0.373 1.00 0.00 N ATOM 0 H ASN A 120 12.430 7.250 -1.286 1.00 0.00 H new ATOM 0 HA ASN A 120 15.336 7.581 -1.574 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.912 9.583 -0.119 1.00 0.00 H new ATOM 0 HB3 ASN A 120 14.043 9.628 -1.640 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.576 10.683 0.879 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.039 11.297 0.102 1.00 0.00 H new ATOM 1765 N SER A 121 14.453 5.679 0.509 1.00 0.00 N ATOM 1766 CA SER A 121 14.718 4.917 1.725 1.00 0.00 C ATOM 1767 C SER A 121 14.128 5.613 2.950 1.00 0.00 C ATOM 1768 O SER A 121 14.756 5.671 4.007 1.00 0.00 O ATOM 1769 CB SER A 121 16.225 4.723 1.909 1.00 0.00 C ATOM 1770 OG SER A 121 16.517 3.419 2.381 1.00 0.00 O ATOM 0 H SER A 121 13.992 5.147 -0.229 1.00 0.00 H new ATOM 0 HA SER A 121 14.241 3.942 1.623 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.735 4.893 0.961 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.607 5.462 2.613 1.00 0.00 H new ATOM 0 HG SER A 121 17.486 3.320 2.489 1.00 0.00 H new ATOM 1776 N CYS A 122 12.918 6.142 2.799 1.00 0.00 N ATOM 1777 CA CYS A 122 12.244 6.833 3.892 1.00 0.00 C ATOM 1778 C CYS A 122 10.805 6.345 4.040 1.00 0.00 C ATOM 1779 O CYS A 122 9.991 6.499 3.130 1.00 0.00 O ATOM 1780 CB CYS A 122 12.259 8.344 3.655 1.00 0.00 C ATOM 1781 SG CYS A 122 13.797 9.153 4.154 1.00 0.00 S ATOM 0 H CYS A 122 12.384 6.105 1.930 1.00 0.00 H new ATOM 0 HA CYS A 122 12.781 6.611 4.814 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.086 8.537 2.596 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.430 8.795 4.200 1.00 0.00 H new ATOM 0 HG CYS A 122 13.715 10.428 3.913 1.00 0.00 H new ATOM 1787 N PHE A 123 10.500 5.758 5.191 1.00 0.00 N ATOM 1788 CA PHE A 123 9.159 5.248 5.456 1.00 0.00 C ATOM 1789 C PHE A 123 8.127 6.370 5.387 1.00 0.00 C ATOM 1790 O PHE A 123 8.374 7.482 5.854 1.00 0.00 O ATOM 1791 CB PHE A 123 9.109 4.574 6.828 1.00 0.00 C ATOM 1792 CG PHE A 123 9.910 3.306 6.902 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.548 2.197 6.155 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.026 3.223 7.721 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.284 1.030 6.221 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.765 2.058 7.791 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.394 0.960 7.041 1.00 0.00 C ATOM 0 H PHE A 123 11.162 5.623 5.955 1.00 0.00 H new ATOM 0 HA PHE A 123 8.919 4.511 4.689 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.477 5.271 7.580 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.071 4.354 7.078 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.680 2.245 5.514 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.321 4.079 8.311 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.992 0.173 5.632 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.633 2.006 8.432 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.970 0.048 7.095 1.00 0.00 H new ATOM 1807 N ILE A 124 6.973 6.070 4.802 1.00 0.00 N ATOM 1808 CA ILE A 124 5.905 7.053 4.671 1.00 0.00 C ATOM 1809 C ILE A 124 5.254 7.340 6.021 1.00 0.00 C ATOM 1810 O ILE A 124 5.358 6.544 6.953 1.00 0.00 O ATOM 1811 CB ILE A 124 4.822 6.580 3.682 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.321 5.187 4.069 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.366 6.579 2.262 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.036 4.793 3.372 1.00 0.00 C ATOM 0 H ILE A 124 6.753 5.154 4.411 1.00 0.00 H new ATOM 0 HA ILE A 124 6.361 7.966 4.288 1.00 0.00 H new ATOM 0 HB ILE A 124 3.982 7.273 3.727 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.092 4.454 3.834 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.166 