USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 988 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 128 CYS SG : rot -82:sc= -0.474 USER MOD Set 1.2: A 129 GLN :FLIP amide:sc= -6.4! C(o=-8.5!,f=-6.9!) USER MOD Single : A 11 CYS SG : rot -104:sc= -12.3! USER MOD Single : A 19 CYS SG : rot 180:sc= -2.01! USER MOD Single : A 35 GLN : amide:sc= -0.0571 K(o=-0.057,f=-1.6!) USER MOD Single : A 37 SER OG : rot 180:sc=-0.00338 USER MOD Single : A 42 HIS :FLIP no HD1:sc= -4.39! C(o=-5!,f=-4.4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.953 USER MOD Single : A 47 LYS NZ :NH3+ -112:sc= 0.362 (180deg=-2.79!) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -3.45! C(o=-7.7!,f=-3.5!) USER MOD Single : A 59 THR OG1 : rot -74:sc= -3.41! USER MOD Single : A 64 THR OG1 : rot 71:sc= -3.67! USER MOD Single : A 65 GLN : amide:sc= -0.491 K(o=-0.49,f=-2.1) USER MOD Single : A 74 GLN :FLIP amide:sc= -6.86! C(o=-9.5!,f=-6.9!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN :FLIP amide:sc= -5.71! C(o=-12!,f=-5.7!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 165:sc= -3.61! USER MOD Single : A 104 LYS NZ :NH3+ 174:sc= 1.24 (180deg=1.17) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS :FLIP no HD1:sc= -2.51! C(o=-3.9!,f=-2.5!) USER MOD Single : A 116 HIS : no HD1:sc= -3.42 X(o=-3.4,f=-3.5!) USER MOD Single : A 117 GLN : amide:sc= -0.953 K(o=-0.95,f=-2.4!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.0929 X(o=-0.093,f=-0.12) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -115:sc= -2.07 (180deg=-6.77!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00986 F(o=-1.6!,f=-0.0099) USER MOD Single : A 144 HIS : no HE2:sc= -12.1! C(o=-12!,f=-18!) USER MOD Single : A 145 GLN : amide:sc= -0.0301 X(o=-0.03,f=-0.063) USER MOD Single : A 148 CYS SG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot -29:sc= 0.0657 USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 12.083 -3.556 -7.018 1.00 0.00 N ATOM 106 CA ARG A 9 11.170 -2.470 -7.449 1.00 0.00 C ATOM 107 C ARG A 9 10.176 -3.044 -8.455 1.00 0.00 C ATOM 108 O ARG A 9 10.554 -3.614 -9.458 1.00 0.00 O ATOM 109 CB ARG A 9 11.975 -1.327 -8.084 1.00 0.00 C ATOM 110 CG ARG A 9 12.027 -1.490 -9.606 1.00 0.00 C ATOM 111 CD ARG A 9 12.851 -0.352 -10.211 1.00 0.00 C ATOM 112 NE ARG A 9 14.288 -0.529 -9.861 1.00 0.00 N ATOM 113 CZ ARG A 9 14.795 0.092 -8.828 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.037 0.844 -8.079 1.00 0.00 N ATOM 115 NH2 ARG A 9 16.061 -0.048 -8.545 1.00 0.00 N ATOM 0 HA ARG A 9 10.633 -2.070 -6.589 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.521 -0.369 -7.830 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.987 -1.317 -7.678 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.470 -2.452 -9.865 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.018 -1.482 -10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.730 -0.339 -11.294 1.00 0.00 H new ATOM 0 HD3 ARG A 9 12.492 0.607 -9.838 1.00 0.00 H new ATOM 0 HE ARG A 9 14.878 -1.137 -10.429 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.046 0.949 -8.299 1.00 0.00 H new ATOM 0 HH12 ARG A 9 14.435 1.327 -7.274 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.652 -0.640 -9.129 1.00 0.00 H new ATOM 0 HH22 ARG A 9 16.460 0.435 -7.740 1.00 0.00 H new ATOM 129 N ALA A 10 8.911 -2.908 -8.191 1.00 0.00 N ATOM 130 CA ALA A 10 7.895 -3.454 -9.129 1.00 0.00 C ATOM 131 C ALA A 10 7.189 -2.295 -9.827 1.00 0.00 C ATOM 132 O ALA A 10 7.403 -1.143 -9.506 1.00 0.00 O ATOM 133 CB ALA A 10 6.879 -4.289 -8.348 1.00 0.00 C ATOM 0 H ALA A 10 8.535 -2.442 -7.365 1.00 0.00 H new ATOM 0 HA ALA A 10 8.378 -4.086 -9.874 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.133 -4.690 -9.034 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.391 -5.111 -7.848 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.387 -3.662 -7.604 1.00 0.00 H new ATOM 139 N CYS A 11 6.366 -2.582 -10.793 1.00 0.00 N ATOM 140 CA CYS A 11 5.670 -1.483 -11.511 1.00 0.00 C ATOM 141 C CYS A 11 4.243 -1.915 -11.862 1.00 0.00 C ATOM 142 O CYS A 11 3.983 -3.072 -12.133 1.00 0.00 O ATOM 143 CB CYS A 11 6.452 -1.153 -12.781 1.00 0.00 C ATOM 144 SG CYS A 11 8.042 -2.016 -12.747 1.00 0.00 S ATOM 0 H CYS A 11 6.146 -3.524 -11.115 1.00 0.00 H new ATOM 0 HA CYS A 11 5.616 -0.598 -10.877 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.882 -1.452 -13.661 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.611 -0.077 -12.855 1.00 0.00 H new ATOM 0 HG CYS A 11 8.988 -1.172 -12.457 1.00 0.00 H new ATOM 150 N GLY A 12 3.315 -0.996 -11.851 1.00 0.00 N ATOM 151 CA GLY A 12 1.904 -1.361 -12.175 1.00 0.00 C ATOM 152 C GLY A 12 1.242 -0.257 -12.993 1.00 0.00 C ATOM 153 O GLY A 12 1.818 0.786 -13.237 1.00 0.00 O ATOM 0 H GLY A 12 3.471 -0.012 -11.633 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.883 -2.297 -12.733 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.344 -1.526 -11.254 1.00 0.00 