USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 939 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 44 CYS SG : rot -115:sc= -1.43 USER MOD Set 1.2: A 60 MET CE :methyl 164:sc= -0.0629 (180deg=-0.43) USER MOD Set 2.1: A 11 GLN : amide:sc= 0.329 K(o=0.74,f=-2.3!) USER MOD Set 2.2: A 12 ASN : amide:sc= 0.406 K(o=0.74,f=-2.7) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.0629 K(o=0.063,f=-2.3) USER MOD Single : A 38 ASN : amide:sc=-0.00167 X(o=-0.0017,f=-0.43) USER MOD Single : A 39 CYS SG : rot -7:sc= 0.152 USER MOD Single : A 43 TYR OH : rot 180:sc= 0.424 USER MOD Single : A 45 ASN : amide:sc= -0.0494 X(o=-0.049,f=-0.2) USER MOD Single : A 49 CYS SG : rot 180:sc= -0.0863 USER MOD Single : A 52 CYS SG : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 150:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0.0356 X(o=0.036,f=0) USER MOD Single : A 64 CYS SG : rot -29:sc= -0.412 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.098 USER MOD Single : A 66 CYS SG : rot 14:sc= 0.0862 USER MOD Single : A 70 HIS : no HD1:sc= 0.545 K(o=0.54,f=-7.6!) USER MOD Single : A 74 THR OG1 : rot -96:sc= 0.647 USER MOD Single : A 75 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 81 GLN : amide:sc= 0.541 K(o=0.54,f=0) USER MOD Single : A 84 GLN : amide:sc= 0.533 K(o=0.53,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 179:sc= 1.25 (180deg=1.19) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 55:sc= -0.11 USER MOD Single : A 108 CYS SG : rot 30:sc= -0.369 USER MOD Single : A 116 LYS NZ :NH3+ -110:sc= 2.52 (180deg=0.0749) USER MOD Single : A 117 ASN : amide:sc= 0.688 K(o=0.69,f=-3.2!) USER MOD Single : A 124 MET CE :methyl -155:sc=-0.00568 (180deg=-0.241) USER MOD Single : A 128 ASN : amide:sc= -0.675 X(o=-0.68,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 148 N PRO A 10 -7.571 -13.357 -12.786 1.00 0.00 N ATOM 149 CA PRO A 10 -8.140 -13.541 -11.444 1.00 0.00 C ATOM 150 C PRO A 10 -9.594 -14.033 -11.486 1.00 0.00 C ATOM 151 O PRO A 10 -10.515 -13.326 -11.897 1.00 0.00 O ATOM 152 CB PRO A 10 -7.977 -12.198 -10.734 1.00 0.00 C ATOM 153 CG PRO A 10 -6.717 -11.626 -11.382 1.00 0.00 C ATOM 154 CD PRO A 10 -6.792 -12.127 -12.825 1.00 0.00 C ATOM 0 HA PRO A 10 -7.619 -14.327 -10.897 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -8.841 -11.551 -10.888 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -7.859 -12.321 -9.657 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -6.702 -10.537 -11.336 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -5.815 -11.978 -10.882 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -7.265 -11.387 -13.470 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.795 -12.310 -13.226 1.00 0.00 H new ATOM 162 N GLN A 11 -9.792 -15.284 -11.085 1.00 0.00 N ATOM 163 CA GLN A 11 -11.025 -16.041 -11.320 1.00 0.00 C ATOM 164 C GLN A 11 -12.295 -15.424 -10.712 1.00 0.00 C ATOM 165 O GLN A 11 -13.379 -15.610 -11.263 1.00 0.00 O ATOM 166 CB GLN A 11 -10.823 -17.516 -10.920 1.00 0.00 C ATOM 167 CG GLN A 11 -10.837 -17.816 -9.411 1.00 0.00 C ATOM 168 CD GLN A 11 -9.735 -17.126 -8.608 1.00 0.00 C ATOM 169 OE1 GLN A 11 -8.587 -17.014 -9.024 1.00 0.00 O ATOM 170 NE2 GLN A 11 -10.041 -16.599 -7.442 1.00 0.00 N ATOM 0 H GLN A 11 -9.086 -15.816 -10.576 1.00 0.00 H new ATOM 0 HA GLN A 11 -11.217 -15.990 -12.392 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -11.603 -18.110 -11.395 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.871 -17.855 -11.328 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -11.804 -17.518 -9.005 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -10.750 -18.893 -9.269 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -10.990 -16.681 -7.079 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -9.329 -16.108 -6.902 1.00 0.00 H new ATOM 179 N ASN A 12 -12.181 -14.651 -9.627 1.00 0.00 N ATOM 180 CA ASN A 12 -13.333 -14.069 -8.932 1.00 0.00 C ATOM 181 C ASN A 12 -13.981 -12.970 -9.794 1.00 0.00 C ATOM 182 O ASN A 12 -15.188 -12.990 -10.031 1.00 0.00 O ATOM 183 CB ASN A 12 -12.880 -13.528 -7.561 1.00 0.00 C ATOM 184 CG ASN A 12 -12.739 -14.598 -6.484 1.00 0.00 C ATOM 185 OD1 ASN A 12 -12.788 -15.798 -6.724 1.00 0.00 O ATOM 186 ND2 ASN A 12 -12.529 -14.198 -5.251 1.00 0.00 N ATOM 0 H ASN A 12 -11.284 -14.411 -9.205 1.00 0.00 H new ATOM 0 HA ASN A 12 -14.090 -14.836 -8.766 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -11.923 -13.021 -7.681 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -13.597 -12.780 -7.223 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -12.409 -14.884 -4.506 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -12.486 -13.201 -5.039 1.00 0.00 H new ATOM 193 N THR A 13 -13.173 -12.033 -10.303 1.00 0.00 N ATOM 194 CA THR A 13 -13.629 -10.930 -11.172 1.00 0.00 C ATOM 195 C THR A 13 -13.901 -11.397 -12.608 1.00 0.00 C ATOM 196 O THR A 13 -14.877 -10.989 -13.244 1.00 0.00 O ATOM 197 CB THR A 13 -12.607 -9.785 -11.124 1.00 0.00 C ATOM 198 OG1 THR A 13 -13.205 -8.575 -11.532 1.00 0.00 O ATOM 199 CG2 THR A 13 -11.366 -10.022 -11.982 1.00 0.00 C ATOM 0 H THR A 13 -12.169 -12.015 -10.123 1.00 0.00 H new ATOM 0 HA THR A 13 -14.583 -10.564 -10.794 1.00 0.00 H new ATOM 0 HB THR A 13 -12.281 -9.735 -10.085 1.00 0.00 H new ATOM 0 HG1 THR A 13 -12.542 -7.854 -11.495 1.00 0.00 H new ATOM 0 HG21 THR A 13 -10.694 -9.168 -11.894 1.00 0.00 H new ATOM 0 HG22 THR A 13 -10.855 -10.923 -11.642 1.00 0.00 H new ATOM 0 HG23 THR A 13 -11.662 -10.144 -13.024 1.00 0.00 H new ATOM 207 N PHE A 14 -13.083 -12.338 -13.095 1.00 0.00 N ATOM 208 CA PHE A 14 -13.280 -13.005 -14.380 1.00 0.00 C ATOM 209 C PHE A 14 -14.645 -13.698 -14.421 1.00 0.00 C ATOM 210 O PHE A 14 -15.360 -13.587 -15.415 1.00 0.00 O ATOM 211 CB PHE A 14 -12.137 -14.003 -14.567 1.00 0.00 C ATOM 212 CG PHE A 14 -12.123 -14.727 -15.899 1.00 0.00 C ATOM 213 CD1 PHE A 14 -11.755 -14.040 -17.073 1.00 0.00 C ATOM 214 CD2 PHE A 14 -12.461 -16.093 -15.968 1.00 0.00 C ATOM 215 CE1 PHE A 14 -11.724 -14.714 -18.306 1.00 0.00 C ATOM 216 CE2 PHE A 14 -12.430 -16.766 -17.203 1.00 0.00 C ATOM 217 CZ PHE A 14 -12.060 -16.077 -18.372 1.00 0.00 C ATOM 0 H PHE A 14 -12.253 -12.660 -12.596 1.00 0.00 H new ATOM 0 HA PHE A 14 -13.270 -12.281 -15.195 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -11.191 -13.474 -14.449 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -12.189 -14.744 -13.769 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -11.496 -12.993 -17.025 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -12.744 -16.624 -15.071 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -11.442 -14.184 -19.204 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -12.691 -17.813 -17.254 1.00 0.00 H new ATOM 0 HZ PHE A 14 -12.034 -16.595 -19.319 1.00 0.00 H new ATOM 227 N LEU A 15 -15.046 -14.322 -13.305 1.00 0.00 N ATOM 228 CA LEU A 15 -16.403 -14.852 -13.128 1.00 0.00 C ATOM 229 C LEU A 15 -17.446 -13.736 -12.952 1.00 0.00 C ATOM 230 O LEU A 15 -18.488 -13.792 -13.591 1.00 0.00 O ATOM 231 CB LEU A 15 -16.445 -15.864 -11.969 1.00 0.00 C ATOM 232 CG LEU A 15 -17.867 -16.354 -11.630 1.00 0.00 C ATOM 233 CD1 LEU A 15 -18.587 -17.005 -12.814 1.00 0.00 C ATOM 234 CD2 LEU A 15 -17.814 -17.366 -10.485 1.00 0.00 C ATOM 0 H LEU A 15 -14.438 -14.473 -12.500 1.00 0.00 H new ATOM 0 HA LEU A 15 -16.672 -15.379 -14.044 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -15.825 -16.723 -12.225 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -16.006 -15.407 -11.082 1.00 0.00 H new ATOM 0 HG LEU A 15 -18.430 -15.464 -11.347 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -19.581 -17.326 -12.503 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -18.676 -16.284 -13.627 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -18.017 -17.869 -13.156 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -18.823 -17.706 -10.253 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -17.203 -18.219 -10.781 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -17.378 -16.896 -9.604 1.00 0.00 H new ATOM 246 N ASP A 16 -17.194 -12.711 -12.140 1.00 0.00 N ATOM 247 CA ASP A 16 -18.085 -11.553 -11.953 1.00 0.00 C ATOM 248 C ASP A 16 -18.585 -10.941 -13.274 1.00 0.00 C ATOM 249 O ASP A 16 -19.752 -10.565 -13.392 1.00 0.00 O ATOM 250 CB ASP A 16 -17.395 -10.479 -11.107 1.00 0.00 C ATOM 251 CG ASP A 16 -18.407 -9.445 -10.601 1.00 0.00 C ATOM 252 OD1 ASP A 16 -19.399 -9.855 -9.954 1.00 0.00 O ATOM 253 OD2 ASP A 16 -18.228 -8.231 -10.857 1.00 0.00 O ATOM 0 H ASP A 16 -16.345 -12.655 -11.577 1.00 0.00 H new ATOM 0 HA ASP A 16 -18.965 -11.930 -11.432 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -16.892 -10.946 -10.260 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -16.627 -9.982 -11.700 1.00 0.00 H new ATOM 258 N THR A 17 -17.712 -10.854 -14.278 1.00 0.00 N ATOM 259 CA THR A 17 -18.095 -10.438 -15.646 1.00 0.00 C ATOM 260 C THR A 17 -19.142 -11.373 -16.274 1.00 0.00 C ATOM 261 O THR A 17 -20.129 -10.924 -16.866 1.00 0.00 O ATOM 262 CB THR A 17 -16.856 -10.335 -16.556 1.00 0.00 C ATOM 263 OG1 THR A 17 -15.957 -9.381 -16.026 1.00 0.00 O ATOM 264 CG2 THR A 17 -17.187 -9.876 -17.979 1.00 0.00 C ATOM 0 H THR A 17 -16.720 -11.067 -14.176 1.00 0.00 H new ATOM 0 HA THR A 17 -18.553 -9.453 -15.556 1.00 0.00 H new ATOM 0 HB THR A 17 -16.431 -11.338 -16.596 1.00 0.00 H new ATOM 0 HG1 THR A 17 -15.169 -9.318 -16.605 1.00 0.00 H new ATOM 0 HG21 THR A 17 -16.271 -9.825 -18.567 1.00 0.00 H new ATOM 0 HG22 THR A 17 -17.874 -10.586 -18.440 1.00 0.00 H new ATOM 0 HG23 THR A 17 -17.652 -8.891 -17.945 1.00 0.00 H new ATOM 272 N ILE A 18 -18.972 -12.685 -16.101 1.00 0.00 N ATOM 273 CA ILE A 18 -19.916 -13.707 -16.574 1.00 0.00 C ATOM 274 C ILE A 18 -21.219 -13.642 -15.774 1.00 0.00 C ATOM 275 O ILE A 18 -22.290 -13.810 -16.357 1.00 0.00 O ATOM 276 CB ILE A 18 -19.302 -15.120 -16.481 1.00 0.00 C ATOM 277 CG1 ILE A 18 -17.902 -15.260 -17.104 1.00 0.00 C ATOM 278 CG2 ILE A 18 -20.235 -16.190 -17.071 1.00 0.00 C ATOM 279 CD1 ILE A 18 -17.834 -15.019 -18.618 1.00 0.00 C ATOM 0 H ILE A 18 -18.162 -13.077 -15.621 1.00 0.00 H new ATOM 0 HA ILE A 18 -20.135 -13.501 -17.622 1.00 0.00 H new ATOM 0 HB ILE A 18 -19.182 -15.282 -15.410 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -17.230 -14.558 -16.610 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -17.527 -16.262 -16.894 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -19.765 -17.170 -16.986 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -21.178 -16.191 -16.525 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -20.424 -15.969 -18.121 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -16.806 -15.141 -18.960 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -18.474 -15.737 -19.130 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -18.173 -14.007 -18.841 1.00 0.00 H new ATOM 291 N ILE A 19 -21.157 -13.302 -14.477 1.00 0.00 N ATOM 292 CA ILE A 19 -22.359 -13.001 -13.707 1.00 0.00 C ATOM 293 C ILE A 19 -23.109 -11.870 -14.395 1.00 0.00 C ATOM 294 O ILE A 19 -24.252 -12.079 -14.768 1.00 0.00 O ATOM 295 CB ILE A 19 -22.096 -12.620 -12.237 1.00 0.00 C ATOM 296 CG1 ILE A 19 -21.242 -13.629 -11.445 1.00 0.00 C ATOM 297 CG2 ILE A 19 -23.450 -12.405 -11.540 1.00 0.00 C ATOM 298 CD1 ILE A 19 -21.727 -15.075 -11.509 1.00 0.00 C ATOM 0 H ILE A 19 -20.288 -13.231 -13.948 1.00 0.00 H new ATOM 0 HA ILE A 19 -22.946 -13.919 -13.676 1.00 0.00 H new ATOM 0 HB ILE A 19 -21.501 -11.707 -12.253 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -20.219 -13.588 -11.818 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -21.213 -13.317 -10.401 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -23.284 -12.134 -10.497 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -23.994 -11.604 -12.041 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -24.034 -13.324 -11.587 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -21.062 -15.708 -10.922 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -22.738 -15.138 -11.106 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -21.728 -15.413 -12.545 1.00 0.00 H new ATOM 310 N ARG A 20 -22.467 -10.726 -14.678 1.00 0.00 N ATOM 311 CA ARG A 20 -23.097 -9.598 -15.382 1.00 0.00 C ATOM 312 C ARG A 20 -23.597 -9.972 -16.781 1.00 0.00 C ATOM 313 O ARG A 20 -24.565 -9.369 -17.249 1.00 0.00 O ATOM 314 CB ARG A 20 -22.118 -8.409 -15.446 1.00 0.00 C ATOM 315 CG ARG A 20 -22.342 -7.393 -14.315 1.00 0.00 C ATOM 316 CD ARG A 20 -21.403 -7.476 -13.108 1.00 0.00 C ATOM 317 NE ARG A 20 -21.578 -8.666 -12.257 1.00 0.00 N ATOM 318 CZ ARG A 20 -22.419 -8.800 -11.246 1.00 0.00 C ATOM 319 NH1 ARG A 20 -23.571 -8.201 -11.175 1.00 0.00 N ATOM 320 NH2 ARG A 20 -22.101 -9.560 -10.243 1.00 0.00 N ATOM 0 H ARG A 20 -21.494 -10.557 -14.424 1.00 0.00 H new ATOM 0 HA ARG A 20 -23.980 -9.311 -14.811 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -21.095 -8.783 -15.395 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -22.226 -7.906 -16.407 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -22.261 -6.392 -14.738 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -23.365 -7.506 -13.956 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -20.374 -7.454 -13.466 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -21.546 -6.586 -12.495 1.00 0.00 H new ATOM 0 HE ARG A 20 -20.989 -9.471 -12.470 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -23.872 -7.584 -11.929 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -24.173 -8.348 -10.365 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -21.206 -10.050 -10.238 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -22.746 -9.667 -9.460 1.00 0.00 H new ATOM 334 N LYS A 21 -23.018 -10.995 -17.419 1.00 0.00 N ATOM 335 CA LYS A 21 -23.511 -11.572 -18.677 1.00 0.00 C ATOM 336 C LYS A 21 -24.844 -12.321 -18.525 1.00 0.00 C ATOM 337 O LYS A 21 -25.742 -12.104 -19.340 1.00 0.00 O ATOM 338 CB LYS A 21 -22.424 -12.472 -19.254 1.00 0.00 C ATOM 339 CG LYS A 21 -22.524 -12.588 -20.777 1.00 0.00 C ATOM 340 CD LYS A 21 -21.266 -13.319 -21.236 1.00 0.00 C ATOM 341 CE LYS A 21 -21.339 -13.654 -22.730 1.00 0.00 C ATOM 342 NZ LYS A 21 -20.123 -14.372 -23.193 1.00 0.00 N ATOM 0 H LYS A 21 -22.177 -11.455 -17.070 1.00 0.00 H new ATOM 0 HA LYS A 21 -23.727 -10.755 -19.365 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -21.445 -12.076 -18.984 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -22.501 -13.464 -18.809 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -23.420 -13.137 -21.067 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -22.591 -11.603 -21.238 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -20.390 -12.700 -21.041 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -21.143 -14.236 -20.660 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -22.219 -14.267 -22.923 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -21.459 -12.735 -23.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -20.209 -14.582 -24.