5.152 5.147 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.589 6.243 1.575 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.678 7.588 1.991 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.221 5.906 2.200 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.739 3.795 3.693 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.251 5.505 3.627 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.192 4.796 2.293 1.00 0.00 H new ATOM 1826 N ARG A 125 4.584 8.483 6.116 1.00 0.00 N ATOM 1827 CA ARG A 125 3.916 8.877 7.351 1.00 0.00 C ATOM 1828 C ARG A 125 3.070 10.128 7.138 1.00 0.00 C ATOM 1829 O ARG A 125 3.326 10.915 6.228 1.00 0.00 O ATOM 1830 CB ARG A 125 4.946 9.126 8.455 1.00 0.00 C ATOM 1831 CG ARG A 125 4.328 9.505 9.790 1.00 0.00 C ATOM 1832 CD ARG A 125 5.394 9.773 10.840 1.00 0.00 C ATOM 1833 NE ARG A 125 4.937 9.431 12.185 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.045 10.144 12.869 1.00 0.00 C ATOM 1835 NH1 ARG A 125 3.510 11.236 12.337 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.687 9.763 14.087 1.00 0.00 N ATOM 0 H ARG A 125 4.489 9.153 5.353 1.00 0.00 H new ATOM 0 HA ARG A 125 3.258 8.063 7.654 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.550 8.228 8.586 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.621 9.921 8.138 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.707 10.392 9.666 1.00 0.00 H new ATOM 0 HG3 ARG A 125 3.674 8.702 10.130 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.288 9.197 10.604 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.676 10.825 10.810 1.00 0.00 H new ATOM 0 HE ARG A 125 5.324 8.597 12.626 1.00 0.00 H new ATOM 0 HH11 ARG A 125 3.782 11.532 11.400 1.00 0.00 H new ATOM 0 HH12 ARG A 125 2.827 11.779 12.865 1.00 0.00 H new ATOM 0 HH21 ARG A 125 4.095 8.924 14.499 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.004 10.309 14.612 1.00 0.00 H new ATOM 1850 N CYS A 126 2.061 10.305 7.985 1.00 0.00 N ATOM 1851 CA CYS A 126 1.177 11.461 7.888 1.00 0.00 C ATOM 1852 C CYS A 126 1.430 12.436 9.034 1.00 0.00 C ATOM 1853 O CYS A 126 1.436 12.049 10.202 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.286 11.014 7.898 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.706 9.892 9.253 1.00 0.00 S ATOM 0 H CYS A 126 1.835 9.664 8.745 1.00 0.00 H new ATOM 0 HA CYS A 126 1.387 11.970 6.947 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.924 11.896 7.960 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.511 10.523 6.951 1.00 0.00 H new ATOM 0 HG CYS A 126 -0.032 10.222 10.314 1.00 0.00 H new ATOM 1861 N ASN A 127 1.637 13.703 8.690 1.00 0.00 N ATOM 1862 CA ASN A 127 1.891 14.735 9.689 1.00 0.00 C ATOM 1863 C ASN A 127 0.612 15.092 10.439 1.00 0.00 C ATOM 1864 O ASN A 127 -0.473 14.620 10.096 1.00 0.00 O ATOM 1865 CB ASN A 127 2.476 15.984 9.026 1.00 0.00 C ATOM 1866 CG ASN A 127 3.980 16.078 9.195 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.549 15.502 10.122 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.632 16.809 8.299 1.00 0.00 N ATOM 0 H ASN A 127 1.634 14.040 7.727 1.00 0.00 H new ATOM 0 HA ASN A 127 2.612 14.343 10.406 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.232 15.976 7.964 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.009 16.871 9.453 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.645 16.910 8.363 1.00 0.00 H new ATOM 0 HD22 ASN A 127 4.120 17.269 7.546 1.00 0.00 H new ATOM 1875 N GLU A 128 0.745 15.926 11.465 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.400 16.346 12.263 1.00 0.00 C ATOM 1877 C GLU A 128 -1.107 17.535 11.619 1.00 0.00 C ATOM 1878 O GLU A 128 -2.322 17.688 11.741 1.00 