H new ATOM 157 N LEU A 13 0.024 -0.478 -13.410 1.00 0.00 N ATOM 158 CA LEU A 13 -0.701 0.553 -14.204 1.00 0.00 C ATOM 159 C LEU A 13 -1.975 0.974 -13.483 1.00 0.00 C ATOM 160 O LEU A 13 -2.832 0.160 -13.203 1.00 0.00 O ATOM 161 CB LEU A 13 -1.144 -0.020 -15.553 1.00 0.00 C ATOM 162 CG LEU A 13 0.023 -0.196 -16.519 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.554 -0.498 -17.902 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.840 1.091 -16.597 1.00 0.00 C ATOM 0 H LEU A 13 -0.502 -1.334 -13.233 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.021 1.394 -14.337 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.630 -0.983 -15.394 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.886 0.641 -16.000 1.00 0.00 H new ATOM 0 HG LEU A 13 0.668 -1.005 -16.176 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.260 -0.629 -18.615 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.148 -1.411 -17.857 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.186 0.330 -18.221 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.670 0.953 -17.290 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.205 1.904 -16.949 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.229 1.336 -15.609 1.00 0.00 H new ATOM 176 N ILE A 14 -2.157 2.241 -13.251 1.00 0.00 N ATOM 177 CA ILE A 14 -3.435 2.668 -12.637 1.00 0.00 C ATOM 178 C ILE A 14 -4.475 2.540 -13.738 1.00 0.00 C ATOM 179 O ILE A 14 -4.709 3.463 -14.492 1.00 0.00 O ATOM 180 CB ILE A 14 -3.341 4.128 -12.189 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.389 4.243 -11.001 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.726 4.649 -11.801 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.930 3.443 -9.814 1.00 0.00 C ATOM 0 H ILE A 14 -1.490 2.985 -13.456 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.683 2.067 -11.762 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.958 4.729 -13.014 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.402 3.873 -11.279 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.270 5.290 -10.720 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.648 5.689 -11.484 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.394 4.581 -12.660 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.124 4.049 -10.983 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.243 3.532 -8.972 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.907 3.832 -9.528 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.025 2.394 -10.095 1.00 0.00 H new ATOM 195 N ILE A 15 -5.080 1.394 -13.868 1.00 0.00 N ATOM 196 CA ILE A 15 -6.072 1.222 -14.957 1.00 0.00 C ATOM 197 C ILE A 15 -7.416 1.786 -14.537 1.00 0.00 C ATOM 198 O ILE A 15 -7.891 1.567 -13.440 1.00 0.00 O ATOM 199 CB ILE A 15 -6.232 -0.254 -15.314 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.941 -0.763 -15.967 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.407 -0.402 -16.286 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.121 -2.222 -16.386 1.00 0.00 C ATOM 0 H ILE A 15 -4.931 0.579 -13.273 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.710 1.761 -15.832 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.427 -0.839 -14.415 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.695 -0.152 -16.836 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.109 -0.674 -15.269 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.532 -1.452 -16.549 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.318 -0.035 -15.814 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.208 0.177 -17.188 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.203 -2.583 -16.850 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.346 -2.828 -15.508 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.942 -2.297 -17.099 1.00 0.00 H new ATOM 214 N PHE A 16 -8.030 2.504 -15.424 1.00 0.00 N ATOM 215 CA PHE A 16 -9.351 3.096 -15.124 1.00 0.00 C ATOM 216 C PHE A 16 -10.115 3.273 -16.435 1.00 0.00 C ATOM 217 O PHE A 16 -9.530 3.377 -17.494 1.00 0.00 O ATOM 218 CB PHE A 16 -9.163 4.458 -14.462 1.00 0.00 C ATOM 219 CG PHE A 16 -8.642 5.434 -15.481 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.535 6.096 -16.328 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.267 5.673 -15.587 1.00 0.00 C ATOM 222 CE1 PHE A 16 -9.059 7.002 -17.278 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.787 6.580 -16.538 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.685 7.245 -17.386 1.00 0.00 C ATOM 0 H PHE A 16 -7.668 2.708 -16.355 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.906 2.443 -14.450 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.110 4.811 -14.053 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.466 4.377 -13.628 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.595 5.907 -16.248 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.577 5.158 -14.935 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.751 7.515 -17.929 