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -19.286 -13.776 -23.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -20.022 -15.261 -22.663 1.00 0.00 H new ATOM 356 N PHE A 22 -24.998 -13.160 -17.490 1.00 0.00 N ATOM 357 CA PHE A 22 -26.231 -13.935 -17.239 1.00 0.00 C ATOM 358 C PHE A 22 -27.180 -13.354 -16.165 1.00 0.00 C ATOM 359 O PHE A 22 -28.242 -13.924 -15.911 1.00 0.00 O ATOM 360 CB PHE A 22 -25.922 -15.431 -17.028 1.00 0.00 C ATOM 361 CG PHE A 22 -25.270 -15.852 -15.718 1.00 0.00 C ATOM 362 CD1 PHE A 22 -26.011 -15.904 -14.519 1.00 0.00 C ATOM 363 CD2 PHE A 22 -23.937 -16.302 -15.716 1.00 0.00 C ATOM 364 CE1 PHE A 22 -25.419 -16.369 -13.333 1.00 0.00 C ATOM 365 CE2 PHE A 22 -23.344 -16.775 -14.532 1.00 0.00 C ATOM 366 CZ PHE A 22 -24.086 -16.810 -13.339 1.00 0.00 C ATOM 0 H PHE A 22 -24.268 -13.324 -16.797 1.00 0.00 H new ATOM 0 HA PHE A 22 -26.814 -13.838 -18.155 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -26.858 -15.982 -17.127 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -25.274 -15.755 -17.842 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -27.042 -15.584 -14.513 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -23.364 -16.284 -16.632 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -25.989 -16.387 -12.416 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -22.318 -17.112 -14.539 1.00 0.00 H new ATOM 0 HZ PHE A 22 -23.632 -17.175 -12.429 1.00 0.00 H new ATOM 376 N GLU A 23 -26.832 -12.214 -15.555 1.00 0.00 N ATOM 377 CA GLU A 23 -27.466 -11.604 -14.368 1.00 0.00 C ATOM 378 C GLU A 23 -28.995 -11.403 -14.518 1.00 0.00 C ATOM 379 O GLU A 23 -29.737 -11.449 -13.532 1.00 0.00 O ATOM 380 CB GLU A 23 -26.788 -10.233 -14.122 1.00 0.00 C ATOM 381 CG GLU A 23 -27.314 -9.433 -12.917 1.00 0.00 C ATOM 382 CD GLU A 23 -26.870 -7.961 -12.966 1.00 0.00 C ATOM 383 OE1 GLU A 23 -25.650 -7.681 -12.912 1.00 0.00 O ATOM 384 OE2 GLU A 23 -27.760 -7.078 -13.045 1.00 0.00 O ATOM 0 H GLU A 23 -26.051 -11.653 -15.895 1.00 0.00 H new ATOM 0 HA GLU A 23 -27.330 -12.286 -13.528 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -25.719 -10.397 -13.987 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -26.907 -9.624 -15.018 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -28.403 -9.483 -12.896 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -26.956 -9.889 -11.994 1.00 0.00 H new ATOM 450 N LYS A 28 -36.684 -5.088 -15.283 1.00 0.00 N ATOM 451 CA LYS A 28 -37.162 -3.694 -15.377 1.00 0.00 C ATOM 452 C LYS A 28 -36.209 -2.645 -14.793 1.00 0.00 C ATOM 453 O LYS A 28 -35.598 -2.884 -13.750 1.00 0.00 O ATOM 454 CB LYS A 28 -38.564 -3.568 -14.748 1.00 0.00 C ATOM 455 CG LYS A 28 -39.542 -4.724 -15.066 1.00 0.00 C ATOM 456 CD LYS A 28 -39.732 -5.726 -13.915 1.00 0.00 C ATOM 457 CE LYS A 28 -40.978 -6.601 -14.136 1.00 0.00 C ATOM 458 NZ LYS A 28 -40.800 -7.599 -15.228 1.00 0.00 N ATOM 0 HA LYS A 28 -37.207 -3.471 -16.443 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -38.453 -3.496 -13.666 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -39.012 -2.633 -15.085 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -40.512 -4.302 -15.329 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -39.180 -5.260 -15.943 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -38.849 -6.360 -13.833 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -39.826 -5.187 -12.972 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -41.218 -7.123 -13.210 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -41.828 -5.961 -14.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -41.670 -8.159 -15.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -40.598 -7.105 -16.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -40.007 -8.231 -14.995 1.00 0.00 H new ATOM 472 N PHE A 29 -36.153 -1.457 -15.416 1.00 0.00 N ATOM 473 CA PHE A 29 -35.325 -0.329 -14.955 1.00 0.00 C ATOM 474 C PHE A 29 -35.606 1.004 -15.674 1.00 0.00 C ATOM 475 O PHE A 29 -36.180 1.079 -16.769 1.00 0.00 O ATOM 476 CB PHE A 29 -33.813 -0.646 -15.077 1.00 0.00 C ATOM 477 CG PHE A 29 -33.245 -0.780 -16.480 1.00 0.00 C ATOM 478 CD1 PHE A 29 -32.794 0.354 -17.188 1.00 0.00 C ATOM 479 CD2 PHE A 29 -33.105 -2.054 -17.058 1.00 0.00 C ATOM 480 CE1 PHE A 29 -32.234 0.210 -18.471 1.00 0.00 C ATOM 481 CE2 PHE A 29 -32.546 -2.199 -18.340 1.00 0.00 C ATOM 482 CZ PHE A 29 -32.114 -1.066 -19.049 1.00 0.00 C ATOM 0 H PHE A 29 -36.685 -1.250 -16.261 1.00 0.00 H new ATOM 0 HA PHE A 29 -35.607 -0.201 -13.910 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -33.260 0.139 -14.562 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -33.618 -1.576 -14.543 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -32.879 1.335 -16.744 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -33.429 -2.928 -16.513 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -31.896 1.081 -19.013 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -32.449 -3.181 -18.779 1.00 0.00 H new ATOM 0 HZ PHE A 29 -31.690 -1.175 -20.036 1.00 0.00 H new ATOM 492 N ILE A 30 -35.137 2.062 -15.014 1.00 0.00 N ATOM 493 CA ILE A 30 -35.100 3.449 -15.477 1.00 0.00 C ATOM 494 C ILE A 30 -33.701 4.042 -15.329 1.00 0.00 C ATOM 495 O ILE A 30 -32.825 3.450 -14.706 1.00 0.00 O ATOM 496 CB ILE A 30 -36.152 4.308 -14.740 1.00 0.00 C ATOM 497 CG1 ILE A 30 -36.225 4.137 -13.207 1.00 0.00 C ATOM 498 CG2 ILE A 30 -37.515 4.007 -15.360 1.00 0.00 C ATOM 499 CD1 ILE A 30 -34.912 4.413 -12.466 1.00 0.00 C ATOM 0 H ILE A 30 -34.746 1.966 -14.077 1.00 0.00 H new ATOM 0 HA ILE A 30 -35.351 3.454 -16.538 1.00 0.00 H new ATOM 0 HB ILE A 30 -35.841 5.344 -14.872 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -36.993 4.805 -12.817 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -36.545 3.119 -12.984 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -38.281 4.600 -14.860 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -37.496 4.259 -16.420 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -37.742 2.947 -15.243 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -35.061 4.268 -11.396 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -34.142 3.728 -12.822 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -34.598 5.440 -12.652 1.00 0.00 H new ATOM 511 N ILE A 31 -33.506 5.224 -15.902 1.00 0.00 N ATOM 512 CA ILE A 31 -32.281 6.012 -15.863 1.00 0.00 C ATOM 513 C ILE A 31 -32.654 7.403 -15.379 1.00 0.00 C ATOM 514 O ILE A 31 -33.443 8.101 -16.019 1.00 0.00 O ATOM 515 CB ILE A 31 -31.625 6.110 -17.256 1.00 0.00 C ATOM 516 CG1 ILE A 31 -31.619 4.782 -18.044 1.00 0.00 C ATOM 517 CG2 ILE A 31 -30.213 6.706 -17.117 1.00 0.00 C ATOM 518 CD1 ILE A 31 -30.683 3.746 -17.430 1.00 0.00 C ATOM 0 H ILE A 31 -34.242 5.684 -16.437 1.00 0.00 H new ATOM 0 HA ILE A 31 -31.561 5.535 -15.198 1.00 0.00 H new ATOM 0 HB ILE A 31 -32.243 6.777 -17.857 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -32.631 4.378 -18.078 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -31.318 4.975 -19.074 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -29.749 6.775 -18.101 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -30.280 7.701 -16.676 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -29.609 6.065 -16.475 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -30.715 2.831 -18.021 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -29.665 4.136 -17.420 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -30.999 3.530 -16.409 1.00 0.00 H new ATOM 530 N ALA A 32 -32.063 7.801 -14.261 1.00 0.00 N ATOM 531 CA ALA A 32 -32.305 9.098 -13.629 1.00 0.00 C ATOM 532 C ALA A 32 -31.011 9.891 -13.398 1.00 0.00 C ATOM 533 O ALA A 32 -29.943 9.314 -13.170 1.00 0.00 O ATOM 534 CB ALA A 32 -33.182 8.938 -12.365 1.00 0.00 C ATOM 0 H ALA A 32 -31.390 7.224 -13.756 1.00 0.00 H new ATOM 0 HA ALA A 32 -32.878 9.712 -14.324 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -33.349 9.915 -11.912 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -34.140 8.497 -12.640 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -32.676 8.288 -11.651 1.00 0.00 H new ATOM 540 N ASN A 33 -31.101 11.225 -13.443 1.00 0.00 N ATOM 541 CA ASN A 33 -29.984 12.101 -13.075 1.00 0.00 C ATOM 542 C ASN A 33 -29.899 12.264 -11.543 1.00 0.00 C ATOM 543 O ASN A 33 -30.716 12.943 -10.922 1.00 0.00 O ATOM 544 CB ASN A 33 -29.992 13.433 -13.865 1.00 0.00 C ATOM 545 CG ASN A 33 -31.297 14.208 -13.947 1.00 0.00 C ATOM 546 OD1 ASN A 33 -32.325 13.860 -13.396 1.00 0.00 O ATOM 547 ND2 ASN A 33 -31.296 15.298 -14.682 1.00 0.00 N ATOM 0 H ASN A 33 -31.942 11.724 -13.733 1.00 0.00 H new ATOM 0 HA ASN A 33 -29.054 11.620 -13.378 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -29.242 14.088 -13.422 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -29.667 13.219 -14.883 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -32.152 15.844 -14.786 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -30.440 15.598 -15.148 1.00 0.00 H new ATOM 554 N ALA A 34 -28.874 11.660 -10.930 1.00 0.00 N ATOM 555 CA ALA A 34 -28.669 11.668 -9.476 1.00 0.00 C ATOM 556 C ALA A 34 -28.266 13.038 -8.899 1.00 0.00 C ATOM 557 O ALA A 34 -28.311 13.249 -7.685 1.00 0.00 O ATOM 558 CB ALA A 34 -27.596 10.624 -9.151 1.00 0.00 C ATOM 0 H ALA A 34 -28.154 11.145 -11.436 1.00 0.00 H new ATOM 0 HA ALA A 34 -29.625 11.433 -9.007 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -27.420 10.605 -8.075 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -27.933 9.641 -9.481 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -26.670 10.881 -9.665 1.00 0.00 H new ATOM 564 N ARG A 35 -27.835 13.960 -9.770 1.00 0.00 N ATOM 565 CA ARG A 35 -27.208 15.243 -9.401 1.00 0.00 C ATOM 566 C ARG A 35 -28.162 16.449 -9.460 1.00 0.00 C ATOM 567 O ARG A 35 -27.725 17.579 -9.235 1.00 0.00 O ATOM 568 CB ARG A 35 -25.931 15.467 -10.241 1.00 0.00 C ATOM 569 CG ARG A 35 -24.967 14.266 -10.364 1.00 0.00 C ATOM 570 CD ARG A 35 -24.628 13.519 -9.063 1.00 0.00 C ATOM 571 NE ARG A 35 -24.086 14.397 -8.011 1.00 0.00 N ATOM 572 CZ ARG A 35 -23.812 14.036 -6.769 1.00 0.00 C ATOM 573 NH1 ARG A 35 -23.952 12.808 -6.351 1.00 0.00 N ATOM 574 NH2 ARG A 35 -23.386 14.916 -5.909 1.00 0.00 N ATOM 0 H ARG A 35 -27.913 13.834 -10.779 1.00 0.00 H new ATOM 0 HA ARG A 35 -26.932 15.169 -8.349 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -26.231 15.767 -11.245 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -25.381 16.303 -9.809 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -25.400 13.552 -11.064 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -24.036 14.620 -10.806 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -25.527 13.028 -8.689 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -23.903 12.735 -9.281 1.00 0.00 H new ATOM 0 HE ARG A 35 -23.906 15.369 -8.263 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -24.284 12.086 -6.991 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -23.730 12.570 -5.384 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -23.263 15.888 -6.193 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -23.176 14.633 -4.952 1.00 0.00 H new ATOM 588 N VAL A 36 -29.446 16.227 -9.768 1.00 0.00 N ATOM 589 CA VAL A 36 -30.474 17.271 -9.949 1.00 0.00 C ATOM 590 C VAL A 36 -31.513 17.211 -8.822 1.00 0.00 C ATOM 591 O VAL A 36 -31.919 16.125 -8.404 1.00 0.00 O ATOM 592 CB VAL A 36 -31.103 17.183 -11.359 1.00 0.00 C ATOM 593 CG1 VAL A 36 -32.336 16.279 -11.452 1.00 0.00 C ATOM 594 CG2 VAL A 36 -31.476 18.554 -11.915 1.00 0.00 C ATOM 0 H VAL A 36 -29.815 15.286 -9.904 1.00 0.00 H new ATOM 0 HA VAL A 36 -30.001 18.251 -9.883 1.00 0.00 H new ATOM 0 HB VAL A 36 -30.311 16.733 -11.958 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -32.710 16.278 -12.476 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -32.065 15.263 -11.163 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -33.112 16.652 -10.783 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -31.913 18.438 -12.907 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -32.199 19.031 -11.253 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -30.582 19.174 -11.983 1.00 0.00 H new ATOM 604 N GLU A 37 -31.964 18.364 -8.322 1.00 0.00 N ATOM 605 CA GLU A 37 -32.901 18.461 -7.185 1.00 0.00 C ATOM 606 C GLU A 37 -34.261 17.764 -7.435 1.00 0.00 C ATOM 607 O GLU A 37 -34.902 17.289 -6.494 1.00 0.00 O ATOM 608 CB GLU A 37 -33.084 19.952 -6.851 1.00 0.00 C ATOM 609 CG GLU A 37 -33.851 20.204 -5.545 1.00 0.00 C ATOM 610 CD GLU A 37 -33.864 21.705 -5.195 1.00 0.00 C ATOM 611 OE1 GLU A 37 -34.768 22.438 -5.670 1.00 0.00 O ATOM 612 OE2 GLU A 37 -32.976 22.167 -4.436 1.00 0.00 O ATOM 0 H GLU A 37 -31.689 19.272 -8.696 1.00 0.00 H new ATOM 0 HA GLU A 37 -32.472 17.924 -6.339 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -32.103 20.423 -6.782 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -33.613 20.436 -7.672 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -34.874 19.841 -5.644 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -33.390 19.641 -4.733 1.00 0.00 H new ATOM 619 N ASN A 38 -34.686 17.655 -8.700 1.00 0.00 N ATOM 620 CA ASN A 38 -35.913 16.961 -9.115 1.00 0.00 C ATOM 621 C ASN A 38 -35.751 15.427 -9.281 1.00 0.00 C ATOM 622 O ASN A 38 -36.748 14.724 -9.459 1.00 0.00 O ATOM 623 CB ASN A 38 -36.414 17.634 -10.409 1.00 0.00 C ATOM 624 CG ASN A 38 -37.857 17.290 -10.761 1.00 0.00 C ATOM 625 OD1 ASN A 38 -38.722 17.136 -9.911 1.00 0.00 O ATOM 626 ND2 ASN A 38 -38.178 17.210 -12.034 1.00 0.00 N ATOM 0 H ASN A 38 -34.173 18.057 -9.484 1.00 0.00 H new ATOM 0 HA ASN A 38 -36.651 17.057 -8.318 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -36.323 18.715 -10.304 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -35.768 17.338 -11.235 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -39.143 17.021 -12.306 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -37.462 17.337 -12.749 1.00 0.00 H new ATOM 633 N CYS A 39 -34.514 14.904 -9.247 1.00 0.00 N ATOM 634 CA CYS A 39 -34.164 13.481 -9.406 1.00 0.00 C ATOM 635 C CYS A 39 -34.896 12.795 -10.583 1.00 0.00 C ATOM 636 O CYS A 39 -35.508 11.737 -10.412 1.00 0.00 O ATOM 637 CB CYS A 39 -34.374 12.746 -8.068 1.00 0.00 C ATOM 638 SG CYS A 39 -33.596 13.635 -6.682 1.00 0.00 S ATOM 0 H CYS A 39 -33.691 15.489 -9.101 1.00 0.00 H new ATOM 0 HA CYS A 39 -33.109 13.425 -9.674 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -35.441 12.636 -7.877 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -33.957 11.741 -8.135 1.00 0.00 H new ATOM 0 HG CYS A 39 -32.901 14.633 -7.142 1.00 0.00 H new ATOM 644 N ALA A 40 -34.904 13.421 -11.762 1.00 0.00 N ATOM 645 CA ALA A 40 -35.770 13.026 -12.872 1.00 0.00 C ATOM 646 C ALA A 40 -35.262 11.848 -13.732 1.00 0.00 C ATOM 647 O ALA A 40 -34.061 11.625 -13.893 1.00 0.00 O ATOM 648 CB ALA A 40 -36.101 14.264 -13.710 1.00 0.00 C ATOM 0 H ALA A 40 -34.306 14.220 -11.973 1.00 0.00 H new ATOM 0 HA ALA