0.00 O ATOM 1879 CB GLU A 128 0.045 16.710 13.680 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.109 16.891 14.653 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.721 17.700 15.875 1.00 0.00 C ATOM 1882 OE1 GLU A 128 0.453 17.617 16.293 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -1.590 18.417 16.414 1.00 0.00 O ATOM 0 H GLU A 128 1.635 16.324 11.763 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.101 15.513 12.312 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.707 15.930 14.056 1.00 0.00 H new ATOM 0 HB3 GLU A 128 0.627 17.631 13.644 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.936 17.385 14.142 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -1.469 15.912 14.969 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.336 18.373 10.934 1.00 0.00 N ATOM 1891 CA ALA A 129 -0.887 19.549 10.271 1.00 0.00 C ATOM 1892 C ALA A 129 -1.676 19.158 9.026 1.00 0.00 C ATOM 1893 O ALA A 129 -2.768 19.672 8.784 1.00 0.00 O ATOM 1894 CB ALA A 129 0.226 20.520 9.909 1.00 0.00 C ATOM 0 H ALA A 129 0.672 18.260 10.824 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.571 20.039 10.964 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.200 21.393 9.415 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.745 20.833 10.815 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.931 20.031 9.237 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.116 18.245 8.239 1.00 0.00 N ATOM 1901 CA GLY A 130 -1.780 17.800 7.029 1.00 0.00 C ATOM 1902 C GLY A 130 -0.830 17.692 5.852 1.00 0.00 C ATOM 1903 O GLY A 130 -1.140 18.150 4.752 1.00 0.00 O ATOM 0 H GLY A 130 -0.213 17.805 8.418 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.243 16.830 7.208 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.582 18.495 6.782 1.00 0.00 H new ATOM 1907 N ASP A 131 0.329 17.084 6.084 1.00 0.00 N ATOM 1908 CA ASP A 131 1.327 16.919 5.034 1.00 0.00 C ATOM 1909 C ASP A 131 1.928 15.517 5.071 1.00 0.00 C ATOM 1910 O ASP A 131 2.815 15.232 5.874 1.00 0.00 O ATOM 1911 CB ASP A 131 2.434 17.963 5.184 1.00 0.00 C ATOM 1912 CG ASP A 131 1.980 19.351 4.774 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.861 19.747 5.161 1.00 0.00 O ATOM 1914 OD2 ASP A 131 2.742 20.040 4.065 1.00 0.00 O ATOM 0 H ASP A 131 0.600 16.698 6.989 1.00 0.00 H new ATOM 0 HA ASP A 131 0.833 17.059 4.073 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.770 17.985 6.221 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.291 17.670 4.577 1.00 0.00 H new ATOM 1919 N ILE A 132 1.438 14.646 4.195 1.00 0.00 N ATOM 1920 CA ILE A 132 1.927 13.274 4.126 1.00 0.00 C ATOM 1921 C ILE A 132 3.313 13.217 3.493 1.00 0.00 C ATOM 1922 O ILE A 132 3.448 13.256 2.270 1.00 0.00 O ATOM 1923 CB ILE A 132 0.970 12.374 3.322 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.469 12.558 3.810 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.392 10.918 3.435 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -1.475 11.719 3.052 1.00 0.00 C ATOM 0 H ILE A 132 0.703 14.866 3.523 1.00 0.00 H new ATOM 0 HA ILE A 132 1.982 12.906 5.151 1.00 0.00 H new ATOM 0 HB ILE A 132 1.017 12.664 2.272 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.520 12.304 4.869 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.743 13.609 3.720 1.00 0.00 H new ATOM 0 HG21 ILE A 132 0.706 10.295 2.861 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.402 10.801 3.043 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.371 10.613 4.481 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -2.473 11.900 3.451 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -1.452 11.989 1.996 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -1.226 