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.727 6.768 -16.619 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.316 7.944 -18.122 1.00 0.00 H new ATOM 234 N ARG A 17 -11.410 3.316 -16.372 1.00 0.00 N ATOM 235 CA ARG A 17 -12.212 3.498 -17.613 1.00 0.00 C ATOM 236 C ARG A 17 -13.184 4.660 -17.419 1.00 0.00 C ATOM 237 O ARG A 17 -13.893 4.732 -16.433 1.00 0.00 O ATOM 238 CB ARG A 17 -13.001 2.220 -17.908 1.00 0.00 C ATOM 239 CG ARG A 17 -13.891 2.440 -19.134 1.00 0.00 C ATOM 240 CD ARG A 17 -14.798 1.228 -19.334 1.00 0.00 C ATOM 241 NE ARG A 17 -15.694 1.079 -18.152 1.00 0.00 N ATOM 242 CZ ARG A 17 -15.429 0.190 -17.231 1.00 0.00 C ATOM 243 NH1 ARG A 17 -14.371 -0.567 -17.338 1.00 0.00 N ATOM 244 NH2 ARG A 17 -16.219 0.064 -16.201 1.00 0.00 N ATOM 0 H ARG A 17 -11.953 3.233 -15.513 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.545 3.712 -18.448 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.317 1.391 -18.087 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.611 1.950 -17.046 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.493 3.339 -19.002 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -13.275 2.596 -20.020 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -15.391 1.349 -20.241 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -14.197 0.328 -19.464 1.00 0.00 H new ATOM 0 HE ARG A 17 -16.518 1.674 -18.061 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -13.750 -0.465 -18.141 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -14.165 -1.260 -16.619 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -17.043 0.659 -16.114 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -16.013 -0.629 -15.482 1.00 0.00 H new ATOM 258 N ARG A 18 -13.229 5.569 -18.354 1.00 0.00 N ATOM 259 CA ARG A 18 -14.159 6.720 -18.224 1.00 0.00 C ATOM 260 C ARG A 18 -15.352 6.529 -19.161 1.00 0.00 C ATOM 261 O ARG A 18 -15.195 6.241 -20.330 1.00 0.00 O ATOM 262 CB ARG A 18 -13.428 8.015 -18.565 1.00 0.00 C ATOM 263 CG ARG A 18 -12.955 7.980 -20.016 1.00 0.00 C ATOM 264 CD ARG A 18 -11.988 9.141 -20.252 1.00 0.00 C ATOM 265 NE ARG A 18 -12.751 10.420 -20.279 1.00 0.00 N ATOM 266 CZ ARG A 18 -13.411 10.761 -21.350 1.00 0.00 C ATOM 267 NH1 ARG A 18 -13.408 9.979 -22.394 1.00 0.00 N ATOM 268 NH2 ARG A 18 -14.076 11.882 -21.377 1.00 0.00 N ATOM 0 H ARG A 18 -12.661 5.562 -19.201 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.520 6.777 -17.197 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.089 8.867 -18.410 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.575 8.147 -17.899 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.463 7.031 -20.229 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.807 8.056 -20.692 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.236 9.169 -19.463 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.457 9.001 -21.193 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.757 11.028 -19.460 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.889 9.101 -22.372 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.924 10.245 -23.232 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.080 12.492 -20.560 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -14.592 12.149 -22.215 1.00 0.00 H new ATOM 282 N CYS A 19 -16.545 6.689 -18.655 1.00 0.00 N ATOM 283 CA CYS A 19 -17.746 6.517 -19.517 1.00 0.00 C ATOM 284 C CYS A 19 -18.184 7.870 -20.064 1.00 0.00 C ATOM 285 O CYS A 19 -17.568 8.887 -19.819 1.00 0.00 O ATOM 286 CB CYS A 19 -18.895 5.907 -18.713 1.00 0.00 C ATOM 287 SG CYS A 19 -19.931 7.230 -18.043 1.00 0.00 S ATOM 0 H CYS A 19 -16.738 6.931 -17.683 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.490 5.850 -20.340 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.490 5.251 -19.349 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -18.501 5.294 -17.903 1.00 0.00 H new ATOM 0 HG CYS A 19 -20.909 6.712 -17.361 1.00 0.00 H new ATOM 424 N ALA A 28 -18.281 8.456 -14.185 1.00 0.00 N ATOM 425 CA ALA A 28 -17.822 7.978 -15.513 1.00 0.00 C ATOM 426 C ALA A 28 -16.467 7.286 -15.371 1.00 0.00 C ATOM 427 O ALA A 28 -16.146 6.381 -16.112 1.00 0.00 O ATOM 428 CB ALA A 28 -17.692 9.167 -16.465 1.00 0.00 C ATOM 0 HA ALA A 28 -18.548 7.269 -15.913 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.355 8.817 -17.441 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.660 9.657 -16.570 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.968 9.877 -16.064 1.00 0.00 H new ATOM 434 N ILE A 29 -15.670 7.706 -14.426 1.00 0.00 N ATOM 435 CA ILE A 29 -14.328 7.079 -14.251 1.00 0.00 C ATOM 436 C ILE A 29 -14.367 6.028 -13.145 1.00 0.00 C ATOM 437 O ILE A 29 -14.843 6.269 -12.053 1.00 0.00 O ATOM 438 CB ILE A 29 -13.311 8.163 -13.890 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.319 9.237 -14.987 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.919 7.540 -13.759 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.909 9.443 -15.548 1.00 0.00 