A 40 -36.678 12.619 -12.428 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -36.747 13.979 -14.541 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -36.613 14.998 -13.088 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -35.179 14.697 -14.099 1.00 0.00 H new ATOM 654 N VAL A 41 -36.214 11.121 -14.328 1.00 0.00 N ATOM 655 CA VAL A 41 -36.043 9.976 -15.223 1.00 0.00 C ATOM 656 C VAL A 41 -35.706 10.492 -16.623 1.00 0.00 C ATOM 657 O VAL A 41 -36.580 10.762 -17.448 1.00 0.00 O ATOM 658 CB VAL A 41 -37.323 9.109 -15.216 1.00 0.00 C ATOM 659 CG1 VAL A 41 -37.221 7.906 -16.158 1.00 0.00 C ATOM 660 CG2 VAL A 41 -37.629 8.559 -13.816 1.00 0.00 C ATOM 0 H VAL A 41 -37.200 11.337 -14.184 1.00 0.00 H new ATOM 0 HA VAL A 41 -35.223 9.343 -14.884 1.00 0.00 H new ATOM 0 HB VAL A 41 -38.118 9.776 -15.550 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -38.146 7.331 -16.115 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -37.058 8.255 -17.178 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -36.387 7.275 -15.853 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -38.536 7.955 -13.853 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -36.796 7.943 -13.477 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -37.773 9.388 -13.123 1.00 0.00 H new ATOM 670 N ILE A 42 -34.414 10.653 -16.888 1.00 0.00 N ATOM 671 CA ILE A 42 -33.874 11.096 -18.179 1.00 0.00 C ATOM 672 C ILE A 42 -34.033 10.032 -19.279 1.00 0.00 C ATOM 673 O ILE A 42 -34.090 10.377 -20.461 1.00 0.00 O ATOM 674 CB ILE A 42 -32.399 11.522 -18.017 1.00 0.00 C ATOM 675 CG1 ILE A 42 -31.517 10.363 -17.496 1.00 0.00 C ATOM 676 CG2 ILE A 42 -32.312 12.749 -17.092 1.00 0.00 C ATOM 677 CD1 ILE A 42 -30.029 10.690 -17.451 1.00 0.00 C ATOM 0 H ILE A 42 -33.688 10.475 -16.194 1.00 0.00 H new ATOM 0 HA ILE A 42 -34.456 11.959 -18.503 1.00 0.00 H new ATOM 0 HB ILE A 42 -32.011 11.791 -19.000 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -31.849 10.089 -16.495 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -31.668 9.491 -18.132 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -31.270 13.047 -16.980 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -32.880 13.572 -17.525 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -32.725 12.498 -16.115 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -29.478 9.828 -17.075 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -29.680 10.934 -18.454 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -29.863 11.542 -16.792 1.00 0.00 H new ATOM 689 N TYR A 43 -34.129 8.750 -18.900 1.00 0.00 N ATOM 690 CA TYR A 43 -34.409 7.633 -19.826 1.00 0.00 C ATOM 691 C TYR A 43 -35.083 6.447 -19.127 1.00 0.00 C ATOM 692 O TYR A 43 -35.042 6.333 -17.906 1.00 0.00 O ATOM 693 CB TYR A 43 -33.138 7.215 -20.594 1.00 0.00 C ATOM 694 CG TYR A 43 -33.394 6.333 -21.803 1.00 0.00 C ATOM 695 CD1 TYR A 43 -33.819 6.915 -23.014 1.00 0.00 C ATOM 696 CD2 TYR A 43 -33.185 4.941 -21.728 1.00 0.00 C ATOM 697 CE1 TYR A 43 -34.051 6.104 -24.142 1.00 0.00 C ATOM 698 CE2 TYR A 43 -33.402 4.130 -22.858 1.00 0.00 C ATOM 699 CZ TYR A 43 -33.835 4.711 -24.069 1.00 0.00 C ATOM 700 OH TYR A 43 -34.074 3.933 -25.162 1.00 0.00 O ATOM 0 H TYR A 43 -34.014 8.451 -17.932 1.00 0.00 H new ATOM 0 HA TYR A 43 -35.129 7.995 -20.560 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -32.614 8.113 -20.920 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -32.472 6.688 -19.910 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -33.967 7.983 -23.077 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -32.857 4.495 -20.801 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -34.395 6.549 -25.064 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -33.237 3.064 -22.798 1.00 0.00 H new ATOM 0 HH TYR A 43 -33.875 2.998 -24.947 1.00 0.00 H new ATOM 710 N CYS A 44 -35.752 5.573 -19.878 1.00 0.00 N ATOM 711 CA CYS A 44 -36.525 4.461 -19.319 1.00 0.00 C ATOM 712 C CYS A 44 -36.538 3.219 -20.227 1.00 0.00 C ATOM 713 O CYS A 44 -36.545 3.342 -21.457 1.00 0.00 O ATOM 714 CB CYS A 44 -37.941 4.961 -18.978 1.00 0.00 C ATOM 715 SG CYS A 44 -38.664 5.889 -20.357 1.00 0.00 S ATOM 0 H CYS A 44 -35.774 5.615 -20.897 1.00 0.00 H new ATOM 0 HA CYS A 44 -36.037 4.124 -18.404 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -38.580 4.112 -18.734 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -37.901 5.595 -18.092 1.00 0.00 H new ATOM 0 HG CYS A 44 -38.840 7.127 -20.002 1.00 0.00 H new ATOM 721 N ASN A 45 -36.553 2.018 -19.630 1.00 0.00 N ATOM 722 CA ASN A 45 -36.599 0.754 -20.377 1.00 0.00 C ATOM 723 C ASN A 45 -38.027 0.226 -20.591 1.00 0.00 C ATOM 724 O ASN A 45 -38.945 0.548 -19.837 1.00 0.00 O ATOM 725 CB ASN A 45 -35.673 -0.268 -19.697 1.00 0.00 C ATOM 726 CG ASN A 45 -35.278 -1.406 -20.623 1.00 0.00 C ATOM 727 OD1 ASN A 45 -34.841 -1.199 -21.745 1.00 0.00 O ATOM 728 ND2 ASN A 45 -35.423 -2.639 -20.193 1.00 0.00 N ATOM 0 H ASN A 45 -36.534 1.897 -18.617 1.00 0.00 H new ATOM 0 HA ASN A 45 -36.232 0.938 -21.387 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -34.774 0.239 -19.346 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -36.172 -0.676 -18.818 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -35.171 -3.422 -20.796 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -35.788 -2.813 -19.256 1.00 0.00 H new ATOM 735 N ASP A 46 -38.212 -0.648 -21.582 1.00 0.00 N ATOM 736 CA ASP A 46 -39.507 -1.300 -21.843 1.00 0.00 C ATOM 737 C ASP A 46 -39.951 -2.211 -20.680 1.00 0.00 C ATOM 738 O ASP A 46 -41.144 -2.398 -20.445 1.00 0.00 O ATOM 739 CB ASP A 46 -39.474 -2.049 -23.185 1.00 0.00 C ATOM 740 CG ASP A 46 -38.674 -3.363 -23.137 1.00 0.00 C ATOM 741 OD1 ASP A 46 -37.431 -3.309 -22.990 1.00 0.00 O ATOM 742 OD2 ASP A 46 -39.286 -4.451 -23.261 1.00 0.00 O ATOM 0 H ASP A 46 -37.473 -0.927 -22.228 1.00 0.00 H new ATOM 0 HA ASP A 46 -40.262 -0.517 -21.915 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -40.496 -2.267 -23.495 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -39.042 -1.398 -23.945 1.00 0.00 H new ATOM 747 N GLY A 47 -39.001 -2.687 -19.870 1.00 0.00 N ATOM 748 CA GLY A 47 -39.286 -3.370 -18.611 1.00 0.00 C ATOM 749 C GLY A 47 -40.151 -2.526 -17.662 1.00 0.00 C ATOM 750 O GLY A 47 -41.189 -3.007 -17.216 1.00 0.00 O ATOM 0 H GLY A 47 -38.005 -2.607 -20.074 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -39.795 -4.311 -18.820 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -38.347 -3.618 -18.116 1.00 0.00 H new ATOM 754 N PHE A 48 -39.801 -1.254 -17.401 1.00 0.00 N ATOM 755 CA PHE A 48 -40.665 -0.337 -16.625 1.00 0.00 C ATOM 756 C PHE A 48 -42.066 -0.259 -17.278 1.00 0.00 C ATOM 757 O PHE A 48 -43.090 -0.189 -16.595 1.00 0.00 O ATOM 758 CB PHE A 48 -40.050 1.091 -16.525 1.00 0.00 C ATOM 759 CG PHE A 48 -41.032 2.201 -16.896 1.00 0.00 C ATOM 760 CD1 PHE A 48 -41.139 2.651 -18.227 1.00 0.00 C ATOM 761 CD2 PHE A 48 -41.991 2.617 -15.948 1.00 0.00 C ATOM 762 CE1 PHE A 48 -42.261 3.395 -18.629 1.00 0.00 C ATOM 763 CE2 PHE A 48 -43.100 3.382 -16.350 1.00 0.00 C ATOM 764 CZ PHE A 48 -43.248 3.753 -17.696 1.00 0.00 C ATOM 0 H PHE A 48 -38.926 -0.834 -17.715 1.00 0.00 H new ATOM 0 HA PHE A 48 -40.749 -0.735 -15.614 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -39.695 1.255 -15.508 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -39.181 1.151 -17.180 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -40.359 2.424 -18.938 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -41.873 2.347 -14.909 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -42.365 3.693 -19.662 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -43.839 3.685 -15.623 1.00 0.00 H new ATOM 0 HZ PHE A 48 -44.117 4.311 -18.013 1.00 0.00 H new ATOM 774 N CYS A 49 -42.109 -0.261 -18.614 1.00 0.00 N ATOM 775 CA CYS A 49 -43.365 -0.201 -19.359 1.00 0.00 C ATOM 776 C CYS A 49 -44.266 -1.403 -19.025 1.00 0.00 C ATOM 777 O CYS A 49 -45.467 -1.235 -18.821 1.00 0.00 O ATOM 778 CB CYS A 49 -43.090 -0.022 -20.859 1.00 0.00 C ATOM 779 SG CYS A 49 -44.541 0.711 -21.663 1.00 0.00 S ATOM 0 H CYS A 49 -41.278 -0.304 -19.204 1.00 0.00 H new ATOM 0 HA CYS A 49 -43.929 0.678 -19.047 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -42.219 0.617 -21.005 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -42.858 -0.985 -21.314 1.00 0.00 H new ATOM 0 HG CYS A 49 -44.304 0.863 -22.932 1.00 0.00 H new ATOM 785 N GLU A 50 -43.692 -2.603 -18.883 1.00 0.00 N ATOM 786 CA GLU A 50 -44.426 -3.808 -18.462 1.00 0.00 C ATOM 787 C GLU A 50 -44.757 -3.815 -16.956 1.00 0.00 C ATOM 788 O GLU A 50 -45.781 -4.363 -16.545 1.00 0.00 O ATOM 789 CB GLU A 50 -43.627 -5.073 -18.812 1.00 0.00 C ATOM 790 CG GLU A 50 -43.308 -5.184 -20.308 1.00 0.00 C ATOM 791 CD GLU A 50 -42.730 -6.572 -20.652 1.00 0.00 C ATOM 792 OE1 GLU A 50 -41.645 -6.936 -20.138 1.00 0.00 O ATOM 793 OE2 GLU A 50 -43.366 -7.319 -21.438 1.00 0.00 O ATOM 0 H GLU A 50 -42.701 -2.769 -19.057 1.00 0.00 H new ATOM 0 HA GLU A 50 -45.370 -3.797 -19.006 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -42.695 -5.076 -18.246 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -44.192 -5.951 -18.500 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -44.213 -5.009 -20.890 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -42.594 -4.410 -20.589 1.00 0.00 H new ATOM 800 N LEU A 51 -43.912 -3.181 -16.135 1.00 0.00 N ATOM 801 CA LEU A 51 -44.070 -3.045 -14.684 1.00 0.00 C ATOM 802 C LEU A 51 -45.301 -2.209 -14.311 1.00 0.00 C ATOM 803 O LEU A 51 -46.163 -2.675 -13.565 1.00 0.00 O ATOM 804 CB LEU A 51 -42.780 -2.405 -14.142 1.00 0.00 C ATOM 805 CG LEU A 51 -42.737 -2.141 -12.631 1.00 0.00 C ATOM 806 CD1 LEU A 51 -42.773 -3.433 -11.819 1.00 0.00 C ATOM 807 CD2 LEU A 51 -41.473 -1.371 -12.283 1.00 0.00 C ATOM 0 H LEU A 51 -43.064 -2.730 -16.479 1.00 0.00 H new ATOM 0 HA LEU A 51 -44.232 -4.026 -14.238 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -41.942 -3.052 -14.401 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -42.624 -1.459 -14.660 1.00 0.00 H new ATOM 0 HG LEU A 51 -43.623 -1.559 -12.377 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -42.741 -3.195 -10.756 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -43.691 -3.977 -12.041 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -41.913 -4.050 -12.079 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -41.444 -1.185 -11.209 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -40.600 -1.955 -12.573 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -41.467 -0.421 -12.817 1.00 0.00 H new ATOM 819 N CYS A 52 -45.388 -0.993 -14.850 1.00 0.00 N ATOM 820 CA CYS A 52 -46.473 -0.045 -14.572 1.00 0.00 C ATOM 821 C CYS A 52 -47.624 -0.154 -15.590 1.00 0.00 C ATOM 822 O CYS A 52 -48.763 0.202 -15.289 1.00 0.00 O ATOM 823 CB CYS A 52 -45.878 1.370 -14.526 1.00 0.00 C ATOM 824 SG CYS A 52 -44.614 1.483 -13.221 1.00 0.00 S ATOM 0 H CYS A 52 -44.695 -0.630 -15.504 1.00 0.00 H new ATOM 0 HA CYS A 52 -46.920 -0.286 -13.607 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -45.437 1.618 -15.491 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -46.668 2.098 -14.341 1.00 0.00 H new ATOM 0 HG CYS A 52 -44.120 2.685 -13.198 1.00 0.00 H new ATOM 830 N GLY A 53 -47.362 -0.682 -16.790 1.00 0.00 N ATOM 831 CA GLY A 53 -48.370 -0.874 -17.846 1.00 0.00 C ATOM 832 C GLY A 53 -48.784 0.394 -18.614 1.00 0.00 C ATOM 833 O GLY A 53 -49.760 0.345 -19.365 1.00 0.00 O ATOM 0 H GLY A 53 -46.430 -0.994 -17.062 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -47.985 -1.600 -18.562 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -49.261 -1.311 -17.396 1.00 0.00 H new ATOM 837 N TYR A 54 -48.079 1.518 -18.429 1.00 0.00 N ATOM 838 CA TYR A 54 -48.366 2.807 -19.079 1.00 0.00 C ATOM 839 C TYR A 54 -47.543 2.989 -20.374 1.00 0.00 C ATOM 840 O TYR A 54 -47.737 2.240 -21.334 1.00 0.00 O ATOM 841 CB TYR A 54 -48.257 3.952 -18.053 1.00 0.00 C ATOM 842 CG TYR A 54 -49.424 4.014 -17.081 1.00 0.00 C ATOM 843 CD1 TYR A 54 -50.627 4.630 -17.483 1.00 0.00 C ATOM 844 CD2 TYR A 54 -49.317 3.465 -15.789 1.00 0.00 C ATOM 845 CE1 TYR A 54 -51.721 4.695 -16.599 1.00 0.00 C ATOM 846 CE2 TYR A 54 -50.409 3.525 -14.901 1.00 0.00 C ATOM 847 CZ TYR A 54 -51.614 4.141 -15.305 1.00 0.00 C ATOM 848 OH TYR A 54 -52.672 4.190 -14.449 1.00 0.00 O ATOM 0 H TYR A 54 -47.272 1.559 -17.807 1.00 0.00 H new ATOM 0 HA TYR A 54 -49.399 2.827 -19.427 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -47.332 3.836 -17.489 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -48.189 4.900 -18.586 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -50.710 5.054 -18.473 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -48.395 2.996 -15.478 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -52.641 5.168 -16.910 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -50.325 3.100 -13.912 1.00 0.00 H new ATOM 0 HH TYR A 54 -52.644 3.415 -13.850 1.00 0.00 H new ATOM 858 N SER A 55 -46.654 3.988 -20.433 1.00 0.00 N ATOM 859 CA SER A 55 -45.830 4.331 -21.602 1.00 0.00 C ATOM 860 C SER A 55 -44.615 5.162 -21.183 1.00 0.00 C ATOM 861 O SER A 55 -44.670 5.922 -20.216 1.00 0.00 O ATOM 862 CB SER A 55 -46.661 5.108 -22.632 1.00 0.00 C ATOM 863 OG SER A 55 -45.860 5.480 -23.743 1.00 0.00 O ATOM 0 H SER A 55 -46.481 4.604 -19.638 1.00 0.00 H new ATOM 0 HA SER A 55 -45.480 3.403 -22.054 1.00 0.00 H new ATOM 0 HB2 SER A 55 -47.497 4.496 -22.969 1.00 0.00 H new ATOM 0 HB3 SER A 55 -47.085 5.999 -22.168 1.00 0.00 H new ATOM 0 HG SER A 55 -46.407 5.973 -24.390 1.00 0.00 H new ATOM 869 N ARG A 56 -43.507 5.046 -21.919 1.00 0.00 N ATOM 870 CA ARG A 56 -42.259 5.805 -21.686 1.00 0.00 C ATOM 871 C ARG A 56 -42.480 7.321 -21.729 1.00 0.00 C ATOM 872 O ARG A 56 -41.956 8.048 -20.885 1.00 0.00 O ATOM 873 CB ARG A 56 -41.196 5.336 -22.699 1.00 0.00 C ATOM 874 CG ARG A 56 -40.850 3.845 -22.490 1.00 0.00 C ATOM 875 CD ARG A 56 -39.443 3.464 -22.956 1.00 0.00 C ATOM 876 NE ARG A 56 -39.215 3.699 -24.394 1.00 0.00 N ATOM 877 CZ ARG A 56 -38.031 3.825 -24.968 1.00 0.00 C ATOM 878 NH1 ARG A 56 -36.920 3.753 -24.291 1.00 0.00 N ATOM 879 NH2 ARG A 56 -37.932 4.027 -26.251 1.00 0.00 N ATOM 0 H ARG A 56 -43.443 4.409 -22.713 1.00 0.00 H new ATOM 0 HA ARG A 56 -41.902 5.599 -20.677 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -41.564 5.489 -23.714 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -40.295 5.940 -22.592 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -40.949 3.604 -21.432 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -41.577 3.235 -23.026 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -38.712 4.034 -22.383 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -39.269 2.411 -22.736 1.00 0.00 H new ATOM 0 HE ARG A 56 -40.037 3.770 -24.994 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -36.946 3.595 -23.284 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -36.024 3.855 -24.768 