10.664 3.163 1.00 0.00 H new ATOM 1938 N GLU A 133 4.339 13.125 4.333 1.00 0.00 N ATOM 1939 CA GLU A 133 5.715 13.063 3.853 1.00 0.00 C ATOM 1940 C GLU A 133 6.398 11.781 4.322 1.00 0.00 C ATOM 1941 O GLU A 133 5.844 11.028 5.124 1.00 0.00 O ATOM 1942 CB GLU A 133 6.502 14.281 4.342 1.00 0.00 C ATOM 1943 CG GLU A 133 6.491 14.445 5.853 1.00 0.00 C ATOM 1944 CD GLU A 133 7.325 15.624 6.317 1.00 0.00 C ATOM 1945 OE1 GLU A 133 6.959 16.773 5.995 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.344 15.397 7.003 1.00 0.00 O ATOM 0 H GLU A 133 4.244 13.092 5.348 1.00 0.00 H new ATOM 0 HA GLU A 133 5.694 13.065 2.763 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.534 14.197 4.001 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.087 15.179 3.884 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.464 14.575 6.193 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.868 13.533 6.317 1.00 0.00 H new ATOM 1953 N ALA A 134 7.603 11.540 3.815 1.00 0.00 N ATOM 1954 CA ALA A 134 8.360 10.350 4.180 1.00 0.00 C ATOM 1955 C ALA A 134 9.278 10.627 5.367 1.00 0.00 C ATOM 1956 O ALA A 134 10.220 11.413 5.268 1.00 0.00 O ATOM 1957 CB ALA A 134 9.169 9.855 2.991 1.00 0.00 C ATOM 0 H ALA A 134 8.075 12.153 3.151 1.00 0.00 H new ATOM 0 HA ALA A 134 7.652 9.574 4.473 1.00 0.00 H new ATOM 0 HB1 ALA A 134 9.730 8.965 3.278 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.496 9.611 2.169 1.00 0.00 H new ATOM 0 HB3 ALA A 134 9.862 10.634 2.673 1.00 0.00 H new ATOM 1963 N LYS A 135 8.994 9.976 6.492 1.00 0.00 N ATOM 1964 CA LYS A 135 9.794 10.152 7.698 1.00 0.00 C ATOM 1965 C LYS A 135 11.187 9.559 7.519 1.00 0.00 C ATOM 1966 O LYS A 135 11.463 8.886 6.525 1.00 0.00 O ATOM 1967 CB LYS A 135 9.097 9.502 8.896 1.00 0.00 C ATOM 1968 CG LYS A 135 9.129 10.353 10.154 1.00 0.00 C ATOM 1969 CD LYS A 135 9.001 9.501 11.406 1.00 0.00 C ATOM 1970 CE LYS A 135 9.923 9.993 12.511 1.00 0.00 C ATOM 1971 NZ LYS A 135 9.695 11.430 12.825 1.00 0.00 N ATOM 0 H LYS A 135 8.217 9.323 6.592 1.00 0.00 H new ATOM 0 HA LYS A 135 9.897 11.221 7.883 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.059 9.295 8.634 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.570 8.543 9.104 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.061 10.916 10.190 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.318 11.081 10.123 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.969 9.520 11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 135 9.238 8.464 11.168 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.765 9.396 13.409 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.960 9.847 12.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 10.174 11.671 13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.077 12.018 12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.675 11.607 12.922 1.00 0.00 H new ATOM 1985 N ASN A 136 12.063 9.813 8.487 1.00 0.00 N ATOM 1986 CA ASN A 136 13.428 9.303 8.435 1.00 0.00 C ATOM 1987 C ASN A 136 13.437 7.778 8.391 1.00 0.00 C ATOM 1988 O ASN A 136 12.385 7.140 8.414 1.00 0.00 O ATOM 1989 CB ASN A 136 14.226 9.797 9.644 1.00 0.00 C ATOM 1990 CG ASN A 136 15.097 10.992 9.311 1.00 0.00 C ATOM 1991 OD1 ASN A 136 14.949 12.066 9.896 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.014 10.812 8.367 1.00 0.00 N ATOM 0 H ASN A 136 11.851 10.369 9.316 1.00 0.00 H new ATOM 0 HA ASN A 136 13.895 9.677 7.524 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.538 10.064 10.446 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.852 8.987 10.018 1.00 0.00 H new ATOM 0 HD21 ASN A 136 16.630 11.580 8.101 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.102 