C ATOM 0 H ILE A 29 -15.889 8.455 -13.769 1.00 0.00 H new ATOM 0 HA ILE A 29 -14.040 6.592 -15.183 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.575 8.622 -12.937 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.996 8.941 -15.789 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.696 10.176 -14.582 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -11.196 8.315 -13.502 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.932 6.782 -12.976 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.636 7.080 -14.706 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.934 10.208 -16.324 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.242 9.761 -14.747 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.546 8.507 -15.973 1.00 0.00 H new ATOM 453 N GLU A 30 -13.860 4.860 -13.428 1.00 0.00 N ATOM 454 CA GLU A 30 -13.847 3.778 -12.409 1.00 0.00 C ATOM 455 C GLU A 30 -12.464 3.134 -12.385 1.00 0.00 C ATOM 456 O GLU A 30 -11.699 3.257 -13.321 1.00 0.00 O ATOM 457 CB GLU A 30 -14.898 2.725 -12.763 1.00 0.00 C ATOM 458 CG GLU A 30 -16.285 3.365 -12.758 1.00 0.00 C ATOM 459 CD GLU A 30 -17.340 2.296 -13.043 1.00 0.00 C ATOM 460 OE1 GLU A 30 -16.955 1.184 -13.367 1.00 0.00 O ATOM 461 OE2 GLU A 30 -18.513 2.606 -12.934 1.00 0.00 O ATOM 0 H GLU A 30 -13.452 4.609 -14.328 1.00 0.00 H new ATOM 0 HA GLU A 30 -14.076 4.194 -11.428 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.686 2.300 -13.744 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.862 1.905 -12.046 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.478 3.833 -11.793 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.337 4.152 -13.510 1.00 0.00 H new ATOM 469 N PHE A 31 -12.133 2.448 -11.328 1.00 0.00 N ATOM 470 CA PHE A 31 -10.795 1.801 -11.257 1.00 0.00 C ATOM 471 C PHE A 31 -10.945 0.287 -11.301 1.00 0.00 C ATOM 472 O PHE A 31 -11.895 -0.281 -10.801 1.00 0.00 O ATOM 473 CB PHE A 31 -10.092 2.193 -9.963 1.00 0.00 C ATOM 474 CG PHE A 31 -9.764 3.662 -9.997 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.859 4.154 -10.943 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.360 4.527 -9.079 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.548 5.518 -10.969 1.00 0.00 C ATOM 478 CE2 PHE A 31 -10.050 5.887 -9.102 1.00 0.00 C ATOM 479 CZ PHE A 31 -9.144 6.387 -10.045 1.00 0.00 C ATOM 0 H PHE A 31 -12.729 2.308 -10.512 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.203 2.135 -12.109 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.731 1.971 -9.108 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.180 1.608 -9.840 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.401 3.482 -11.653 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -11.060 4.144 -8.351 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.850 5.900 -11.699 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.510 6.556 -8.390 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.905 7.440 -10.060 1.00 0.00 H new ATOM 489 N LEU A 32 -10.000 -0.363 -11.907 1.00 0.00 N ATOM 490 CA LEU A 32 -10.042 -1.840 -12.014 1.00 0.00 C ATOM 491 C LEU A 32 -8.970 -2.440 -11.088 1.00 0.00 C ATOM 492 O LEU A 32 -7.785 -2.333 -11.335 1.00 0.00 O ATOM 493 CB LEU A 32 -9.801 -2.196 -13.490 1.00 0.00 C ATOM 494 CG LEU A 32 -9.202 -3.597 -13.652 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.300 -4.652 -13.568 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.544 -3.695 -15.024 1.00 0.00 C ATOM 0 H LEU A 32 -9.187 0.074 -12.340 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.003 -2.249 -11.702 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.743 -2.139 -14.035 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.130 -1.461 -13.935 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.473 -3.767 -12.859 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.862 -5.643 -13.685 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.795 -4.586 -12.599 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.029 -4.482 -14.360 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.114 -4.688 -15.151 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.291 -3.521 -15.799 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.757 -2.946 -15.104 1.00 0.00 H new ATOM 508 N LEU A 33 -9.388 -3.066 -10.013 1.00 0.00 N ATOM 509 CA LEU A 33 -8.413 -3.676 -9.054 1.00 0.00 C ATOM 510 C LEU A 33 -8.546 -5.196 -9.094 1.00 0.00 C ATOM 511 O LEU A 33 -9.478 -5.726 -9.664 1.00 0.00 O ATOM 512 CB LEU A 33 -8.715 -3.201 -7.631 1.00 0.00 C ATOM 513 CG LEU A 33 -8.253 -1.757 -7.440 1.00 0.00 C ATOM 514 CD1 LEU A 33 -8.989 -1.159 -6.244 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.750 -1.737 -7.161 1.00 0.00 C ATOM 0 H LEU A 33 -10.369 -3.181 -9.758 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.404 -3.376 -9.338 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.785 -3.276 -7.436 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.214 -3.848 -6.911 