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -38.774 4.090 -26.824 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -37.013 4.123 -26.683 1.00 0.00 H new ATOM 893 N ALA A 57 -43.365 7.791 -22.608 1.00 0.00 N ATOM 894 CA ALA A 57 -43.775 9.196 -22.693 1.00 0.00 C ATOM 895 C ALA A 57 -44.451 9.721 -21.403 1.00 0.00 C ATOM 896 O ALA A 57 -44.458 10.927 -21.157 1.00 0.00 O ATOM 897 CB ALA A 57 -44.704 9.340 -23.904 1.00 0.00 C ATOM 0 H ALA A 57 -43.827 7.195 -23.295 1.00 0.00 H new ATOM 0 HA ALA A 57 -42.883 9.810 -22.812 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -45.027 10.377 -23.994 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -44.171 9.046 -24.808 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -45.576 8.699 -23.772 1.00 0.00 H new ATOM 903 N GLU A 58 -44.974 8.829 -20.553 1.00 0.00 N ATOM 904 CA GLU A 58 -45.580 9.153 -19.257 1.00 0.00 C ATOM 905 C GLU A 58 -44.531 9.273 -18.136 1.00 0.00 C ATOM 906 O GLU A 58 -44.816 9.892 -17.111 1.00 0.00 O ATOM 907 CB GLU A 58 -46.649 8.108 -18.892 1.00 0.00 C ATOM 908 CG GLU A 58 -47.736 7.906 -19.962 1.00 0.00 C ATOM 909 CD GLU A 58 -48.768 9.051 -19.951 1.00 0.00 C ATOM 910 OE1 GLU A 58 -49.787 8.950 -19.224 1.00 0.00 O ATOM 911 OE2 GLU A 58 -48.576 10.057 -20.676 1.00 0.00 O ATOM 0 H GLU A 58 -44.987 7.829 -20.756 1.00 0.00 H new ATOM 0 HA GLU A 58 -46.055 10.129 -19.354 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -46.157 7.153 -18.707 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -47.127 8.406 -17.959 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -47.271 7.845 -20.946 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -48.244 6.957 -19.790 1.00 0.00 H new ATOM 918 N VAL A 59 -43.331 8.688 -18.305 1.00 0.00 N ATOM 919 CA VAL A 59 -42.210 8.787 -17.344 1.00 0.00 C ATOM 920 C VAL A 59 -41.070 9.711 -17.773 1.00 0.00 C ATOM 921 O VAL A 59 -40.268 10.087 -16.920 1.00 0.00 O ATOM 922 CB VAL A 59 -41.671 7.414 -16.909 1.00 0.00 C ATOM 923 CG1 VAL A 59 -42.691 6.702 -16.018 1.00 0.00 C ATOM 924 CG2 VAL A 59 -41.299 6.528 -18.089 1.00 0.00 C ATOM 0 H VAL A 59 -43.107 8.124 -19.125 1.00 0.00 H new ATOM 0 HA VAL A 59 -42.664 9.264 -16.476 1.00 0.00 H new ATOM 0 HB VAL A 59 -40.756 7.597 -16.345 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -42.297 5.731 -15.717 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -42.884 7.306 -15.131 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -43.620 6.561 -16.570 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -40.925 5.572 -17.723 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -42.179 6.359 -18.709 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -40.526 7.017 -18.682 1.00 0.00 H new ATOM 934 N MET A 60 -41.031 10.161 -19.035 1.00 0.00 N ATOM 935 CA MET A 60 -40.049 11.108 -19.559 1.00 0.00 C ATOM 936 C MET A 60 -39.943 12.326 -18.645 1.00 0.00 C ATOM 937 O MET A 60 -40.822 13.188 -18.604 1.00 0.00 O ATOM 938 CB MET A 60 -40.461 11.562 -20.975 1.00 0.00 C ATOM 939 CG MET A 60 -39.870 10.700 -22.090 1.00 0.00 C ATOM 940 SD MET A 60 -38.075 10.876 -22.304 1.00 0.00 S ATOM 941 CE MET A 60 -37.511 9.262 -21.703 1.00 0.00 C ATOM 0 H MET A 60 -41.707 9.863 -19.739 1.00 0.00 H new ATOM 0 HA MET A 60 -39.079 10.613 -19.603 1.00 0.00 H new ATOM 0 HB2 MET A 60 -41.548 11.544 -21.051 1.00 0.00 H new ATOM 0 HB3 MET A 60 -40.148 12.596 -21.122 1.00 0.00 H new ATOM 0 HG2 MET A 60 -40.098 9.654 -21.884 1.00 0.00 H new ATOM 0 HG3 MET A 60 -40.362 10.954 -23.029 1.00 0.00 H new ATOM 0 HE1 MET A 60 -36.483 9.093 -22.024 1.00 0.00 H new ATOM 0 HE2 MET A 60 -37.560 9.242 -20.614 1.00 0.00 H new ATOM 0 HE3 MET A 60 -38.151 8.479 -22.109 1.00 0.00 H new ATOM 951 N GLN A 61 -38.828 12.394 -17.922 1.00 0.00 N ATOM 952 CA GLN A 61 -38.415 13.524 -17.098 1.00 0.00 C ATOM 953 C GLN A 61 -39.318 13.739 -15.861 1.00 0.00 C ATOM 954 O GLN A 61 -39.359 14.840 -15.306 1.00 0.00 O ATOM 955 CB GLN A 61 -38.187 14.757 -18.005 1.00 0.00 C ATOM 956 CG GLN A 61 -37.355 14.450 -19.281 1.00 0.00 C ATOM 957 CD GLN A 61 -37.874 15.172 -20.526 1.00 0.00 C ATOM 958 OE1 GLN A 61 -38.168 16.362 -20.528 1.00 0.00 O ATOM 959 NE2 GLN A 61 -38.020 14.469 -21.633 1.00 0.00 N ATOM 0 H GLN A 61 -38.157 11.626 -17.894 1.00 0.00 H new ATOM 0 HA GLN A 61 -37.455 13.309 -16.629 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -39.154 15.162 -18.302 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -37.680 15.531 -17.429 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -36.318 14.737 -19.108 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -37.363 13.375 -19.462 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -37.779 13.478 -21.643 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -38.374 14.917 -22.478 1.00 0.00 H new ATOM 968 N ARG A 62 -40.037 12.694 -15.406 1.00 0.00 N ATOM 969 CA ARG A 62 -40.757 12.662 -14.120 1.00 0.00 C ATOM 970 C ARG A 62 -39.800 12.300 -12.970 1.00 0.00 C ATOM 971 O ARG A 62 -38.744 11.732 -13.248 1.00 0.00 O ATOM 972 CB ARG A 62 -41.895 11.625 -14.190 1.00 0.00 C ATOM 973 CG ARG A 62 -43.213 12.129 -14.788 1.00 0.00 C ATOM 974 CD ARG A 62 -43.249 12.444 -16.289 1.00 0.00 C ATOM 975 NE ARG A 62 -42.706 13.771 -16.634 1.00 0.00 N ATOM 976 CZ ARG A 62 -43.236 14.960 -16.417 1.00 0.00 C ATOM 977 NH1 ARG A 62 -44.382 15.121 -15.819 1.00 0.00 N ATOM 978 NH2 ARG A 62 -42.610 16.029 -16.816 1.00 0.00 N ATOM 0 H ARG A 62 -40.135 11.828 -15.936 1.00 0.00 H new ATOM 0 HA ARG A 62 -41.172 13.652 -13.929 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -41.552 10.774 -14.778 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -42.091 11.258 -13.183 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -43.979 11.381 -14.585 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -43.500 13.033 -14.250 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -42.684 11.681 -16.824 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -44.279 12.382 -16.639 1.00 0.00 H new ATOM 0 HE ARG A 62 -41.800 13.770 -17.103 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -44.908 14.308 -15.497 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -44.753 16.060 -15.673 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -41.713 15.946 -17.295 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -43.016 16.950 -16.650 1.00 0.00 H new ATOM 992 N PRO A 63 -40.136 12.564 -11.693 1.00 0.00 N ATOM 993 CA PRO A 63 -39.310 12.150 -10.555 1.00 0.00 C ATOM 994 C PRO A 63 -39.126 10.625 -10.468 1.00 0.00 C ATOM 995 O PRO A 63 -40.086 9.863 -10.606 1.00 0.00 O ATOM 996 CB PRO A 63 -40.013 12.694 -9.304 1.00 0.00 C ATOM 997 CG PRO A 63 -40.870 13.840 -9.839 1.00 0.00 C ATOM 998 CD PRO A 63 -41.273 13.343 -11.226 1.00 0.00 C ATOM 0 HA PRO A 63 -38.300 12.547 -10.662 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -40.623 11.929 -8.823 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -39.295 13.043 -8.562 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -41.739 14.024 -9.207 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -40.310 14.774 -9.891 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -42.176 12.734 -11.180 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -41.484 14.175 -11.898 1.00 0.00 H new ATOM 1006 N CYS A 64 -37.904 10.176 -10.175 1.00 0.00 N ATOM 1007 CA CYS A 64 -37.586 8.778 -9.851 1.00 0.00 C ATOM 1008 C CYS A 64 -38.145 8.340 -8.475 1.00 0.00 C ATOM 1009 O CYS A 64 -38.303 7.149 -8.207 1.00 0.00 O ATOM 1010 CB CYS A 64 -36.061 8.633 -9.928 1.00 0.00 C ATOM 1011 SG CYS A 64 -35.589 6.885 -9.859 1.00 0.00 S ATOM 0 H CYS A 64 -37.087 10.786 -10.155 1.00 0.00 H new ATOM 0 HA CYS A 64 -38.069 8.113 -10.567 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -35.693 9.080 -10.852 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -35.596 9.175 -9.105 1.00 0.00 H new ATOM 0 HG CYS A 64 -36.479 6.221 -9.183 1.00 0.00 H new ATOM 1017 N THR A 65 -38.456 9.303 -7.603 1.00 0.00 N ATOM 1018 CA THR A 65 -39.027 9.154 -6.266 1.00 0.00 C ATOM 1019 C THR A 65 -40.387 8.465 -6.320 1.00 0.00 C ATOM 1020 O THR A 65 -41.402 9.085 -6.634 1.00 0.00 O ATOM 1021 CB THR A 65 -39.156 10.513 -5.551 1.00 0.00 C ATOM 1022 OG1 THR A 65 -38.048 11.347 -5.813 1.00 0.00 O ATOM 1023 CG2 THR A 65 -39.241 10.310 -4.042 1.00 0.00 C ATOM 0 H THR A 65 -38.302 10.284 -7.834 1.00 0.00 H new ATOM 0 HA THR A 65 -38.341 8.529 -5.695 1.00 0.00 H new ATOM 0 HB THR A 65 -40.062 10.986 -5.930 1.00 0.00 H new ATOM 0 HG1 THR A 65 -38.163 12.201 -5.346 1.00 0.00 H new ATOM 0 HG21 THR A 65 -39.332 11.278 -3.549 1.00 0.00 H new ATOM 0 HG22 THR A 65 -40.112 9.699 -3.806 1.00 0.00 H new ATOM 0 HG23 THR A 65 -38.340 9.807 -3.691 1.00 0.00 H new ATOM 1031 N CYS A 66 -40.387 7.169 -6.022 1.00 0.00 N ATOM 1032 CA CYS A 66 -41.541 6.251 -6.068 1.00 0.00 C ATOM 1033 C CYS A 66 -42.825 6.726 -5.349 1.00 0.00 C ATOM 1034 O CYS A 66 -43.892 6.164 -5.581 1.00 0.00 O ATOM 1035 CB CYS A 66 -41.118 4.879 -5.517 1.00 0.00 C ATOM 1036 SG CYS A 66 -39.644 4.249 -6.372 1.00 0.00 S ATOM 0 H CYS A 66 -39.535 6.695 -5.723 1.00 0.00 H new ATOM 0 HA CYS A 66 -41.821 6.205 -7.121 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -40.914 4.961 -4.449 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -41.938 4.170 -5.632 1.00 0.00 H new ATOM 0 HG CYS A 66 -39.096 5.209 -7.056 1.00 0.00 H new ATOM 1042 N ASP A 67 -42.759 7.770 -4.520 1.00 0.00 N ATOM 1043 CA ASP A 67 -43.923 8.486 -3.969 1.00 0.00 C ATOM 1044 C ASP A 67 -44.859 8.987 -5.096 1.00 0.00 C ATOM 1045 O ASP A 67 -46.081 8.824 -5.036 1.00 0.00 O ATOM 1046 CB ASP A 67 -43.384 9.663 -3.136 1.00 0.00 C ATOM 1047 CG ASP A 67 -44.472 10.356 -2.301 1.00 0.00 C ATOM 1048 OD1 ASP A 67 -45.145 11.274 -2.825 1.00 0.00 O ATOM 1049 OD2 ASP A 67 -44.629 9.998 -1.108 1.00 0.00 O ATOM 0 H ASP A 67 -41.870 8.156 -4.201 1.00 0.00 H new ATOM 0 HA ASP A 67 -44.518 7.817 -3.346 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -42.599 9.301 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -42.926 10.393 -3.803 1.00 0.00 H new ATOM 1054 N PHE A 68 -44.274 9.471 -6.200 1.00 0.00 N ATOM 1055 CA PHE A 68 -44.967 9.843 -7.442 1.00 0.00 C ATOM 1056 C PHE A 68 -45.761 8.672 -8.068 1.00 0.00 C ATOM 1057 O PHE A 68 -46.693 8.887 -8.846 1.00 0.00 O ATOM 1058 CB PHE A 68 -43.898 10.374 -8.415 1.00 0.00 C ATOM 1059 CG PHE A 68 -44.438 10.997 -9.689 1.00 0.00 C ATOM 1060 CD1 PHE A 68 -44.810 12.355 -9.707 1.00 0.00 C ATOM 1061 CD2 PHE A 68 -44.574 10.221 -10.857 1.00 0.00 C ATOM 1062 CE1 PHE A 68 -45.326 12.930 -10.882 1.00 0.00 C ATOM 1063 CE2 PHE A 68 -45.101 10.793 -12.027 1.00 0.00 C ATOM 1064 CZ PHE A 68 -45.478 12.148 -12.041 1.00 0.00 C ATOM 0 H PHE A 68 -43.266 9.620 -6.255 1.00 0.00 H new ATOM 0 HA PHE A 68 -45.715 10.605 -7.222 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -43.292 11.116 -7.895 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -43.234 9.552 -8.684 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -44.699 12.956 -8.817 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -44.272 9.184 -10.853 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -45.606 13.973 -10.894 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -45.217 10.192 -12.917 1.00 0.00 H new ATOM 0 HZ PHE A 68 -45.884 12.587 -12.940 1.00 0.00 H new ATOM 1074 N LEU A 69 -45.415 7.433 -7.697 1.00 0.00 N ATOM 1075 CA LEU A 69 -46.005 6.171 -8.146 1.00 0.00 C ATOM 1076 C LEU A 69 -46.836 5.484 -7.031 1.00 0.00 C ATOM 1077 O LEU A 69 -47.100 4.283 -7.107 1.00 0.00 O ATOM 1078 CB LEU A 69 -44.863 5.291 -8.720 1.00 0.00 C ATOM 1079 CG LEU A 69 -45.119 4.581 -10.064 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -46.273 3.585 -10.015 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -45.360 5.566 -11.211 1.00 0.00 C ATOM 0 H LEU A 69 -44.661 7.278 -7.027 1.00 0.00 H new ATOM 0 HA LEU A 69 -46.733 6.349 -8.937 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -43.979 5.919 -8.834 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -44.620 4.530 -7.979 1.00 0.00 H new ATOM 0 HG LEU A 69 -44.200 4.027 -10.254 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -46.397 3.123 -10.994 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -46.057 2.814 -9.275 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -47.191 4.105 -9.741 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -45.535 5.014 -12.134 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -46.231 6.181 -10.985 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -44.486 6.206 -11.331 1.00 0.00 H new ATOM 1093 N HIS A 70 -47.276 6.219 -5.993 1.00 0.00 N ATOM 1094 CA HIS A 70 -48.165 5.672 -4.950 1.00 0.00 C ATOM 1095 C HIS A 70 -49.466 5.080 -5.505 1.00 0.00 C ATOM 1096 O HIS A 70 -50.160 5.700 -6.316 1.00 0.00 O ATOM 1097 CB HIS A 70 -48.565 6.744 -3.922 1.00 0.00 C ATOM 1098 CG HIS A 70 -47.623 6.886 -2.760 1.00 0.00 C ATOM 1099 ND1 HIS A 70 -47.159 5.837 -1.964 1.00 0.00 N ATOM 1100 CD2 HIS A 70 -47.137 8.058 -2.271 1.00 0.00 C ATOM 1101 CE1 HIS A 70 -46.355 6.399 -1.053 1.00 0.00 C ATOM 1102 NE2 HIS A 70 -46.329 7.734 -1.208 1.00 0.00 N ATOM 0 H HIS A 70 -47.029 7.199 -5.854 1.00 0.00 H new ATOM 0 HA HIS A 70 -47.577 4.881 -4.485 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -48.639 7.705 -4.431 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -49.558 6.508 -3.540 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -47.345 9.050 -2.645 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -45.804 5.856 -0.299 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -45.801 8.393 -0.636 1.00 0.00 H new ATOM 1110 N GLY A 71 -49.833 3.920 -4.964 1.00 0.00 N ATOM 1111 CA GLY A 71 -51.128 3.259 -5.126 1.00 0.00 C ATOM 1112 C GLY A 71 -51.722 2.831 -3.771 1.00 0.00 C ATOM 1113 O GLY A 71 -51.065 2.988 -2.728 1.00 0.00 O ATOM 0 H GLY A 71 -49.201 3.386 -4.368 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -51.820 3.933 -5.630 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -51.013 2.384 -5.766 1.00 0.00 H new ATOM 1117 N PRO A 72 -52.943 2.258 -3.750 1.00 0.00 N ATOM 1118 CA PRO A 72 -53.639 1.875 -2.513 1.00 0.00 C ATOM 1119 C PRO A 72 -52.957 0.773 -1.679 1.00 0.00 C ATOM 1120 O PRO A 72 -53.341 0.553 -0.527 1.00 0.00 O ATOM 1121 CB PRO A 72 -55.036 1.421 -2.960 1.00 0.00 C ATOM 1122 CG PRO A 72 -55.252 2.153 -4.282 1.00 0.00 C ATOM 1123 CD PRO A 72 -53.852 2.147 -4.886 1.00 0.00 C ATOM 0 HA PRO A 72 -53.646 2.731 -1.838 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -55.083 0.340 -3.089 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -55.797 1.687 -2.226 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -55.972 1.639 -4.919 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -55.626 3.166 -4.130 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -53.670 1.231 -5.448 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -53.719 2.978 -5.579 1.00 0.00 H new ATOM 1131 N ARG A 73 -51.925 0.113 -2.226 1.00 0.00 N ATOM 1132 CA ARG A 73 -51.093 -0.901 -1.548 1.00 0.00 C ATOM 1133 C ARG A 73 -49.709 -0.375 -1.131 1.00 0.00 C ATOM 1134 O ARG A 73 -48.996 -1.063 -0.400 1.00 0.00 O ATOM 1135 CB ARG A 73 -51.010 -2.139 -2.465 1.00 0.00 C ATOM 1136 CG ARG A 73 -50.586 -3.431 -1.745 1.00 0.00 C ATOM 1137 CD ARG A 73 -50.659 -4.630 -2.697 1.00 0.00 C ATOM 1138 NE ARG A 73 -50.322 -5.890 -2.006 1.00 0.00 N ATOM 1139 CZ ARG A 73 -50.510 -7.118 -2.458 1.00 0.00 C ATOM 1140 NH1 ARG A 73 -50.978 -7.368 -3.648 1.00 0.00 N ATOM 1141 NH2 ARG A 73 -50.217 -8.142 -1.708 1.00 0.00 N ATOM 0 H ARG A 73 -51.633 0.275 -3.190 1.00 0.00 H new ATOM 0 HA ARG A 73 -51.564 -1.174 -0.604 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -51.983 -2.298 -2.930 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -50.302 -1.935 -3.268 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -49.570 -3.324 -1.364 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -51.233 -3.603 -0.885 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -51.662 -4.701 -3.118 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -49.974 -4.476 -3.531 1.00 0.00 H new ATOM 0 HE ARG A 73 -49.899 -5.804 -1.082 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -51.216 -6.599 -4.274 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -51.106 -8.333 -3.953 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -49.842 -7.997 -0.771 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -50.363 -9.089 -2.058 1.00 0.00 H new ATOM 1155 N THR A 74 -49.303 0.822 -1.572 1.00 0.00 N ATOM 1156 CA THR A 74 -47.938 1.329 -1.327 1.00 0.00 C ATOM 1157 C THR A 74 -47.762 1.827 0.103 1.00 0.00 C ATOM 1158 O THR A 74 -48.637 2.496 0.655 1.00 0.00 O ATOM 1159 CB THR A 74 -47.520 2.417 -2.329 1.00 0.00 C ATOM 1160 OG1 THR A 74 -47.944 2.107 -3.638 1.00 0.00 O ATOM 1161 CG2 THR A 74 -46.003 2.598 -2.380 1.00 0.00 C ATOM 0 H THR A 74 -49.897 1.461 -2.101 1.00 0.00 H new ATOM 0 HA THR A 74 -47.275 0.476 -1.475 1.00 0.00 H new ATOM 0 HB THR A 74 -47.995 3.333 -1.979 1.00 0.00 H new ATOM 0 HG1 THR A 74 -47.214 1.669 -4.123 1.00 0.00 H new ATOM 0 HG21 THR A 74 -45.753 3.376 -3.101 1.00 0.00 H new ATOM 0 HG22 THR A 74 -45.638 2.886 -1.394 1.00 0.00 H new ATOM 0 HG23 THR A 74 -45.535 1.661 -2.681 1.00 0.00 H new ATOM 1169 N GLN A 75 -46.607 1.529 0.704 1.00 0.00 N ATOM 1170 CA GLN A 75 -46.264 2.021 2.037 1.00 0.00 C ATOM 1171 C GLN A 75 -45.664 3.430 1.934 1.00 0.00 C ATOM 1172 O GLN A 75 -44.721 3.710 1.184 1.00 0.00 O ATOM 1173 CB GLN A 75 -45.311 1.050 2.744 1.00 0.00 C ATOM 1174 CG GLN A 75 -45.895 -0.356 2.972 1.00 0.00 C ATOM 1175 CD GLN A 75 -44.814 -1.343 3.415 1.00 0.00 C ATOM 1176 OE1 GLN A 75 -44.524 -1.503 4.594 1.00 0.00 O ATOM 1177 NE2 GLN A 75 -44.167 -2.017 2.486 1.00 0.00 N ATOM 0 H GLN A 75 -45.888 0.942 0.281 1.00 0.00 H new ATOM 0 HA GLN A 75 -47.170 2.081 2.640 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -44.399 0.961 2.154 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -45.028 1.474 3.707 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -46.678 -0.308 3.728 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -46.361 -0.712 2.053 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -44.405 -1.887 1.503 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -43.428 -2.669 2.750 1.00 0.00 H new ATOM 1186 N ARG A 76 -46.203 4.333 2.745 1.00 0.00 N ATOM 1187 CA ARG A 76 -45.802 5.750 2.767 1.00 0.00 C ATOM 1188 C ARG A 76 -44.401 5.917 3.352 1.00 0.00 C ATOM 1189 O ARG A 76 -43.585 6.638 2.789 1.00 0.00 O ATOM 1190 CB ARG A 76 -46.875 6.613 3.443 1.00 0.00 C ATOM 1191 CG ARG A 76 -48.335 6.302 3.034 1.00 0.00 C ATOM 1192 CD ARG A 76 -48.610 6.215 1.518 1.00 0.00 C ATOM 1193 NE ARG A 76 -50.002 5.785 1.260 1.00 0.00 N ATOM 1194 CZ ARG A 76 -50.478 5.156 0.196 1.00 0.00 C ATOM 1195 NH1 ARG A 76 -49.797 4.957 -0.895 1.00 0.00 N ATOM 1196 NH2 ARG A 76 -51.697 4.699 0.194 1.00 0.00 N ATOM 0 H ARG A 76 -46.938 4.108 3.415 1.00 0.00 H new ATOM 0 HA ARG A 76 -45.733 6.117 1.743 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -46.785 6.494 4.523 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -46.669 7.660 3.220 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -48.625 5.356 3.490 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -48.981 7.071 3.457 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -48.433 7.186 1.056 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -47.916 5.512 1.058 1.00 0.00 H new ATOM 0 HE ARG A 76 -50.679 6.000 1.992 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -48.837 5.294 -0.965 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -50.224 4.464 -1.680 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -52.290 4.825 1.014 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -52.059 4.215 -0.628 1.00 0.00 H new ATOM 1210 N ARG A 77 -44.085 5.153 4.406 1.00 0.00 N ATOM 1211 CA ARG A 77 -42.731 5.011 4.982 1.00 0.00 C ATOM 1212 C ARG A 77 -41.693 4.471 3.999 1.00 0.00 C ATOM 1213 O ARG A 77 -40.538 4.894 4.025 1.00 0.00 O ATOM 1214 CB ARG A 77 -42.787 4.160 6.258 1.00 0.00 C ATOM 1215 CG ARG A 77 -43.253 2.707 6.077 1.00 0.00 C ATOM 1216 CD ARG A 77 -43.428 2.013 7.432 1.00 0.00 C ATOM 1217 NE ARG A 77 -42.143 1.552 7.999 1.00 0.00 N ATOM 1218 CZ ARG A 77 -41.979 0.889 9.131 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -42.984 0.555 9.892 1.00 0.00 N ATOM 1220 NH2 ARG A 77 -40.787 0.545 9.529 1.00 0.00 N ATOM 0 H ARG A 77 -44.783 4.597 4.901 1.00 0.00 H new ATOM 0 HA ARG A 77 -42.393 6.017 5.232 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -41.794 4.149 6.708 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -43.454 4.649 6.968 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -44.196 2.689 5.531 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -42.526 2.161 5.476 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -43.904 2.701 8.131 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -44.098 1.161 7.317 1.00 0.00 H new ATOM 0 HE ARG A 77 -41.301 1.766 7.465 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -43.935 0.805 9.620 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -42.819 0.043 10.759 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -39.972 0.787 8.966 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -40.669 0.034 10.404 1.00 0.00 H new ATOM 1234 N ALA A 78 -42.100 3.561 3.117 1.00 0.00 N ATOM 1235 CA ALA A 78 -41.255 3.052 2.035 1.00 0.00 C ATOM 1236 C ALA A 78 -40.923 4.173 1.034 1.00 0.00 C ATOM 1237 O ALA A 78 -39.749 4.458 0.752 1.00 0.00 O ATOM 1238 CB ALA A 78 -41.954 1.870 1.349 1.00 0.00 C ATOM 0 H ALA A 78 -43.034 3.151 3.132 1.00 0.00 H new ATOM 0 HA ALA A 78 -40.311 2.698 2.449 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -41.324 1.492 0.544 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -42.127 1.077 2.077 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -42.908 2.200 0.938 1.00 0.00 H new ATOM 1244 N ALA A 79 -41.963 4.878 0.572 1.00 0.00 N ATOM 1245 CA ALA A 79 -41.770 5.982 -0.372 1.00 0.00 C ATOM 1246 C ALA A 79 -40.980 7.153 0.243 1.00 0.00 C ATOM 1247 O ALA A 79 -40.178 7.787 -0.442 1.00 0.00 O ATOM 1248 CB ALA A 79 -43.138 6.433 -0.861 1.00 0.00 C ATOM 0 H ALA A 79 -42.934 4.706 0.833 1.00 0.00 H new ATOM 0 HA ALA A 79 -41.168 5.630 -1.210 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -43.019 7.256 -1.566 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -43.640 5.601 -1.355 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -43.736 6.766 -0.013 1.00 0.00 H new ATOM 1254 N ALA A 80 -41.152 7.397 1.545 1.00 0.00 N ATOM 1255 CA ALA A 80 -40.428 8.413 2.297 1.00 0.00 C ATOM 1256 C ALA A 80 -38.934 8.083 2.428 1.00 0.00 C ATOM 1257 O ALA A 80 -38.108 8.913 2.058 1.00 0.00 O ATOM 1258 CB ALA A 80 -41.097 8.579 3.662 1.00 0.00 C ATOM 0 H ALA A 80 -41.818 6.877 2.116 1.00 0.00 H new ATOM 0 HA ALA A 80 -40.473 9.357 1.755 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -40.566 9.337 4.238 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -42.133 8.888 3.524 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -41.069 7.631 4.199 1.00 0.00 H new ATOM 1264 N GLN A 81 -38.568 6.881 2.895 1.00 0.00 N ATOM 1265 CA GLN A 81 -37.185 6.372 2.870 1.00 0.00 C ATOM 1266 C GLN A 81 -36.531 6.503 1.486 1.00 0.00 C ATOM 1267 O GLN A 81 -35.387 6.954 1.383 1.00 0.00 O ATOM 1268 CB GLN A 81 -37.157 4.912 3.343 1.00 0.00 C ATOM 1269 CG GLN A 81 -37.325 4.796 4.865 1.00 0.00 C ATOM 1270 CD GLN A 81 -37.532 3.346 5.288 1.00 0.00 C ATOM 1271 OE1 GLN A 81 -36.634 2.661 5.758 1.00 0.00 O ATOM 1272 NE2 GLN A 81 -38.728 2.824 5.115 1.00 0.00 N ATOM 0 H GLN A 81 -39.231 6.225 3.307 1.00 0.00 H new ATOM 0 HA GLN A 81 -36.599 6.989 3.552 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -37.952 4.355 2.847 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -36.214 4.453 3.047 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -36.444 5.200 5.363 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -38.176 5.396 5.186 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -39.480 3.391 4.724 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -38.903 1.853 5.372 1.00 0.00 H new ATOM 1281 N ILE A 82 -37.264 6.197 0.408 1.00 0.00 N ATOM 1282 CA ILE A 82 -36.757 6.409 -0.955 1.00 0.00 C ATOM 1283 C ILE A 82 -36.518 7.893 -1.226 1.00 0.00 C ATOM 1284 O ILE A 82 -35.427 8.258 -1.653 1.00 0.00 O ATOM 1285 CB ILE A 82 -37.706 5.768 -1.976 1.00 0.00 C ATOM 1286 CG1 ILE A 82 -37.456 4.250 -1.940 1.00 0.00 C ATOM 1287 CG2 ILE A 82 -37.502 6.357 -3.381 1.00 0.00 C ATOM 1288 CD1 ILE A 82 -38.608 3.470 -2.556 1.00 0.00 C ATOM 0 H ILE A 82 -38.204 5.804 0.451 1.00 0.00 H new ATOM 0 HA ILE A 82 -35.789 5.918 -1.056 1.00 0.00 H new ATOM 0 HB ILE A 82 -38.744 5.979 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -36.535 4.021 -2.476 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -37.312 3.930 -0.908 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -38.190 5.880 -4.079 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -37.694 7.430 -3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -36.476 6.179 -3.705 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -38.391 2.403 -2.510 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -39.524 3.678 -2.004 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -38.735 3.770 -3.596 1.00 0.00 H new ATOM 1300 N ALA A 83 -37.483 8.760 -0.918 1.00 0.00 N ATOM 1301 CA ALA A 83 -37.312 10.207 -1.008 1.00 0.00 C ATOM 1302 C ALA A 83 -36.047 10.679 -0.277 1.00 0.00 C ATOM 1303 O ALA A 83 -35.324 11.511 -0.818 1.00 0.00 O ATOM 1304 CB ALA A 83 -38.575 10.907 -0.506 1.00 0.00 C ATOM 0 H ALA A 83 -38.409 8.475 -0.598 1.00 0.00 H new ATOM 0 HA ALA A 83 -37.168 10.480 -2.053 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -38.444 11.987 -0.574 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -39.426 10.605 -1.117 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -38.757 10.629 0.532 1.00 0.00 H new ATOM 1310 N GLN A 84 -35.733 10.109 0.894 1.00 0.00 N ATOM 1311 CA GLN A 84 -34.499 10.424 1.631 1.00 0.00 C ATOM 1312 C GLN A 84 -33.244 9.925 0.892 1.00 0.00 C ATOM 1313 O GLN A 84 -32.218 10.612 0.864 1.00 0.00 O ATOM 1314 CB GLN A 84 -34.490 9.847 3.058 1.00 0.00 C ATOM 1315 CG GLN A 84 -35.725 10.087 3.936 1.00 0.00 C ATOM 1316 CD GLN A 84 -36.339 11.480 3.822 1.00 0.00 C ATOM 1317 OE1 GLN A 84 -35.831 12.464 4.343 1.00 0.00 O ATOM 1318 NE2 GLN A 84 -37.459 11.610 3.141 1.00 0.00 N ATOM 0 H GLN A 84 -36.324 9.419 1.357 1.00 0.00 H new ATOM 0 HA GLN A 84 -34.478 11.512 1.695 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -34.337 8.770 2.983 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -33.624 10.256 3.579 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -36.485 9.350 3.677 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -35.452 9.911 4.976 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -37.888 10.794 2.704 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -37.897 12.527 3.050 1.00 0.00 H new ATOM 1327 N ALA A 85 -33.323 8.746 0.265 1.00 0.00 N ATOM 1328 CA ALA A 85 -32.223 8.173 -0.504 1.00 0.00 C ATOM 1329 C ALA A 85 -31.951 8.942 -1.808 1.00 0.00 C ATOM 1330 O ALA A 85 -30.814 8.962 -2.283 1.00 0.00 O ATOM 1331 CB ALA A 85 -32.510 6.687 -0.755 1.00 0.00 C ATOM 0 H ALA A 85 -34.159 8.162 0.280 1.00 0.00 H new ATOM 0 HA ALA A 85 -31.306 8.264 0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -31.693 6.251 -1.329 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -32.601 6.168 0.199 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -33.441 6.585 -1.313 1.00 0.00 H new ATOM 1337 N LEU A 86 -32.972 9.609 -2.368 1.00 0.00 N ATOM 1338 CA LEU A 86 -32.837 10.411 -3.586 1.00 0.00 C ATOM 1339 C LEU A 86 -32.414 11.851 -3.252 1.00 0.00 C ATOM 1340 O LEU A 86 -31.615 12.454 -3.969 1.00 0.00 O ATOM 1341 CB LEU A 86 -34.119 10.348 -4.437 1.00 0.00 C ATOM 1342 CG LEU A 86 -34.664 8.944 -4.796 1.00 0.00 C ATOM 1343 CD1 LEU A 86 -35.390 9.014 -6.137 1.00 0.00 C ATOM 1344 CD2 LEU A 86 -33.616 7.834 -4.970 1.00 0.00 C ATOM 0 H LEU A 86 -33.917 9.605 -1.984 1.00 0.00 H new ATOM 0 HA LEU A 86 -32.040 9.984 -4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -34.903 10.889 -3.907 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -33.934 10.886 -5.367 1.00 0.00 H new ATOM 0 HG LEU A 86 -35.291 8.685 -3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -35.776 8.027 -6.394 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -36.218 9.720 -6.066 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -34.696 9.345 -6.910 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -34.116 6.898 -5.219 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -32.930 8.104 -5.773 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -33.058 7.711 -4.042 1.00 0.00 H new ATOM 1356 N LEU A 87 -32.875 12.370 -2.108 1.00 0.00 N ATOM 1357 CA LEU A 87 -32.433 13.615 -1.486 1.00 0.00 C ATOM 1358 C LEU A 87 -30.928 13.535 -1.156 1.00 0.00 C ATOM 1359 O LEU A 87 -30.206 14.522 -1.317 1.00 0.00 O ATOM 1360 CB LEU A 87 -33.321 13.797 -0.235 1.00 0.00 C ATOM 1361 CG LEU A 87 -32.752 14.544 0.983 1.00 0.00 C ATOM 1362 CD1 LEU A 87 -33.316 15.950 0.881 1.00 0.00 C ATOM 1363 CD2 LEU A 87 -33.224 13.956 2.312 1.00 0.00 C ATOM 0 H LEU A 87 -33.604 11.906 -1.566 1.00 0.00 H new ATOM 0 HA LEU A 87 -32.541 14.479 -2.142 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -34.226 14.319 -0.547 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -33.624 12.805 0.100 1.00 0.00 H new ATOM 0 HG LEU A 87 -31.664 14.487 0.972 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -32.955 16.548 1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -32.993 16.404 -0.056 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -34.405 15.908 0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -32.791 14.524 3.135 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -34.311 14.009 