9.905 7.908 1.00 0.00 H new ATOM 1999 N LYS A 137 14.633 7.200 8.330 1.00 0.00 N ATOM 2000 CA LYS A 137 14.779 5.750 8.283 1.00 0.00 C ATOM 2001 C LYS A 137 14.182 5.102 9.530 1.00 0.00 C ATOM 2002 O LYS A 137 13.692 3.974 9.481 1.00 0.00 O ATOM 2003 CB LYS A 137 16.255 5.369 8.156 1.00 0.00 C ATOM 2004 CG LYS A 137 16.800 5.515 6.744 1.00 0.00 C ATOM 2005 CD LYS A 137 18.272 5.895 6.752 1.00 0.00 C ATOM 2006 CE LYS A 137 18.463 7.386 6.529 1.00 0.00 C ATOM 2007 NZ LYS A 137 17.836 7.843 5.258 1.00 0.00 N ATOM 0 H LYS A 137 15.514 7.714 8.312 1.00 0.00 H new ATOM 0 HA LYS A 137 14.239 5.384 7.410 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.842 5.993 8.830 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.385 4.337 8.482 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.668 4.578 6.203 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.230 6.275 6.209 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.718 5.608 7.705 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.797 5.340 5.975 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.031 7.936 7.365 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.528 7.617 6.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 18.377 8.642 4.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 17.834 7.062 4.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 16.858 8.144 5.442 1.00 0.00 H new ATOM 2021 N THR A 138 14.226 5.824 10.645 1.00 0.00 N ATOM 2022 CA THR A 138 13.690 5.320 11.903 1.00 0.00 C ATOM 2023 C THR A 138 12.178 5.131 11.812 1.00 0.00 C ATOM 2024 O THR A 138 11.432 6.092 11.626 1.00 0.00 O ATOM 2025 CB THR A 138 14.029 6.275 13.050 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.237 7.592 12.565 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.264 5.865 13.824 1.00 0.00 C ATOM 0 H THR A 138 14.627 6.760 10.702 1.00 0.00 H new ATOM 0 HA THR A 138 14.149 4.352 12.102 1.00 0.00 H new ATOM 0 HB THR A 138 13.171 6.236 13.722 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.451 8.187 13.314 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.448 6.584 14.622 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.112 4.875 14.255 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.122 5.840 13.153 1.00 0.00 H new ATOM 2035 N ALA A 139 11.733 3.885 11.946 1.00 0.00 N ATOM 2036 CA ALA A 139 10.312 3.570 11.879 1.00 0.00 C ATOM 2037 C ALA A 139 9.726 3.384 13.273 1.00 0.00 C ATOM 2038 O ALA A 139 9.930 2.351 13.911 1.00 0.00 O ATOM 2039 CB ALA A 139 10.088 2.322 11.039 1.00 0.00 C ATOM 0 H ALA A 139 12.337 3.078 12.102 1.00 0.00 H new ATOM 0 HA ALA A 139 9.800 4.409 11.407 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.022 2.098 10.997 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.463 2.491 10.030 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.618 1.482 11.487 1.00 0.00 H new ATOM 2045 N GLY A 140 8.995 4.391 13.742 1.00 0.00 N ATOM 2046 CA GLY A 140 8.390 4.319 15.058 1.00 0.00 C ATOM 2047 C GLY A 140 7.208 3.370 15.102 1.00 0.00 C ATOM 2048 O GLY A 140 6.855 2.760 14.093 1.00 0.00 O ATOM 0 H GLY A 140 8.811 5.256 13.233 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.139 3.996 15.781 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.064 5.314 15.360 1.00 0.00 H new ATOM 2052 N GLU A 141 6.596 3.246 16.276 1.00 0.00 N ATOM 2053 CA GLU A 141 5.447 2.364 16.449 1.00 0.00 C ATOM 2054 C GLU A 141 4.240 2.884 15.674 1.00 0.00 C ATOM 2055 O GLU A 141 3.421 2.106 15.185 1.00 0.00 O ATOM 2056 CB GLU A 141 5.097 2.233 17.932 1.00 0.00 C ATOM 2057 CG GLU A 141 6.281 1.851 18.805 1.00 0.00 C ATOM 2058 CD GLU A 141 6.499 0.353 18.867 