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.465 -1.179 -8.340 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.668 -0.128 -6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.063 -1.181 -6.429 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.763 -1.740 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.419 -0.707 -7.025 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.540 -2.309 -6.257 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.218 -2.181 -8.002 1.00 0.00 H new ATOM 527 N LEU A 34 -7.621 -5.907 -8.499 1.00 0.00 N ATOM 528 CA LEU A 34 -7.712 -7.396 -8.519 1.00 0.00 C ATOM 529 C LEU A 34 -7.561 -7.976 -7.106 1.00 0.00 C ATOM 530 O LEU A 34 -6.696 -7.579 -6.351 1.00 0.00 O ATOM 531 CB LEU A 34 -6.599 -7.961 -9.404 1.00 0.00 C ATOM 532 CG LEU A 34 -6.568 -7.240 -10.755 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.562 -7.937 -11.669 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.949 -7.287 -11.407 1.00 0.00 C ATOM 0 H LEU A 34 -6.815 -5.524 -8.005 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.691 -7.673 -8.911 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.637 -7.850 -8.904 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.756 -9.028 -9.559 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.280 -6.200 -10.600 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.534 -7.430 -12.633 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.573 -7.904 -11.213 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.861 -8.975 -11.814 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.916 -6.772 -12.367 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.243 -8.325 -11.562 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.675 -6.798 -10.757 1.00 0.00 H new ATOM 546 N GLN A 35 -8.377 -8.941 -6.759 1.00 0.00 N ATOM 547 CA GLN A 35 -8.253 -9.577 -5.414 1.00 0.00 C ATOM 548 C GLN A 35 -7.553 -10.923 -5.593 1.00 0.00 C ATOM 549 O GLN A 35 -8.114 -11.850 -6.141 1.00 0.00 O ATOM 550 CB GLN A 35 -9.636 -9.811 -4.799 1.00 0.00 C ATOM 551 CG GLN A 35 -9.504 -9.951 -3.280 1.00 0.00 C ATOM 552 CD GLN A 35 -10.890 -10.119 -2.653 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.893 -9.990 -3.326 1.00 0.00 O ATOM 554 NE2 GLN A 35 -10.987 -10.401 -1.381 1.00 0.00 N ATOM 0 H GLN A 35 -9.121 -9.314 -7.348 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.686 -8.924 -4.751 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.299 -8.980 -5.042 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.085 -10.711 -5.220 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.879 -10.810 -3.038 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.012 -9.071 -2.866 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -10.144 -10.509 -0.817 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -11.906 -10.513 -0.952 1.00 0.00 H new ATOM 563 N ALA A 36 -6.329 -11.044 -5.160 1.00 0.00 N ATOM 564 CA ALA A 36 -5.610 -12.338 -5.341 1.00 0.00 C ATOM 565 C ALA A 36 -6.268 -13.426 -4.489 1.00 0.00 C ATOM 566 O ALA A 36 -6.448 -13.274 -3.299 1.00 0.00 O ATOM 567 CB ALA A 36 -4.149 -12.174 -4.925 1.00 0.00 C ATOM 0 H ALA A 36 -5.798 -10.310 -4.692 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.659 -12.630 -6.390 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.625 -13.120 -5.058 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.679 -11.409 -5.542 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.100 -11.876 -3.878 1.00 0.00 H new ATOM 573 N SER A 37 -6.624 -14.531 -5.093 1.00 0.00 N ATOM 574 CA SER A 37 -7.269 -15.634 -4.319 1.00 0.00 C ATOM 575 C SER A 37 -6.218 -16.670 -3.922 1.00 0.00 C ATOM 576 O SER A 37 -6.457 -17.519 -3.086 1.00 0.00 O ATOM 577 CB SER A 37 -8.341 -16.307 -5.177 1.00 0.00 C ATOM 578 OG SER A 37 -8.847 -17.441 -4.484 1.00 0.00 O ATOM 0 H SER A 37 -6.496 -14.717 -6.088 1.00 0.00 H new ATOM 0 HA SER A 37 -7.727 -15.218 -3.422 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.148 -15.605 -5.390 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.920 -16.609 -6.136 1.00 0.00 H new ATOM 0 HG SER A 37 -9.536 -17.876 -5.028 1.00 0.00 H new ATOM 641 N HIS A 42 -6.259 -10.125 -1.096 1.00 0.00 N ATOM 642 CA HIS A 42 -5.984 -8.665 -0.977 1.00 0.00 C ATOM 643 C HIS A 42 -6.285 -7.982 -2.312 1.00 0.00 C ATOM 644 O HIS A 42 -6.050 -8.534 -3.368 1.00 0.00 O ATOM 645 CB HIS A 42 -4.510 -8.455 -0.626 1.00 0.00 C ATOM 646 CG HIS A 42 -3.650 -9.234 -1.586 1.00 0.00 C ATOM 647 ND1 HIS A 42 -2.843 -8.843 -2.627 1.00 0.00 N flip ATOM 648 CD2 HIS A 42 -3.541 -10.616 -1.523 1.00 0.00 C flip ATOM 649 CE1 HIS A 42 -2.244 -9.961 -3.194 1.00 0.00 C flip ATOM 650 NE2 HIS A 42 -2.697 -11.002 -2.494 1.00 0.00 N flip ATOM 0 HA HIS A 42 -6.613 -8.238 -0.196 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.261 -7.395 -0.675 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.319 -8.780 0.397 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.044 -11.264 -0.820 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.556 -9.983 -4.026 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -2.435 -11.971 -2.674 1.00 0.00 H new ATOM 659 N TRP A 43 -6.801 -6.783 -2.274 1.00 0.00 N ATOM 660 CA TRP A 43 -7.116 -6.068 -3.544 1.00 0.00 C ATOM 661 C TRP A 43 -5.902 -5.264 -4.007 1.00 0.00 C ATOM 662 O TRP A 43 -5.226 -4.628 -3.224 1.00 0.00 O ATOM 663 CB TRP A 43 -8.284 -5.113 -3.315 1.00 0.00 C ATOM 664 CG TRP A 43 -9.575 -5.858 -3.415 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.362 -6.207 -2.372 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.240 -6.345 -4.609 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.472 -6.877 -2.856 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.440 -6.989 -4.230 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.918 -6.289 -5.975 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.291 -7.561 -5.175 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.770 -6.863 -6.930 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.954 -7.498 -6.529 1.00 0.00 C ATOM 0 H TRP A 43 -7.018 -6.269 -1.420 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.378 -6.802 -4.306 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.198 -4.647 -2.333 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.259 -4.310 -4.052 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.158 -5.997 -1.332 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.221 -7.243 -2.269 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.008 -5.801 -6.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.203 -8.048 -4.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.513 -6.816 -7.978 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.606 -7.939 -7.268 1.00 0.00 H new ATOM 683 N THR A 44 -5.629 -5.285 -5.281 1.00 0.00 N ATOM 684 CA THR A 44 -4.466 -4.519 -5.807 1.00 0.00 C ATOM 685 C THR A 44 -4.560 -4.442 -7.328 1.00 0.00 C ATOM 686 O THR A 44 -5.141 -5.300 -7.964 1.00 0.00 O ATOM 687 CB THR A 44 -3.170 -5.227 -5.414 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.173 -4.967 -6.394 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.417 -6.731 -5.323 1.00 0.00 C ATOM 0 H THR A 44 -6.162 -5.800 -5.982 1.00 0.00 H new ATOM 0 HA THR A 44 -4.472 -3.513 -5.388 1.00 0.00 H new ATOM 0 HB THR A 44 -2.833 -4.857 -4.446 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.341 -5.419 -6.142 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.492 -7.235 -5.043 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.181 -6.929 -4.571 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.755 -7.103 -6.290 1.00 0.00 H new ATOM 697 N PRO A 45 -3.982 -3.426 -7.912 1.00 0.00 N ATOM 698 CA PRO A 45 -3.988 -3.241 -9.384 1.00 0.00 C ATOM 699 C PRO A 45 -3.010 -4.196 -10.054 1.00 0.00 C ATOM 700 O PRO A 45 -2.136 -4.747 -9.413 1.00 0.00 O ATOM 701 CB PRO A 45 -3.538 -1.794 -9.566 1.00 0.00 C ATOM 702 CG PRO A 45 -2.670 -1.526 -8.390 1.00 0.00 C ATOM 703 CD PRO A 45 -3.249 -2.346 -7.233 1.00 0.00 C ATOM 0 HA PRO A 45 -4.961 -3.444 -9.831 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.993 -1.662 -10.501 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.389 -1.114 -9.595 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.639 -1.815 -8.594 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.661 -0.463 -8.147 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.464 -2.738 -6.586 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -3.908 -1.746 -6.606 1.00 0.00 H new ATOM 711 N PRO A 46 -3.160 -4.404 -11.323 1.00 0.00 N ATOM 712 CA PRO A 46 -2.273 -5.324 -12.077 1.00 0.00 C ATOM 713 C PRO A 46 -0.819 -4.847 -12.110 1.00 0.00 C ATOM 714 O PRO A 46 -0.420 -4.093 -12.975 1.00 0.00 O ATOM 715 CB PRO A 46 -2.869 -5.347 -13.483 1.00 0.00 C ATOM 716 CG PRO A 46 -3.751 -4.146 -13.589 1.00 0.00 C ATOM 717 CD PRO A 46 -4.180 -3.781 -12.174 1.00 0.00 C ATOM 0 HA PRO A 46 -2.232 -6.308 -11.611 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.083 -5.319 -14.238 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.438 -6.262 -13.648 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.219 -3.317 -14.056 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.619 -4.359 -14.212 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.212 -2.701 -12.033 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.176 -4.162 -11.948 1.00 0.00 H new ATOM 725 N LYS A 47 -0.023 -5.292 -11.174 1.00 0.00 N ATOM 726 CA LYS A 47 1.410 -4.878 -11.145 1.00 0.00 C ATOM 727 C LYS A 47 2.279 -6.087 -10.788 1.00 0.00 C ATOM 728 O LYS A 47 1.888 -6.934 -10.009 1.00 0.00 O ATOM 729 CB LYS A 47 1.605 -3.752 -10.117 1.00 0.00 C ATOM 730 CG LYS A 47 1.912 -4.322 -8.729 1.00 0.00 C ATOM 731 CD LYS A 47 3.425 -4.468 -8.556 1.00 0.00 C ATOM 732 CE LYS A 47 3.724 -5.412 -7.390 1.00 0.00 C ATOM 733 NZ LYS A 47 3.145 -6.756 -7.675 1.00 0.00 N ATOM 0 H LYS A 47 -0.305 -5.926 -10.426 1.00 0.00 H new ATOM 0 HA LYS A 47 1.706 -4.506 -12.126 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.420 -3.102 -10.435 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.706 -3.137 -10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.510 -3.665 -7.958 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.427 -5.291 -8.607 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.869 -4.855 -9.473 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.875 -3.493 -8.371 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.801 -5.493 -7.241 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.304 -5.012 -6.