2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -32.907 12.915 2.382 1.00 0.00 H new ATOM 1375 N GLY A 88 -30.457 12.358 -0.722 1.00 0.00 N ATOM 1376 CA GLY A 88 -29.037 12.045 -0.527 1.00 0.00 C ATOM 1377 C GLY A 88 -28.609 11.894 0.937 1.00 0.00 C ATOM 1378 O GLY A 88 -27.440 12.131 1.251 1.00 0.00 O ATOM 0 H GLY A 88 -31.071 11.577 -0.491 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -28.807 11.120 -1.056 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -28.439 12.832 -0.987 1.00 0.00 H new ATOM 1382 N ALA A 89 -29.526 11.520 1.840 1.00 0.00 N ATOM 1383 CA ALA A 89 -29.197 11.219 3.238 1.00 0.00 C ATOM 1384 C ALA A 89 -28.221 10.024 3.338 1.00 0.00 C ATOM 1385 O ALA A 89 -27.179 10.107 3.990 1.00 0.00 O ATOM 1386 CB ALA A 89 -30.503 10.965 4.004 1.00 0.00 C ATOM 0 H ALA A 89 -30.517 11.418 1.620 1.00 0.00 H new ATOM 0 HA ALA A 89 -28.683 12.068 3.689 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -30.276 10.740 5.046 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -31.133 11.853 3.954 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -31.029 10.122 3.557 1.00 0.00 H new ATOM 1392 N GLU A 90 -28.553 8.928 2.652 1.00 0.00 N ATOM 1393 CA GLU A 90 -27.709 7.753 2.398 1.00 0.00 C ATOM 1394 C GLU A 90 -28.248 6.987 1.177 1.00 0.00 C ATOM 1395 O GLU A 90 -29.459 6.970 0.947 1.00 0.00 O ATOM 1396 CB GLU A 90 -27.642 6.830 3.632 1.00 0.00 C ATOM 1397 CG GLU A 90 -29.004 6.354 4.165 1.00 0.00 C ATOM 1398 CD GLU A 90 -28.814 5.385 5.344 1.00 0.00 C ATOM 1399 OE1 GLU A 90 -28.709 4.158 5.103 1.00 0.00 O ATOM 1400 OE2 GLU A 90 -28.772 5.836 6.515 1.00 0.00 O ATOM 0 H GLU A 90 -29.477 8.829 2.231 1.00 0.00 H new ATOM 0 HA GLU A 90 -26.695 8.094 2.191 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -27.042 5.956 3.380 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -27.120 7.355 4.432 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -29.596 7.212 4.484 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -29.561 5.861 3.368 1.00 0.00 H new ATOM 1407 N GLU A 91 -27.390 6.323 0.397 1.00 0.00 N ATOM 1408 CA GLU A 91 -27.862 5.452 -0.690 1.00 0.00 C ATOM 1409 C GLU A 91 -28.262 4.101 -0.093 1.00 0.00 C ATOM 1410 O GLU A 91 -27.442 3.392 0.502 1.00 0.00 O ATOM 1411 CB GLU A 91 -26.813 5.281 -1.794 1.00 0.00 C ATOM 1412 CG GLU A 91 -26.813 6.496 -2.727 1.00 0.00 C ATOM 1413 CD GLU A 91 -25.977 7.648 -2.138 1.00 0.00 C ATOM 1414 OE1 GLU A 91 -24.732 7.488 -2.070 1.00 0.00 O ATOM 1415 OE2 GLU A 91 -26.541 8.695 -1.746 1.00 0.00 O ATOM 0 H GLU A 91 -26.376 6.369 0.494 1.00 0.00 H new ATOM 0 HA GLU A 91 -28.725 5.919 -1.164 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -25.826 5.156 -1.349 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -27.022 4.376 -2.365 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -26.411 6.211 -3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -27.837 6.832 -2.891 1.00 0.00 H new ATOM 1422 N ARG A 92 -29.546 3.770 -0.237 1.00 0.00 N ATOM 1423 CA ARG A 92 -30.191 2.635 0.439 1.00 0.00 C ATOM 1424 C ARG A 92 -31.248 1.979 -0.447 1.00 0.00 C ATOM 1425 O ARG A 92 -32.067 2.665 -1.060 1.00 0.00 O ATOM 1426 CB ARG A 92 -30.789 3.136 1.771 1.00 0.00 C ATOM 1427 CG ARG A 92 -31.406 2.044 2.666 1.00 0.00 C ATOM 1428 CD ARG A 92 -30.413 0.992 3.181 1.00 0.00 C ATOM 1429 NE ARG A 92 -29.369 1.583 4.038 1.00 0.00 N ATOM 1430 CZ ARG A 92 -28.364 0.964 4.625 1.00 0.00 C ATOM 1431 NH1 ARG A 92 -28.151 -0.317 4.507 1.00 0.00 N ATOM 1432 NH2 ARG A 92 -27.552 1.663 5.357 1.00 0.00 N ATOM 0 H ARG A 92 -30.183 4.292 -0.839 1.00 0.00 H new ATOM 0 HA ARG A 92 -29.449 1.863 0.644 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -30.006 3.645 2.334 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -31.556 3.878 1.550 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -31.882 2.522 3.522 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -32.192 1.537 2.106 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -30.953 0.230 3.743 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -29.945 0.492 2.333 1.00 0.00 H new ATOM 0 HE ARG A 92 -29.432 2.589 4.195 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -28.777 -0.888 3.939 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -27.358 -0.748 4.982 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -27.700 2.666 5.467 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -26.766 1.209 5.823 1.00 0.00 H new ATOM 1446 N LYS A 93 -31.251 0.644 -0.458 1.00 0.00 N ATOM 1447 CA LYS A 93 -32.273 -0.200 -1.091 1.00 0.00 C ATOM 1448 C LYS A 93 -33.468 -0.371 -0.151 1.00 0.00 C ATOM 1449 O LYS A 93 -33.297 -0.677 1.029 1.00 0.00 O ATOM 1450 CB LYS A 93 -31.630 -1.528 -1.493 1.00 0.00 C ATOM 1451 CG LYS A 93 -32.535 -2.433 -2.331 1.00 0.00 C ATOM 1452 CD LYS A 93 -32.042 -3.883 -2.287 1.00 0.00 C ATOM 1453 CE LYS A 93 -30.626 -3.999 -2.866 1.00 0.00 C ATOM 1454 NZ LYS A 93 -30.192 -5.413 -2.977 1.00 0.00 N ATOM 0 H LYS A 93 -30.515 0.098 -0.010 1.00 0.00 H new ATOM 0 HA LYS A 93 -32.660 0.269 -1.996 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -30.719 -1.323 -2.055 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -31.334 -2.064 -0.591 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -33.557 -2.380 -1.957 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -32.554 -2.081 -3.363 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -32.049 -4.242 -1.258 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -32.723 -4.520 -2.851 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -30.596 -3.531 -3.850 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -29.928 -3.453 -2.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -29.237 -5.452 -3.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -30.180 -5.848 -2.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -30.854 -5.932 -3.589 1.00 0.00 H new ATOM 1468 N VAL A 94 -34.671 -0.173 -0.683 1.00 0.00 N ATOM 1469 CA VAL A 94 -35.949 -0.229 0.049 1.00 0.00 C ATOM 1470 C VAL A 94 -36.968 -1.001 -0.786 1.00 0.00 C ATOM 1471 O VAL A 94 -36.920 -0.979 -2.015 1.00 0.00 O ATOM 1472 CB VAL A 94 -36.480 1.192 0.383 1.00 0.00 C ATOM 1473 CG1 VAL A 94 -37.499 1.176 1.529 1.00 0.00 C ATOM 1474 CG2 VAL A 94 -35.385 2.189 0.799 1.00 0.00 C ATOM 0 H VAL A 94 -34.795 0.039 -1.673 1.00 0.00 H new ATOM 0 HA VAL A 94 -35.786 -0.741 0.997 1.00 0.00 H new ATOM 0 HB VAL A 94 -36.934 1.515 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -37.841 2.192 1.726 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -38.350 0.554 1.251 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -37.031 0.771 2.426 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -35.837 3.157 1.015 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -34.876 1.820 1.689 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -34.665 2.298 -0.012 1.00 0.00 H new ATOM 1484 N GLU A 95 -37.918 -1.654 -0.125 1.00 0.00 N ATOM 1485 CA GLU A 95 -39.071 -2.274 -0.780 1.00 0.00 C ATOM 1486 C GLU A 95 -40.121 -1.204 -1.096 1.00 0.00 C ATOM 1487 O GLU A 95 -40.123 -0.157 -0.459 1.00 0.00 O ATOM 1488 CB GLU A 95 -39.643 -3.364 0.136 1.00 0.00 C ATOM 1489 CG GLU A 95 -40.262 -2.831 1.445 1.00 0.00 C ATOM 1490 CD GLU A 95 -40.835 -3.954 2.332 1.00 0.00 C ATOM 1491 OE1 GLU A 95 -40.092 -4.903 2.685 1.00 0.00 O ATOM 1492 OE2 GLU A 95 -42.028 -3.869 2.714 1.00 0.00 O ATOM 0 H GLU A 95 -37.912 -1.770 0.888 1.00 0.00 H new ATOM 0 HA GLU A 95 -38.768 -2.735 -1.720 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -40.403 -3.921 -0.412 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -38.849 -4.068 0.383 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -39.503 -2.283 2.004 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -41.055 -2.123 1.205 1.00 0.00 H new ATOM 1499 N ILE A 96 -41.005 -1.434 -2.064 1.00 0.00 N ATOM 1500 CA ILE A 96 -42.111 -0.523 -2.405 1.00 0.00 C ATOM 1501 C ILE A 96 -43.132 -1.225 -3.299 1.00 0.00 C ATOM 1502 O ILE A 96 -42.781 -2.095 -4.101 1.00 0.00 O ATOM 1503 CB ILE A 96 -41.686 0.795 -3.129 1.00 0.00 C ATOM 1504 CG1 ILE A 96 -40.314 0.787 -3.840 1.00 0.00 C ATOM 1505 CG2 ILE A 96 -41.772 2.015 -2.207 1.00 0.00 C ATOM 1506 CD1 ILE A 96 -40.197 -0.280 -4.922 1.00 0.00 C ATOM 0 H ILE A 96 -40.978 -2.271 -2.647 1.00 0.00 H new ATOM 0 HA ILE A 96 -42.531 -0.245 -1.438 1.00 0.00 H new ATOM 0 HB ILE A 96 -42.425 0.864 -3.928 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -40.139 1.766 -4.286 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -39.530 0.629 -3.099 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -41.467 2.907 -2.754 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -42.798 2.136 -1.858 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -41.113 1.871 -1.351 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -39.209 -0.228 -5.379 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -40.340 -1.265 -4.478 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -40.958 -0.111 -5.684 1.00 0.00 H new ATOM 1518 N ALA A 97 -44.402 -0.836 -3.165 1.00 0.00 N ATOM 1519 CA ALA A 97 -45.460 -1.370 -4.025 1.00 0.00 C ATOM 1520 C ALA A 97 -45.595 -0.560 -5.325 1.00 0.00 C ATOM 1521 O ALA A 97 -45.471 0.667 -5.317 1.00 0.00 O ATOM 1522 CB ALA A 97 -46.801 -1.465 -3.288 1.00 0.00 C ATOM 0 H ALA A 97 -44.721 -0.157 -2.474 1.00 0.00 H new ATOM 0 HA ALA A 97 -45.167 -2.384 -4.297 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -47.559 -1.866 -3.961 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -46.697 -2.124 -2.426 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -47.103 -0.473 -2.952 1.00 0.00 H new ATOM 1528 N PHE A 98 -45.924 -1.249 -6.414 1.00 0.00 N ATOM 1529 CA PHE A 98 -46.315 -0.663 -7.698 1.00 0.00 C ATOM 1530 C PHE A 98 -47.790 -0.956 -7.999 1.00 0.00 C ATOM 1531 O PHE A 98 -48.384 -1.887 -7.445 1.00 0.00 O ATOM 1532 CB PHE A 98 -45.397 -1.185 -8.815 1.00 0.00 C ATOM 1533 CG PHE A 98 -44.056 -0.487 -8.888 1.00 0.00 C ATOM 1534 CD1 PHE A 98 -43.933 0.705 -9.628 1.00 0.00 C ATOM 1535 CD2 PHE A 98 -42.933 -1.017 -8.224 1.00 0.00 C ATOM 1536 CE1 PHE A 98 -42.704 1.385 -9.677 1.00 0.00 C ATOM 1537 CE2 PHE A 98 -41.701 -0.344 -8.290 1.00 0.00 C ATOM 1538 CZ PHE A 98 -41.592 0.867 -8.994 1.00 0.00 C ATOM 0 H PHE A 98 -45.927 -2.269 -6.430 1.00 0.00 H new ATOM 0 HA PHE A 98 -46.201 0.420 -7.644 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -45.232 -2.252 -8.666 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -45.906 -1.072 -9.772 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -44.787 1.098 -10.160 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -43.018 -1.938 -7.666 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -42.615 2.303 -10.238 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -40.834 -0.759 -7.797 1.00 0.00 H new ATOM 0 HZ PHE A 98 -40.653 1.400 -9.010 1.00 0.00 H new ATOM 1548 N TYR A 99 -48.373 -0.165 -8.902 1.00 0.00 N ATOM 1549 CA TYR A 99 -49.691 -0.429 -9.476 1.00 0.00 C ATOM 1550 C TYR A 99 -49.630 -0.456 -11.008 1.00 0.00 C ATOM 1551 O TYR A 99 -48.926 0.334 -11.645 1.00 0.00 O ATOM 1552 CB TYR A 99 -50.750 0.535 -8.922 1.00 0.00 C ATOM 1553 CG TYR A 99 -50.704 1.958 -9.449 1.00 0.00 C ATOM 1554 CD1 TYR A 99 -49.911 2.929 -8.807 1.00 0.00 C ATOM 1555 CD2 TYR A 99 -51.486 2.317 -10.566 1.00 0.00 C ATOM 1556 CE1 TYR A 99 -49.898 4.254 -9.284 1.00 0.00 C ATOM 1557 CE2 TYR A 99 -51.470 3.639 -11.048 1.00 0.00 C ATOM 1558 CZ TYR A 99 -50.672 4.614 -10.408 1.00 0.00 C ATOM 1559 OH TYR A 99 -50.649 5.897 -10.862 1.00 0.00 O ATOM 0 H TYR A 99 -47.937 0.686 -9.258 1.00 0.00 H new ATOM 0 HA TYR A 99 -50.008 -1.425 -9.167 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -51.735 0.122 -9.138 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -50.649 0.568 -7.837 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -49.313 2.658 -7.949 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -52.100 1.574 -11.054 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -49.293 4.998 -8.787 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -52.067 3.908 -11.907 1.00 0.00 H new ATOM 0 HH TYR A 99 -51.235 5.978 -11.643 1.00 0.00 H new ATOM 1569 N ARG A 100 -50.371 -1.398 -11.594 1.00 0.00 N ATOM 1570 CA ARG A 100 -50.546 -1.587 -13.036 1.00 0.00 C ATOM 1571 C ARG A 100 -51.657 -0.667 -13.552 1.00 0.00 C ATOM 1572 O ARG A 100 -52.629 -0.413 -12.839 1.00 0.00 O ATOM 1573 CB ARG A 100 -50.825 -3.084 -13.281 1.00 0.00 C ATOM 1574 CG ARG A 100 -50.735 -3.558 -14.743 1.00 0.00 C ATOM 1575 CD ARG A 100 -49.311 -3.571 -15.327 1.00 0.00 C ATOM 1576 NE ARG A 100 -48.323 -4.260 -14.473 1.00 0.00 N ATOM 1577 CZ ARG A 100 -48.129 -5.556 -14.322 1.00 0.00 C ATOM 1578 NH1 ARG A 100 -48.847 -6.454 -14.938 1.00 0.00 N ATOM 1579 NH2 ARG A 100 -47.197 -5.975 -13.516 1.00 0.00 N ATOM 0 H ARG A 100 -50.892 -2.085 -11.048 1.00 0.00 H new ATOM 0 HA ARG A 100 -49.650 -1.312 -13.593 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -50.120 -3.666 -12.687 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -51.823 -3.313 -12.907 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -51.150 -4.563 -14.811 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -51.360 -2.912 -15.359 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -49.333 -4.055 -16.304 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -48.985 -2.543 -15.488 1.00 0.00 H new ATOM 0 HE ARG A 100 -47.710 -3.654 -13.928 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -49.595 -6.164 -15.568 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -48.660 -7.446 -14.790 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -46.623 -5.303 -13.007 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -47.041 -6.975 -13.394 1.00 0.00 H new ATOM 1593 N LYS A 101 -51.571 -0.242 -14.814 1.00 0.00 N ATOM 1594 CA LYS A 101 -52.578 0.564 -15.527 1.00 0.00 C ATOM 1595 C LYS A 101 -53.983 -0.064 -15.525 1.00 0.00 C ATOM 1596 O LYS A 101 -54.982 0.652 -15.528 1.00 0.00 O ATOM 1597 CB LYS A 101 -52.001 0.816 -16.934 1.00 0.00 C ATOM 1598 CG LYS A 101 -52.931 1.534 -17.922 1.00 0.00 C ATOM 1599 CD LYS A 101 -53.697 0.519 -18.780 1.00 0.00 C ATOM 1600 CE LYS A 101 -54.680 1.237 -19.711 1.00 0.00 C ATOM 1601 NZ LYS A 101 -55.393 0.282 -20.599 1.00 0.00 N ATOM 0 H LYS A 101 -50.763 -0.457 -15.398 1.00 0.00 H new ATOM 0 HA LYS A 101 -52.751 1.511 -15.015 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -51.089 1.404 -16.831 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -51.715 -0.143 -17.366 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -53.636 2.161 -17.376 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -52.348 2.194 -18.564 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -52.995 -0.072 -19.368 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -54.237 -0.176 -18.137 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -55.405 1.792 -19.116 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -54.141 1.965 -20.