1.00 0.00 C ATOM 2059 OE1 GLU A 141 7.181 -0.185 17.970 1.00 0.00 O ATOM 2060 OE2 GLU A 141 5.988 -0.283 19.813 1.00 0.00 O ATOM 0 H GLU A 141 6.876 3.745 17.121 1.00 0.00 H new ATOM 0 HA GLU A 141 5.712 1.382 16.057 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.686 3.179 18.285 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.314 1.483 18.047 1.00 0.00 H new ATOM 0 HG2 GLU A 141 7.181 2.330 18.420 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.123 2.234 19.813 1.00 0.00 H new ATOM 2067 N GLU A 142 4.138 4.204 15.564 1.00 0.00 N ATOM 2068 CA GLU A 142 3.031 4.828 14.849 1.00 0.00 C ATOM 2069 C GLU A 142 3.336 4.936 13.358 1.00 0.00 C ATOM 2070 O GLU A 142 2.429 4.917 12.526 1.00 0.00 O ATOM 2071 CB GLU A 142 2.744 6.217 15.423 1.00 0.00 C ATOM 2072 CG GLU A 142 2.530 6.220 16.928 1.00 0.00 C ATOM 2073 CD GLU A 142 1.062 6.260 17.307 1.00 0.00 C ATOM 2074 OE1 GLU A 142 0.417 5.191 17.299 1.00 0.00 O ATOM 2075 OE2 GLU A 142 0.558 7.362 17.613 1.00 0.00 O ATOM 0 H GLU A 142 4.808 4.862 15.961 1.00 0.00 H new ATOM 0 HA GLU A 142 2.150 4.199 14.977 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.575 6.880 15.181 1.00 0.00 H new ATOM 0 HB3 GLU A 142 1.858 6.626 14.937 1.00 0.00 H new ATOM 0 HG2 GLU A 142 2.989 5.330 17.358 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.037 7.082 17.362 1.00 0.00 H new ATOM 2082 N GLU A 143 4.619 5.049 13.027 1.00 0.00 N ATOM 2083 CA GLU A 143 5.044 5.159 11.636 1.00 0.00 C ATOM 2084 C GLU A 143 4.567 3.959 10.823 1.00 0.00 C ATOM 2085 O GLU A 143 4.314 4.070 9.623 1.00 0.00 O ATOM 2086 CB GLU A 143 6.569 5.276 11.555 1.00 0.00 C ATOM 2087 CG GLU A 143 7.046 6.570 10.916 1.00 0.00 C ATOM 2088 CD GLU A 143 7.814 6.337 9.629 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.889 5.702 9.685 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.342 6.791 8.566 1.00 0.00 O ATOM 0 H GLU A 143 5.382 5.067 13.703 1.00 0.00 H new ATOM 0 HA GLU A 143 4.595 6.059 11.215 1.00 0.00 H new ATOM 0 HB2 GLU A 143 6.985 5.202 12.560 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.960 4.433 10.985 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.186 7.208 10.711 1.00 0.00 H new ATOM 0 HG3 GLU A 143 7.681 7.107 11.621 1.00 0.00 H new ATOM 2097 N MET A 144 4.447 2.811 11.483 1.00 0.00 N ATOM 2098 CA MET A 144 4.000 1.591 10.820 1.00 0.00 C ATOM 2099 C MET A 144 2.609 1.775 10.220 1.00 0.00 C ATOM 2100 O MET A 144 1.827 2.605 10.684 1.00 0.00 O ATOM 2101 CB MET A 144 3.990 0.424 11.809 1.00 0.00 C ATOM 2102 CG MET A 144 5.362 0.095 12.376 1.00 0.00 C ATOM 2103 SD MET A 144 6.492 -0.553 11.129 1.00 0.00 S ATOM 2104 CE MET A 144 8.051 -0.464 12.003 1.00 0.00 C ATOM 0 H MET A 144 4.653 2.700 12.476 1.00 0.00 H new ATOM 0 HA MET A 144 4.698 1.370 10.012 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.314 0.661 12.630 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.590 -0.460 11.311 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.792 0.993 12.819 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.254 -0.636 13.178 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.871 -0.608 11.300 1.00 0.00 H new ATOM 0 HE2 MET A 144 8.147 0.513 12.477 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.086 -1.242 12.765 1.00 0.00 H new ATOM 2114 N ILE A 145 2.310 0.996 9.186 1.00 0.00 N ATOM 2115 CA ILE A 145 1.015 1.073 8.522 1.00 0.00 C ATOM 2116 C ILE A 145 0.390 -0.311 8.374 1.00 0.00 C ATOM 2117 O ILE A 145 1.088 -1.323 8.395 1.00 0.00 O ATOM 2118 CB ILE A 145 1.135 1.721 7.129 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.216 1.018 6.307 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.442 3.205 