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.360 -6.942 -7.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 2.792 -6.782 -8.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.879 -7.483 -7.553 1.00 0.00 H new ATOM 747 N GLY A 48 3.455 -6.179 -11.353 1.00 0.00 N ATOM 748 CA GLY A 48 4.340 -7.338 -11.042 1.00 0.00 C ATOM 749 C GLY A 48 5.767 -6.840 -10.788 1.00 0.00 C ATOM 750 O GLY A 48 6.107 -5.719 -11.103 1.00 0.00 O ATOM 0 H GLY A 48 3.839 -5.504 -12.014 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.967 -7.868 -10.166 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.333 -8.047 -11.870 1.00 0.00 H new ATOM 754 N HIS A 49 6.602 -7.672 -10.221 1.00 0.00 N ATOM 755 CA HIS A 49 8.006 -7.251 -9.945 1.00 0.00 C ATOM 756 C HIS A 49 8.751 -7.053 -11.264 1.00 0.00 C ATOM 757 O HIS A 49 8.351 -7.558 -12.295 1.00 0.00 O ATOM 758 CB HIS A 49 8.711 -8.329 -9.120 1.00 0.00 C ATOM 759 CG HIS A 49 10.205 -8.140 -9.197 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.016 -7.065 -8.916 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.055 -9.157 -9.615 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.342 -7.410 -9.155 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.313 -8.676 -9.573 1.00 0.00 N flip ATOM 0 H HIS A 49 6.371 -8.624 -9.938 1.00 0.00 H new ATOM 0 HA HIS A 49 7.998 -6.314 -9.389 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.382 -8.278 -8.082 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.441 -9.318 -9.491 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.761 -10.151 -9.918 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.213 -6.784 -9.029 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.141 -9.214 -9.829 1.00 0.00 H new ATOM 772 N VAL A 50 9.829 -6.320 -11.243 1.00 0.00 N ATOM 773 CA VAL A 50 10.593 -6.091 -12.501 1.00 0.00 C ATOM 774 C VAL A 50 11.642 -7.191 -12.667 1.00 0.00 C ATOM 775 O VAL A 50 12.433 -7.450 -11.783 1.00 0.00 O ATOM 776 CB VAL A 50 11.277 -4.718 -12.436 1.00 0.00 C ATOM 777 CG1 VAL A 50 12.766 -4.875 -12.113 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.132 -4.006 -13.782 1.00 0.00 C ATOM 0 H VAL A 50 10.213 -5.871 -10.412 1.00 0.00 H new ATOM 0 HA VAL A 50 9.915 -6.114 -13.354 1.00 0.00 H new ATOM 0 HB VAL A 50 10.800 -4.131 -11.651 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.235 -3.892 -12.071 1.00 0.00 H new ATOM 0 HG12 VAL A 50 12.879 -5.372 -11.150 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.245 -5.473 -12.888 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.618 -3.032 -13.733 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.599 -4.606 -14.563 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.075 -3.872 -14.011 1.00 0.00 H new ATOM 841 N ASP A 55 11.726 -3.490 -18.383 1.00 0.00 N ATOM 842 CA ASP A 55 11.903 -2.108 -17.857 1.00 0.00 C ATOM 843 C ASP A 55 10.892 -1.863 -16.736 1.00 0.00 C ATOM 844 O ASP A 55 10.064 -2.701 -16.440 1.00 0.00 O ATOM 845 CB ASP A 55 11.660 -1.100 -18.983 1.00 0.00 C ATOM 846 CG ASP A 55 12.470 0.171 -18.720 1.00 0.00 C ATOM 847 OD1 ASP A 55 13.102 0.245 -17.680 1.00 0.00 O ATOM 848 OD2 ASP A 55 12.444 1.051 -19.565 1.00 0.00 O ATOM 0 HA ASP A 55 12.916 -1.990 -17.473 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.947 -1.534 -19.941 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.599 -0.860 -19.047 1.00 0.00 H new ATOM 854 N ASP A 56 10.951 -0.722 -16.107 1.00 0.00 N ATOM 855 CA ASP A 56 9.988 -0.434 -15.006 1.00 0.00 C ATOM 856 C ASP A 56 8.568 -0.346 -15.573 1.00 0.00 C ATOM 857 O ASP A 56 7.708 -1.132 -15.230 1.00 0.00 O ATOM 858 CB ASP A 56 10.359 0.892 -14.338 1.00 0.00 C ATOM 859 CG ASP A 56 11.707 0.745 -13.630 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.169 -0.379 -13.506 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.254 1.757 -13.224 1.00 0.00 O ATOM 0 H ASP A 56 11.621 0.021 -16.306 1.00 0.00 H new ATOM 0 HA ASP A 56 10.031 -1.236 -14.269 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.412 1.685 -15.084 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.589 1.179 -13.622 1.00 0.00 H new ATOM 867 N LEU A 57 8.308 0.595 -16.443 1.00 0.00 N ATOM 868 CA LEU A 57 6.935 0.692 -17.017 1.00 0.00 C ATOM 869 C LEU A 57 6.653 -0.549 -17.854 1.00 0.00 C ATOM 870 O LEU A 57 5.579 -1.114 -17.802 1.00 0.00 O ATOM 