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -56.049 0.804 -21.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -54.702 -0.230 -21.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -55.927 -0.397 -20.020 1.00 0.00 H new ATOM 1615 N ASP A 102 -54.067 -1.396 -15.464 1.00 0.00 N ATOM 1616 CA ASP A 102 -55.322 -2.160 -15.348 1.00 0.00 C ATOM 1617 C ASP A 102 -55.951 -2.133 -13.931 1.00 0.00 C ATOM 1618 O ASP A 102 -57.090 -2.566 -13.745 1.00 0.00 O ATOM 1619 CB ASP A 102 -55.048 -3.597 -15.823 1.00 0.00 C ATOM 1620 CG ASP A 102 -56.338 -4.405 -16.057 1.00 0.00 C ATOM 1621 OD1 ASP A 102 -57.162 -3.996 -16.912 1.00 0.00 O ATOM 1622 OD2 ASP A 102 -56.509 -5.479 -15.430 1.00 0.00 O ATOM 0 H ASP A 102 -53.242 -1.994 -15.495 1.00 0.00 H new ATOM 0 HA ASP A 102 -56.071 -1.682 -15.980 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -54.472 -3.565 -16.748 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -54.434 -4.109 -15.082 1.00 0.00 H new ATOM 1627 N GLY A 103 -55.225 -1.618 -12.927 1.00 0.00 N ATOM 1628 CA GLY A 103 -55.664 -1.454 -11.532 1.00 0.00 C ATOM 1629 C GLY A 103 -55.062 -2.449 -10.525 1.00 0.00 C ATOM 1630 O GLY A 103 -55.375 -2.370 -9.334 1.00 0.00 O ATOM 0 H GLY A 103 -54.271 -1.289 -13.072 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -55.417 -0.443 -11.209 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -56.750 -1.543 -11.499 1.00 0.00 H new ATOM 1634 N SER A 104 -54.203 -3.376 -10.962 1.00 0.00 N ATOM 1635 CA SER A 104 -53.601 -4.408 -10.095 1.00 0.00 C ATOM 1636 C SER A 104 -52.441 -3.842 -9.267 1.00 0.00 C ATOM 1637 O SER A 104 -51.506 -3.277 -9.833 1.00 0.00 O ATOM 1638 CB SER A 104 -53.108 -5.602 -10.923 1.00 0.00 C ATOM 1639 OG SER A 104 -54.175 -6.160 -11.676 1.00 0.00 O ATOM 0 H SER A 104 -53.900 -3.436 -11.934 1.00 0.00 H new ATOM 0 HA SER A 104 -54.381 -4.745 -9.412 1.00 0.00 H new ATOM 0 HB2 SER A 104 -52.310 -5.282 -11.593 1.00 0.00 H new ATOM 0 HB3 SER A 104 -52.685 -6.360 -10.263 1.00 0.00 H new ATOM 0 HG SER A 104 -53.844 -6.919 -12.200 1.00 0.00 H new ATOM 1645 N CYS A 105 -52.468 -4.007 -7.940 1.00 0.00 N ATOM 1646 CA CYS A 105 -51.467 -3.451 -7.016 1.00 0.00 C ATOM 1647 C CYS A 105 -50.663 -4.560 -6.315 1.00 0.00 C ATOM 1648 O CYS A 105 -51.246 -5.522 -5.810 1.00 0.00 O ATOM 1649 CB CYS A 105 -52.164 -2.537 -5.996 1.00 0.00 C ATOM 1650 SG CYS A 105 -53.067 -1.196 -6.824 1.00 0.00 S ATOM 0 H CYS A 105 -53.198 -4.540 -7.467 1.00 0.00 H new ATOM 0 HA CYS A 105 -50.752 -2.862 -7.590 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -52.854 -3.124 -5.390 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -51.424 -2.115 -5.317 1.00 0.00 H new ATOM 0 HG CYS A 105 -53.888 -1.700 -7.697 1.00 0.00 H new ATOM 1656 N PHE A 106 -49.334 -4.423 -6.242 1.00 0.00 N ATOM 1657 CA PHE A 106 -48.421 -5.486 -5.792 1.00 0.00 C ATOM 1658 C PHE A 106 -47.151 -4.940 -5.112 1.00 0.00 C ATOM 1659 O PHE A 106 -46.561 -3.962 -5.571 1.00 0.00 O ATOM 1660 CB PHE A 106 -48.063 -6.379 -6.998 1.00 0.00 C ATOM 1661 CG PHE A 106 -47.475 -5.647 -8.199 1.00 0.00 C ATOM 1662 CD1 PHE A 106 -48.324 -5.051 -9.154 1.00 0.00 C ATOM 1663 CD2 PHE A 106 -46.079 -5.545 -8.353 1.00 0.00 C ATOM 1664 CE1 PHE A 106 -47.783 -4.329 -10.234 1.00 0.00 C ATOM 1665 CE2 PHE A 106 -45.538 -4.835 -9.441 1.00 0.00 C ATOM 1666 CZ PHE A 106 -46.390 -4.218 -10.373 1.00 0.00 C ATOM 0 H PHE A 106 -48.854 -3.560 -6.497 1.00 0.00 H new ATOM 0 HA PHE A 106 -48.935 -6.073 -5.031 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -47.350 -7.136 -6.670 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -48.962 -6.906 -7.319 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -49.395 -5.149 -9.056 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -45.422 -6.013 -7.635 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -48.438 -3.861 -10.954 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -44.467 -4.764 -9.560 1.00 0.00 H new ATOM 0 HZ PHE A 106 -45.973 -3.658 -11.197 1.00 0.00 H new ATOM 1676 N LEU A 107 -46.712 -5.599 -4.031 1.00 0.00 N ATOM 1677 CA LEU A 107 -45.488 -5.314 -3.272 1.00 0.00 C ATOM 1678 C LEU A 107 -44.516 -6.497 -3.375 1.00 0.00 C ATOM 1679 O LEU A 107 -44.909 -7.656 -3.227 1.00 0.00 O ATOM 1680 CB LEU A 107 -45.891 -5.007 -1.809 1.00 0.00 C ATOM 1681 CG LEU A 107 -44.820 -4.593 -0.771 1.00 0.00 C ATOM 1682 CD1 LEU A 107 -43.738 -5.628 -0.468 1.00 0.00 C ATOM 1683 CD2 LEU A 107 -44.081 -3.316 -1.117 1.00 0.00 C ATOM 0 H LEU A 107 -47.229 -6.387 -3.642 1.00 0.00 H new ATOM 0 HA LEU A 107 -44.967 -4.447 -3.680 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -46.634 -4.210 -1.840 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -46.391 -5.894 -1.420 1.00 0.00 H new ATOM 0 HG LEU A 107 -45.452 -4.465 0.108 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -43.046 -5.225 0.272 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -44.201 -6.534 -0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -43.194 -5.864 -1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -43.349 -3.097 -0.339 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -43.570 -3.439 -2.072 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -44.792 -2.493 -1.189 1.00 0.00 H new ATOM 1695 N CYS A 108 -43.241 -6.186 -3.592 1.00 0.00 N ATOM 1696 CA CYS A 108 -42.105 -7.105 -3.483 1.00 0.00 C ATOM 1697 C CYS A 108 -40.917 -6.393 -2.815 1.00 0.00 C ATOM 1698 O CYS A 108 -40.919 -5.165 -2.671 1.00 0.00 O ATOM 1699 CB CYS A 108 -41.758 -7.626 -4.881 1.00 0.00 C ATOM 1700 SG CYS A 108 -42.698 -9.148 -5.185 1.00 0.00 S ATOM 0 H CYS A 108 -42.956 -5.244 -3.861 1.00 0.00 H new ATOM 0 HA CYS A 108 -42.360 -7.958 -2.854 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -41.999 -6.876 -5.634 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -40.688 -7.821 -4.957 1.00 0.00 H new ATOM 0 HG CYS A 108 -43.823 -9.101 -4.534 1.00 0.00 H new ATOM 1706 N LEU A 109 -39.873 -7.138 -2.443 1.00 0.00 N ATOM 1707 CA LEU A 109 -38.615 -6.578 -1.936 1.00 0.00 C ATOM 1708 C LEU A 109 -37.771 -6.062 -3.122 1.00 0.00 C ATOM 1709 O LEU A 109 -36.676 -6.549 -3.400 1.00 0.00 O ATOM 1710 CB LEU A 109 -37.919 -7.614 -1.024 1.00 0.00 C ATOM 1711 CG LEU A 109 -37.073 -6.995 0.108 1.00 0.00 C ATOM 1712 CD1 LEU A 109 -36.440 -8.113 0.937 1.00 0.00 C ATOM 1713 CD2 LEU A 109 -35.951 -6.065 -0.361 1.00 0.00 C ATOM 0 H LEU A 109 -39.876 -8.157 -2.485 1.00 0.00 H new ATOM 0 HA LEU A 109 -38.784 -5.708 -1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -38.678 -8.260 -0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -37.277 -8.247 -1.637 1.00 0.00 H new ATOM 0 HG LEU A 109 -37.768 -6.386 0.686 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -35.842 -7.678 1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -37.224 -8.736 1.367 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -35.802 -8.723 0.298 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -35.413 -5.679 0.505 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -35.262 -6.619 -0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -36.378 -5.234 -0.923 1.00 0.00 H new ATOM 1725 N VAL A 110 -38.343 -5.103 -3.862 1.00 0.00 N ATOM 1726 CA VAL A 110 -37.803 -4.535 -5.109 1.00 0.00 C ATOM 1727 C VAL A 110 -36.362 -4.050 -4.903 1.00 0.00 C ATOM 1728 O VAL A 110 -36.010 -3.583 -3.815 1.00 0.00 O ATOM 1729 CB VAL A 110 -38.699 -3.386 -5.609 1.00 0.00 C ATOM 1730 CG1 VAL A 110 -38.220 -2.735 -6.911 1.00 0.00 C ATOM 1731 CG2 VAL A 110 -40.137 -3.857 -5.882 1.00 0.00 C ATOM 0 H VAL A 110 -39.234 -4.682 -3.598 1.00 0.00 H new ATOM 0 HA VAL A 110 -37.792 -5.317 -5.868 1.00 0.00 H new ATOM 0 HB VAL A 110 -38.652 -2.661 -4.797 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -38.906 -1.937 -7.193 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -37.222 -2.321 -6.765 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -38.190 -3.484 -7.703 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -40.735 -3.016 -6.233 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -40.126 -4.637 -6.643 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -40.571 -4.253 -4.964 1.00 0.00 H new ATOM 1741 N ASP A 111 -35.519 -4.095 -5.938 1.00 0.00 N ATOM 1742 CA ASP A 111 -34.074 -3.883 -5.741 1.00 0.00 C ATOM 1743 C ASP A 111 -33.677 -2.443 -6.112 1.00 0.00 C ATOM 1744 O ASP A 111 -32.962 -2.168 -7.078 1.00 0.00 O ATOM 1745 CB ASP A 111 -33.297 -4.982 -6.487 1.00 0.00 C ATOM 1746 CG ASP A 111 -31.950 -5.292 -5.823 1.00 0.00 C ATOM 1747 OD1 ASP A 111 -30.948 -4.593 -6.087 1.00 0.00 O ATOM 1748 OD2 ASP A 111 -31.893 -6.231 -4.995 1.00 0.00 O ATOM 0 H ASP A 111 -35.799 -4.272 -6.903 1.00 0.00 H new ATOM 0 HA ASP A 111 -33.807 -3.978 -4.688 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -33.900 -5.890 -6.523 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -33.129 -4.670 -7.518 1.00 0.00 H new ATOM 1753 N VAL A 112 -34.126 -1.500 -5.274 1.00 0.00 N ATOM 1754 CA VAL A 112 -34.055 -0.054 -5.527 1.00 0.00 C ATOM 1755 C VAL A 112 -32.677 0.485 -5.137 1.00 0.00 C ATOM 1756 O VAL A 112 -32.529 1.213 -4.157 1.00 0.00 O ATOM 1757 CB VAL A 112 -35.208 0.654 -4.780 1.00 0.00 C ATOM 1758 CG1 VAL A 112 -35.389 2.115 -5.209 1.00 0.00 C ATOM 1759 CG2 VAL A 112 -36.543 -0.043 -5.057 1.00 0.00 C ATOM 0 H VAL A 112 -34.560 -1.726 -4.379 1.00 0.00 H new ATOM 0 HA VAL A 112 -34.179 0.149 -6.591 1.00 0.00 H new ATOM 0 HB VAL A 112 -34.936 0.610 -3.726 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -36.213 2.559 -4.650 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -34.473 2.670 -5.007 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -35.610 2.156 -6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -37.340 0.472 -4.521 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -36.751 -0.020 -6.127 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -36.490 -1.078 -4.720 1.00 0.00 H new ATOM 1769 N VAL A 113 -31.651 0.121 -5.908 1.00 0.00 N ATOM 1770 CA VAL A 113 -30.247 0.504 -5.652 1.00 0.00 C ATOM 1771 C VAL A 113 -29.693 1.357 -6.814 1.00 0.00 C ATOM 1772 O VAL A 113 -29.903 0.979 -7.970 1.00 0.00 O ATOM 1773 CB VAL A 113 -29.388 -0.740 -5.342 1.00 0.00 C ATOM 1774 CG1 VAL A 113 -29.154 -1.668 -6.538 1.00 0.00 C ATOM 1775 CG2 VAL A 113 -28.031 -0.350 -4.748 1.00 0.00 C ATOM 0 H VAL A 113 -31.765 -0.456 -6.741 1.00 0.00 H new ATOM 0 HA VAL A 113 -30.204 1.133 -4.763 1.00 0.00 H new ATOM 0 HB VAL A 113 -29.978 -1.297 -4.615 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -28.541 -2.514 -6.227 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -30.112 -2.031 -6.910 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -28.642 -1.120 -7.329 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -27.452 -1.250 -4.542 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -27.489 0.275 -5.458 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -28.185 0.203 -3.821 1.00 0.00 H new ATOM 1785 N PRO A 114 -29.042 2.518 -6.569 1.00 0.00 N ATOM 1786 CA PRO A 114 -28.597 3.431 -7.635 1.00 0.00 C ATOM 1787 C PRO A 114 -27.213 3.015 -8.198 1.00 0.00 C ATOM 1788 O PRO A 114 -26.716 1.932 -7.872 1.00 0.00 O ATOM 1789 CB PRO A 114 -28.579 4.800 -6.963 1.00 0.00 C ATOM 1790 CG PRO A 114 -28.147 4.480 -5.535 1.00 0.00 C ATOM 1791 CD PRO A 114 -28.828 3.138 -5.264 1.00 0.00 C ATOM 0 HA PRO A 114 -29.251 3.421 -8.507 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -27.881 5.480 -7.452 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -29.560 5.275 -6.990 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -27.063 4.408 -5.448 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -28.473 5.247 -4.833 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -28.205 2.506 -4.631 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -29.774 3.280 -4.741 1.00 0.00 H new ATOM 1799 N VAL A 115 -26.551 3.861 -9.012 1.00 0.00 N ATOM 1800 CA VAL A 115 -25.202 3.587 -9.561 1.00 0.00 C ATOM 1801 C VAL A 115 -24.176 4.702 -9.268 1.00 0.00 C ATOM 1802 O VAL A 115 -24.391 5.900 -9.511 1.00 0.00 O ATOM 1803 CB VAL A 115 -25.230 3.218 -11.060 1.00 0.00 C ATOM 1804 CG1 VAL A 115 -25.860 1.839 -11.284 1.00 0.00 C ATOM 1805 CG2 VAL A 115 -25.935 4.247 -11.930 1.00 0.00 C ATOM 0 H VAL A 115 -26.936 4.757 -9.310 1.00 0.00 H new ATOM 0 HA VAL A 115 -24.855 2.707 -9.020 1.00 0.00 H new ATOM 0 HB VAL A 115 -24.185 3.199 -11.368 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -25.864 1.610 -12.350 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -25.281 1.084 -10.753 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -26.884 1.841 -10.909 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -25.915 3.920 -12.969 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -26.969 4.353 -11.603 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -25.427 5.207 -11.842 1.00 0.00 H new ATOM 1815 N LYS A 116 -23.024 4.263 -8.739 1.00 0.00 N ATOM 1816 CA LYS A 116 -21.883 5.068 -8.276 1.00 0.00 C ATOM 1817 C LYS A 116 -20.640 4.891 -9.147 1.00 0.00 C ATOM 1818 O LYS A 116 -20.505 3.913 -9.886 1.00 0.00 O ATOM 1819 CB LYS A 116 -21.543 4.747 -6.801 1.00 0.00 C ATOM 1820 CG LYS A 116 -22.680 5.018 -5.806 1.00 0.00 C ATOM 1821 CD LYS A 116 -22.716 3.998 -4.655 1.00 0.00 C ATOM 1822 CE LYS A 116 -23.636 4.489 -3.530 1.00 0.00 C ATOM 1823 NZ LYS A 116 -22.946 5.454 -2.633 1.00 0.00 N ATOM 0 H LYS A 116 -22.853 3.265 -8.615 1.00 0.00 H new ATOM 0 HA LYS A 116 -22.191 6.110 -8.358 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -21.258 3.697 -6.728 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.673 5.335 -6.507 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -22.566 6.021 -5.394 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -23.633 4.997 -6.335 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -23.067 3.035 -5.026 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -21.709 3.842 -4.268 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -24.518 4.961 -3.962 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -23.984 3.636 -2.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -22.783 5.011 -1.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -22.034 5.726 -3.