7.261 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.136 1.315 4.825 1.00 0.00 C ATOM 0 H ILE A 145 2.947 0.305 8.790 1.00 0.00 H new ATOM 0 HA ILE A 145 0.375 1.693 9.149 1.00 0.00 H new ATOM 0 HB ILE A 145 0.183 1.612 6.610 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.196 1.319 6.677 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.134 -0.058 6.459 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.524 3.649 6.269 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.640 3.695 7.813 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.383 3.336 7.796 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.932 0.784 4.304 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.170 0.989 4.440 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.248 2.387 4.662 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.930 -0.345 8.223 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.650 -1.605 8.071 1.00 0.00 C ATOM 2135 C LYS A 146 -2.237 -1.729 6.670 1.00 0.00 C ATOM 2136 O LYS A 146 -3.388 -1.361 6.433 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.763 -1.708 9.115 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.305 -1.390 10.528 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.044 -2.230 11.557 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.378 -1.421 12.800 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.709 -1.785 13.361 1.00 0.00 N ATOM 0 H LYS A 146 -1.523 0.485 8.203 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.943 -2.421 8.222 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.569 -1.027 8.842 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.176 -2.716 9.095 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.233 -1.569 10.613 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.469 -0.332 10.735 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.962 -2.620 11.118 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.433 -3.089 11.834 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.609 -1.583 13.556 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -3.366 -0.359 12.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -4.898 -1.211 14.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -5.446 -1.606 12.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -4.713 -2.793 13.619 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.440 -2.251 5.743 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.881 -2.424 4.365 1.00 0.00 C ATOM 2157 C ILE A 147 -2.838 -3.606 4.240 1.00 0.00 C ATOM 2158 O ILE A 147 -2.553 -4.703 4.722 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.687 -2.640 3.414 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.366 -1.551 3.624 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.158 -2.657 1.967 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.788 -2.067 3.572 1.00 0.00 C ATOM 0 H ILE A 147 -0.485 -2.561 5.922 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.399 -1.508 4.081 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.233 -3.605 3.640 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.239 -0.782 2.862 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.196 -1.074 4.589 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.303 -2.810 1.308 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -1.874 -3.467 1.827 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.634 -1.706 1.728 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.481 -1.240 3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.933 -2.815 4.352 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.976 -2.518 2.598 1.00 0.00 H new ATOM 2174 N ARG A 148 -3.974 -3.373 3.589 1.00 0.00 N ATOM 2175 CA ARG A 148 -4.974 -4.418 3.400 1.00 0.00 C ATOM 2176 C ARG A 148 -5.306 -4.592 1.922 1.00 0.00 C ATOM 2177 O ARG A 148 -4.817 -3.846 1.073 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.245 -4.084 4.183 1.00 0.00 C ATOM 2179 CG ARG A 148 -5.990 -3.738 5.640 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.113 -2.892 6.217 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.728 -2.256 7.475 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.586 -2.912 8.624 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -6.796 -4.222 8.679 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.233 -2.258 9.722 1.00 0.00 N ATOM 0 H ARG A 148 -4.224 -2.471 3.184 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.560 -5.354 3.774 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.748 -3.245 3.702 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -6.925 -4.934 4.134 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -5.889 -4.655 6.220 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.046 -3.200 5.727 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.397 -2.126 5.496 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -7.991 -3.517 6.381 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.558 -1.250 7.472 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.068 -4.731 7.838 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -6.686 -4.720 9.563 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -6.070 -1.252 9.686 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.124 -2.761 10.603 1.00 0.00 H new ATOM 2198 N SER A 149 -6.139 -5.583 1.620 1.00 0.00 N ATOM 2199 CA SER A 149 -6.537 -5.854 0.244 1.00 0.00 C ATOM 2200 C SER A 149 -7.984 -6.335 0.181 1.00 0.00 C ATOM 2201 O SER A 149 -8.521 -6.852 1.160 1.00 0.00 O ATOM 2202 CB SER A 149 -5.613 -6.902 -0.378 1.00 0.00 C ATOM 2203 OG SER A 149 -5.708 -6.892 -1.792 1.00 0.00 O ATOM 0 H SER A 149 -6.551 -6.211 2.310 1.00 0.00 H new ATOM 0 HA SER A 149 -6.456 -4.926 -0.321 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.583 -6.707 -0.078 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.873 -7.891 -0.000 1.00 0.00 H new ATOM 0 HG SER A 149 -5.106 -7.570 -2.165 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.609 -6.160 -0.979 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.995 -6.575 -1.171 1.00 0.00 C ATOM 2211 C CYS A 150 -10.106 -7.589 -2.304 1.00 0.00 C ATOM 2212 O CYS A 150 -11.116 -7.641 -3.007 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.876 -5.360 -1.470 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.260 -4.314 -2.810 1.00 0.00 S ATOM 0 H CYS A 150 -8.179 -5.734 -1.800 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.339 -7.046 -0.250 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.878 -5.705 -1.724 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.966 -4.758 -0.566 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.945 -3.144 -2.338 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.062 -8.393 -2.477 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.044 -9.406 -3.525 1.00 0.00 C ATOM 2222 C ALA A 151 -9.749 -10.679 -3.070 1.00 0.00 C ATOM 2223 O ALA A 151 -10.250 -10.757 -1.949 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.611 -9.713 -3.937 1.00 0.00 C ATOM 0 H ALA A 151 -8.218 -8.362 -1.905 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.582 -9.012 -4.387 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.612 -10.471 -4.720 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.138 -8.805 -4.311 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.056 -10.083 -3.075 1.00 0.00 H new