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -23.538 6.301 -2.513 1.00 0.00 H new ATOM 1837 N ASN A 117 -19.724 5.845 -9.011 1.00 0.00 N ATOM 1838 CA ASN A 117 -18.380 5.801 -9.608 1.00 0.00 C ATOM 1839 C ASN A 117 -17.332 5.200 -8.644 1.00 0.00 C ATOM 1840 O ASN A 117 -17.652 4.853 -7.506 1.00 0.00 O ATOM 1841 CB ASN A 117 -18.004 7.197 -10.139 1.00 0.00 C ATOM 1842 CG ASN A 117 -17.438 8.127 -9.078 1.00 0.00 C ATOM 1843 OD1 ASN A 117 -16.236 8.281 -8.953 1.00 0.00 O ATOM 1844 ND2 ASN A 117 -18.254 8.743 -8.255 1.00 0.00 N ATOM 0 H ASN A 117 -19.893 6.693 -8.471 1.00 0.00 H new ATOM 0 HA ASN A 117 -18.391 5.120 -10.459 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -17.272 7.086 -10.939 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -18.888 7.658 -10.578 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -17.880 9.343 -7.520 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -19.262 8.621 -8.350 1.00 0.00 H new ATOM 1851 N GLU A 118 -16.070 5.106 -9.074 1.00 0.00 N ATOM 1852 CA GLU A 118 -14.963 4.526 -8.288 1.00 0.00 C ATOM 1853 C GLU A 118 -14.636 5.270 -6.972 1.00 0.00 C ATOM 1854 O GLU A 118 -14.089 4.669 -6.045 1.00 0.00 O ATOM 1855 CB GLU A 118 -13.713 4.388 -9.177 1.00 0.00 C ATOM 1856 CG GLU A 118 -13.127 5.726 -9.655 1.00 0.00 C ATOM 1857 CD GLU A 118 -11.899 5.495 -10.558 1.00 0.00 C ATOM 1858 OE1 GLU A 118 -10.759 5.425 -10.037 1.00 0.00 O ATOM 1859 OE2 GLU A 118 -12.063 5.386 -11.799 1.00 0.00 O ATOM 0 H GLU A 118 -15.778 5.435 -9.994 1.00 0.00 H new ATOM 0 HA GLU A 118 -15.305 3.543 -7.964 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -12.946 3.846 -8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.966 3.783 -10.048 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.886 6.286 -10.202 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -12.842 6.332 -8.795 1.00 0.00 H new ATOM 1866 N ASP A 119 -15.013 6.548 -6.847 1.00 0.00 N ATOM 1867 CA ASP A 119 -14.962 7.315 -5.591 1.00 0.00 C ATOM 1868 C ASP A 119 -16.014 6.872 -4.548 1.00 0.00 C ATOM 1869 O ASP A 119 -15.880 7.170 -3.359 1.00 0.00 O ATOM 1870 CB ASP A 119 -15.099 8.812 -5.907 1.00 0.00 C ATOM 1871 CG ASP A 119 -14.579 9.701 -4.762 1.00 0.00 C ATOM 1872 OD1 ASP A 119 -13.365 9.642 -4.446 1.00 0.00 O ATOM 1873 OD2 ASP A 119 -15.375 10.491 -4.199 1.00 0.00 O ATOM 0 H ASP A 119 -15.370 7.092 -7.632 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.995 7.114 -5.129 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -14.549 9.040 -6.820 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -16.146 9.046 -6.099 1.00 0.00 H new ATOM 1878 N GLY A 120 -17.076 6.185 -4.991 1.00 0.00 N ATOM 1879 CA GLY A 120 -18.212 5.733 -4.178 1.00 0.00 C ATOM 1880 C GLY A 120 -19.438 6.651 -4.239 1.00 0.00 C ATOM 1881 O GLY A 120 -20.456 6.351 -3.614 1.00 0.00 O ATOM 0 H GLY A 120 -17.170 5.917 -5.971 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -18.504 4.735 -4.506 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -17.889 5.646 -3.141 1.00 0.00 H new ATOM 1885 N ALA A 121 -19.378 7.750 -4.999 1.00 0.00 N ATOM 1886 CA ALA A 121 -20.468 8.719 -5.125 1.00 0.00 C ATOM 1887 C ALA A 121 -21.442 8.389 -6.260 1.00 0.00 C ATOM 1888 O ALA A 121 -21.025 7.964 -7.342 1.00 0.00 O ATOM 1889 CB ALA A 121 -19.879 10.128 -5.256 1.00 0.00 C ATOM 0 H ALA A 121 -18.556 7.993 -5.552 1.00 0.00 H new ATOM 0 HA ALA A 121 -21.071 8.668 -4.219 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -20.687 10.853 -5.350 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -19.286 10.358 -4.371 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -19.244 10.176 -6.140 1.00 0.00 H new ATOM 1895 N VAL A 122 -22.740 8.593 -5.999 1.00 0.00 N ATOM 1896 CA VAL A 122 -23.854 8.257 -6.896 1.00 0.00 C ATOM 1897 C VAL A 122 -23.946 9.278 -8.029 1.00 0.00 C ATOM 1898 O VAL A 122 -24.424 10.402 -7.855 1.00 0.00 O ATOM 1899 CB VAL A 122 -25.161 8.042 -6.098 1.00 0.00 C ATOM 1900 CG1 VAL A 122 -25.650 9.242 -5.278 1.00 0.00 C ATOM 1901 CG2 VAL A 122 -26.307 7.533 -6.972 1.00 0.00 C ATOM 0 H VAL A 122 -23.055 9.012 -5.124 1.00 0.00 H new ATOM 0 HA VAL A 122 -23.668 7.299 -7.382 1.00 0.00 H new ATOM 0 HB VAL A 122 -24.870 7.276 -5.379 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -26.572 8.978 -4.761 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -24.890 9.517 -4.547 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -25.836 10.086 -5.943 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -27.199 7.400 -6.361 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -26.512 8.257 -7.761 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -26.028 6.579 -7.419 1.00 0.00 H new ATOM 1911 N ILE A 123 -23.416 8.901 -9.193 1.00 0.00 N ATOM 1912 CA ILE A 123 -23.409 9.752 -10.390 1.00 0.00 C ATOM 1913 C ILE A 123 -24.669 9.552 -11.231 1.00 0.00 C ATOM 1914 O ILE A 123 -25.134 10.512 -11.845 1.00 0.00 O ATOM 1915 CB ILE A 123 -22.096 9.644 -11.201 1.00 0.00 C ATOM 1916 CG1 ILE A 123 -22.021 8.525 -12.264 1.00 0.00 C ATOM 1917 CG2 ILE A 123 -20.871 9.622 -10.273 1.00 0.00 C ATOM 1918 CD1 ILE A 123 -22.179 7.077 -11.788 1.00 0.00 C ATOM 0 H ILE A 123 -22.976 7.992 -9.336 1.00 0.00 H new ATOM 0 HA ILE A 123 -23.435 10.786 -10.046 1.00 0.00 H new ATOM 0 HB ILE A 123 -22.092 10.554 -11.800 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -22.792 8.719 -13.010 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -21.060 8.608 -12.771 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -19.963 9.546 -10.871 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -20.843 10.540 -9.686 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -20.937 8.765 -9.603 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -22.104 6.403 -12.642 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -21.393 6.842 -11.070 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -23.152 6.954 -11.313 1.00 0.00 H new ATOM 1930 N MET A 124 -25.274 8.356 -11.192 1.00 0.00 N ATOM 1931 CA MET A 124 -26.554 8.096 -11.852 1.00 0.00 C ATOM 1932 C MET A 124 -27.515 7.326 -10.949 1.00 0.00 C ATOM 1933 O MET A 124 -27.157 6.526 -10.088 1.00 0.00 O ATOM 1934 CB MET A 124 -26.388 7.414 -13.229 1.00 0.00 C ATOM 1935 CG MET A 124 -26.321 8.397 -14.405 1.00 0.00 C ATOM 1936 SD MET A 124 -24.659 8.654 -15.084 1.00 0.00 S ATOM 1937 CE MET A 124 -24.659 10.460 -15.196 1.00 0.00 C ATOM 0 H MET A 124 -24.889 7.548 -10.704 1.00 0.00 H new ATOM 0 HA MET A 124 -27.002 9.071 -12.044 1.00 0.00 H new ATOM 0 HB2 MET A 124 -25.479 6.813 -13.219 1.00 0.00 H new ATOM 0 HB3 MET A 124 -27.221 6.729 -13.387 1.00 0.00 H new ATOM 0 HG2 MET A 124 -26.972 8.035 -15.201 1.00 0.00 H new ATOM 0 HG3 MET A 124 -26.719 9.358 -14.080 1.00 0.00 H new ATOM 0 HE1 MET A 124 -23.955 10.777 -15.965 1.00 0.00 H new ATOM 0 HE2 MET A 124 -25.659 10.809 -15.454 1.00 0.00 H new ATOM 0 HE3 MET A 124 -24.363 10.884 -14.236 1.00 0.00 H new ATOM 1947 N PHE A 125 -28.788 7.590 -11.176 1.00 0.00 N ATOM 1948 CA PHE A 125 -29.907 6.998 -10.465 1.00 0.00 C ATOM 1949 C PHE A 125 -30.544 5.943 -11.384 1.00 0.00 C ATOM 1950 O PHE A 125 -31.555 6.168 -12.036 1.00 0.00 O ATOM 1951 CB PHE A 125 -30.851 8.129 -9.994 1.00 0.00 C ATOM 1952 CG PHE A 125 -30.643 8.776 -8.632 1.00 0.00 C ATOM 1953 CD1 PHE A 125 -29.629 8.382 -7.734 1.00 0.00 C ATOM 1954 CD2 PHE A 125 -31.513 9.822 -8.267 1.00 0.00 C ATOM 1955 CE1 PHE A 125 -29.470 9.052 -6.508 1.00 0.00 C ATOM 1956 CE2 PHE A 125 -31.338 10.501 -7.049 1.00 0.00 C ATOM 1957 CZ PHE A 125 -30.307 10.125 -6.177 1.00 0.00 C ATOM 0 H PHE A 125 -29.084 8.252 -11.893 1.00 0.00 H new ATOM 0 HA PHE A 125 -29.612 6.473 -9.557 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -30.804 8.922 -10.740 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -31.866 7.733 -10.013 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -28.973 7.563 -7.989 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -32.320 10.104 -8.927 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -28.700 8.738 -5.819 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -31.999 11.313 -6.785 1.00 0.00 H new ATOM 0 HZ PHE A 125 -30.158 10.662 -5.252 1.00 0.00 H new ATOM 1967 N ILE A 126 -29.946 4.752 -11.447 1.00 0.00 N ATOM 1968 CA ILE A 126 -30.540 3.600 -12.148 1.00 0.00 C ATOM 1969 C ILE A 126 -31.195 2.684 -11.120 1.00 0.00 C ATOM 1970 O ILE A 126 -30.708 1.600 -10.799 1.00 0.00 O ATOM 1971 CB ILE A 126 -29.537 2.896 -13.070 1.00 0.00 C ATOM 1972 CG1 ILE A 126 -28.923 3.947 -14.016 1.00 0.00 C ATOM 1973 CG2 ILE A 126 -30.222 1.771 -13.879 1.00 0.00 C ATOM 1974 CD1 ILE A 126 -27.958 3.336 -15.015 1.00 0.00 C ATOM 0 H ILE A 126 -29.042 4.554 -11.018 1.00 0.00 H new ATOM 0 HA ILE A 126 -31.318 3.945 -12.829 1.00 0.00 H new ATOM 0 HB ILE A 126 -28.754 2.433 -12.470 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -29.722 4.458 -14.553 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -28.402 4.701 -13.427 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -29.488 1.288 -14.524 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -30.643 1.035 -13.194 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -31.019 2.195 -14.490 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -27.554 4.119 -15.657 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -27.142 2.848 -14.481 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -28.483 2.601 -15.626 1.00 0.00 H new ATOM 1986 N LEU A 127 -32.307 3.164 -10.570 1.00 0.00 N ATOM 1987 CA LEU A 127 -33.098 2.450 -9.580 1.00 0.00 C ATOM 1988 C LEU A 127 -33.920 1.370 -10.288 1.00 0.00 C ATOM 1989 O LEU A 127 -35.060 1.554 -10.708 1.00 0.00 O ATOM 1990 CB LEU A 127 -33.881 3.429 -8.686 1.00 0.00 C ATOM 1991 CG LEU A 127 -33.014 4.425 -7.884 1.00 0.00 C ATOM 1992 CD1 LEU A 127 -31.992 3.765 -7.006 1.00 0.00 C ATOM 1993 CD2 LEU A 127 -32.299 5.491 -8.682 1.00 0.00 C ATOM 0 H LEU A 127 -32.689 4.080 -10.807 1.00 0.00 H new ATOM 0 HA LEU A 127 -32.465 1.918 -8.870 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -34.571 3.995 -9.312 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -34.485 2.852 -7.986 1.00 0.00 H new ATOM 0 HG LEU A 127 -33.782 4.916 -7.286 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -31.422 4.527 -6.475 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -32.494 3.119 -6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -31.317 3.168 -7.619 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -31.725 6.127 -8.008 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -31.625 5.019 -9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -33.030 6.097 -9.217 1.00 0.00 H new ATOM 2005 N ASN A 128 -33.247 0.238 -10.463 1.00 0.00 N ATOM 2006 CA ASN A 128 -33.748 -0.981 -11.110 1.00 0.00 C ATOM 2007 C ASN A 128 -34.981 -1.510 -10.351 1.00 0.00 C ATOM 2008 O ASN A 128 -34.847 -2.127 -9.293 1.00 0.00 O ATOM 2009 CB ASN A 128 -32.644 -2.060 -11.100 1.00 0.00 C ATOM 2010 CG ASN A 128 -31.574 -1.927 -12.170 1.00 0.00 C ATOM 2011 OD1 ASN A 128 -31.559 -2.656 -13.151 1.00 0.00 O ATOM 2012 ND2 ASN A 128 -30.622 -1.034 -12.028 1.00 0.00 N ATOM 0 H ASN A 128 -32.284 0.135 -10.142 1.00 0.00 H new ATOM 0 HA ASN A 128 -34.029 -0.749 -12.137 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -32.158 -2.045 -10.124 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -33.117 -3.036 -11.206 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -29.886 -0.957 -12.730 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -30.618 -0.417 -11.216 1.00 0.00 H new ATOM 2019 N PHE A 129 -36.194 -1.313 -10.877 1.00 0.00 N ATOM 2020 CA PHE A 129 -37.408 -1.746 -10.194 1.00 0.00 C ATOM 2021 C PHE A 129 -37.744 -3.208 -10.504 1.00 0.00 C ATOM 2022 O PHE A 129 -38.810 -3.540 -11.026 1.00 0.00 O ATOM 2023 CB PHE A 129 -38.567 -0.792 -10.468 1.00 0.00 C ATOM 2024 CG PHE A 129 -38.336 0.685 -10.193 1.00 0.00 C ATOM 2025 CD1 PHE A 129 -37.826 1.116 -8.953 1.00 0.00 C ATOM 2026 CD2 PHE A 129 -38.710 1.641 -11.159 1.00 0.00 C ATOM 2027 CE1 PHE A 129 -37.676 2.490 -8.689 1.00 0.00 C ATOM 2028 CE2 PHE A 129 -38.571 3.015 -10.890 1.00 0.00 C ATOM 2029 CZ PHE A 129 -38.045 3.440 -9.657 1.00 0.00 C ATOM 0 H PHE A 129 -36.357 -0.856 -11.774 1.00 0.00 H new ATOM 0 HA PHE A 129 -37.223 -1.705 -9.121 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -38.852 -0.899 -11.515 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -39.419 -1.117 -9.871 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -37.549 0.390 -8.203 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -39.105 1.317 -12.110 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -37.276 2.816 -7.740 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -38.868 3.743 -11.630 1.00 0.00 H new ATOM 0 HZ PHE A 129 -37.925 4.494 -9.454 1.00 0.00 H new ATOM 2039 N GLU A 130 -36.817 -4.103 -10.176 1.00 0.00 N ATOM 2040 CA GLU A 130 -37.027 -5.542 -10.329 1.00 0.00 C ATOM 2041 C GLU A 130 -37.860 -6.098 -9.173 1.00 0.00 C ATOM 2042 O GLU A 130 -37.549 -5.921 -8.000 1.00 0.00 O ATOM 2043 CB GLU A 130 -35.711 -6.303 -10.479 1.00 0.00 C ATOM 2044 CG GLU A 130 -34.678 -5.929 -9.413 1.00 0.00 C ATOM 2045 CD GLU A 130 -33.466 -6.876 -9.434 1.00 0.00 C ATOM 2046 OE1 GLU A 130 -33.577 -8.032 -8.963 1.00 0.00 O ATOM 2047 OE2 GLU A 130 -32.398 -6.467 -9.950 1.00 0.00 O ATOM 0 H GLU A 130 -35.903 -3.855 -9.798 1.00 0.00 H new ATOM 0 HA GLU A 130 -37.585 -5.690 -11.253 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -35.909 -7.374 -10.425 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -35.294 -6.105 -11.466 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -34.342 -4.905 -9.576 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -35.145 -5.958 -8.429 1.00 0.00 H new ATOM 2054 N VAL A 131 -38.934 -6.786 -9.520 1.00 0.00 N ATOM 2055 CA VAL A 131 -39.898 -7.380 -8.585 1.00 0.00 C ATOM 2056 C VAL A 131 -39.338 -8.717 -8.099 1.00 0.00 C ATOM 2057 O VAL A 131 -39.167 -9.638 -8.902 1.00 0.00 O ATOM 2058 CB VAL A 131 -41.238 -7.542 -9.316 1.00 0.00 C ATOM 2059 CG1 VAL A 131 -42.285 -8.346 -8.553 1.00 0.00 C ATOM 2060 CG2 VAL A 131 -41.855 -6.172 -9.635 1.00 0.00 C ATOM 0 H VAL A 131 -39.176 -6.958 -10.496 1.00 0.00 H new ATOM 0 HA VAL A 131 -40.062 -6.748 -7.712 1.00 0.00 H new ATOM 0 HB VAL A 131 -40.985 -8.095 -10.220 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -43.198 -8.409 -9.145 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -41.906 -9.350 -8.364 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -42.501 -7.855 -7.604 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -42.804 -6.312 -10.153 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -42.025 -5.625 -8.708 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -41.175 -5.606 -10.271 1.00 0.00 H new ATOM 2070 N VAL A 132 -38.998 -8.818 -6.808 1.00 0.00 N ATOM 2071 CA VAL A 132 -38.384 -10.034 -6.245 1.00 0.00 C ATOM 2072 C VAL A 132 -38.928 -10.361 -4.849 1.00 0.00 C ATOM 2073 O VAL A 132 -39.084 -9.478 -4.004 1.00 0.00 O ATOM 2074 CB VAL A 132 -36.841 -9.966 -6.327 1.00 0.00 C ATOM 2075 CG1 VAL A 132 -36.224 -8.790 -5.568 1.00 0.00 C ATOM 2076 CG2 VAL A 132 -36.180 -11.267 -5.855 1.00 0.00 C ATOM 0 H VAL A 132 -39.137 -8.070 -6.128 1.00 0.00 H new ATOM 0 HA VAL A 132 -38.677 -10.884 -6.861 1.00 0.00 H new ATOM 0 HB VAL A 132 -36.639 -9.813 -7.387 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -35.140 -8.816 -5.676 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -36.607 -7.854 -5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -36.485 -8.861 -4.512 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -35.097 -11.173 -5.930 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -36.456 -11.460 -4.818 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -36.517 -12.094 -6.480 1.00 0.00 H new