871 CB LEU A 57 6.807 1.941 -17.892 1.00 0.00 C ATOM 872 CG LEU A 57 5.489 1.889 -18.680 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.299 2.164 -17.756 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.527 2.941 -19.788 1.00 0.00 C ATOM 0 H LEU A 57 8.976 1.290 -16.776 1.00 0.00 H new ATOM 0 HA LEU A 57 6.214 0.762 -16.203 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.835 2.836 -17.271 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.651 2.003 -18.579 1.00 0.00 H new ATOM 0 HG LEU A 57 5.373 0.895 -19.111 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.374 2.123 -18.332 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.269 1.412 -16.968 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.405 3.153 -17.310 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.594 2.910 -20.352 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.651 3.930 -19.347 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.362 2.735 -20.457 1.00 0.00 H new ATOM 886 N GLU A 58 7.610 -0.990 -18.620 1.00 0.00 N ATOM 887 CA GLU A 58 7.380 -2.202 -19.443 1.00 0.00 C ATOM 888 C GLU A 58 6.948 -3.319 -18.496 1.00 0.00 C ATOM 889 O GLU A 58 6.117 -4.144 -18.825 1.00 0.00 O ATOM 890 CB GLU A 58 8.677 -2.583 -20.165 1.00 0.00 C ATOM 891 CG GLU A 58 9.049 -1.478 -21.158 1.00 0.00 C ATOM 892 CD GLU A 58 7.971 -1.375 -22.240 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.936 -0.360 -22.915 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.201 -2.311 -22.375 1.00 0.00 O ATOM 0 H GLU A 58 8.533 -0.566 -18.710 1.00 0.00 H new ATOM 0 HA GLU A 58 6.612 -2.028 -20.196 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.481 -2.724 -19.442 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.550 -3.530 -20.689 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.148 -0.526 -20.637 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.016 -1.694 -21.613 1.00 0.00 H new ATOM 902 N THR A 59 7.482 -3.325 -17.304 1.00 0.00 N ATOM 903 CA THR A 59 7.077 -4.356 -16.314 1.00 0.00 C ATOM 904 C THR A 59 5.617 -4.109 -15.943 1.00 0.00 C ATOM 905 O THR A 59 4.818 -5.019 -15.878 1.00 0.00 O ATOM 906 CB THR A 59 7.952 -4.238 -15.066 1.00 0.00 C ATOM 907 OG1 THR A 59 9.019 -5.173 -15.150 1.00 0.00 O ATOM 908 CG2 THR A 59 7.113 -4.520 -13.817 1.00 0.00 C ATOM 0 H THR A 59 8.181 -2.659 -16.976 1.00 0.00 H new ATOM 0 HA THR A 59 7.196 -5.354 -16.735 1.00 0.00 H new ATOM 0 HB THR A 59 8.358 -3.229 -15.001 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.676 -6.076 -14.984 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.741 -4.435 -12.930 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.298 -3.799 -13.756 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.702 -5.528 -13.875 1.00 0.00 H new ATOM 916 N ALA A 60 5.259 -2.870 -15.722 1.00 0.00 N ATOM 917 CA ALA A 60 3.844 -2.566 -15.386 1.00 0.00 C ATOM 918 C ALA A 60 2.991 -2.986 -16.576 1.00 0.00 C ATOM 919 O ALA A 60 1.998 -3.667 -16.437 1.00 0.00 O ATOM 920 CB ALA A 60 3.683 -1.064 -15.144 1.00 0.00 C ATOM 0 H ALA A 60 5.883 -2.064 -15.760 1.00 0.00 H new ATOM 0 HA ALA A 60 3.539 -3.098 -14.485 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.644 -0.844 -14.898 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.324 -0.758 -14.317 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.966 -0.518 -16.044 1.00 0.00 H new ATOM 926 N LEU A 61 3.407 -2.614 -17.756 1.00 0.00 N ATOM 927 CA LEU A 61 2.658 -3.017 -18.973 1.00 0.00 C ATOM 928 C LEU A 61 2.659 -4.543 -19.039 1.00 0.00 C ATOM 929 O LEU A 61 1.683 -5.166 -19.407 1.00 0.00 O ATOM 930 CB LEU A 61 3.356 -2.435 -20.207 1.00 0.00 C ATOM 931 CG LEU A 61 3.214 -0.911 -20.193 1.00 0.00 C ATOM 932 CD1 LEU A 61 4.105 -0.292 -21.267 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.759 -0.532 -20.471 1.00 0.00 C ATOM 0 H LEU A 61 4.237 -2.046 -17.927 1.00 0.00 H new ATOM 0 HA LEU A 61 1.634 -2.646 -18.942 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.410 -2.714 -20.209 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.916 -2.845 -21.116 1.00 0.00 H new ATOM 0 HG LEU A 61 3.515 -0.537 -19.215 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.997 0.792 -21.249 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.145 -0.556 -21.074 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.811 -0.670 -22.246 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.657 0.553 -20.461 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.463 -0.915 -21.448 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.117 -0.963 -19.703 1.00 0.00 H new ATOM 945 N ARG A 62 3.754 -5.143 -18.659 1.00 0.00 N ATOM 946 CA ARG A 62 3.845 -6.627 -18.665 1.00 0.00 C ATOM 947 C ARG A 62 2.846 -7.206 -17.661 1.00 0.00 C ATOM 948 O ARG A 62 2.105 -8.119 -17.961 1.00 0.00 O ATOM 949 CB ARG A 62 5.261 -7.028 -18.252 1.00 0.00 C ATOM 950 CG ARG A 62 5.391 -8.551 -18.212 1.00 0.00 C ATOM 951 CD ARG A 62 6.712 -8.914 -17.532 1.00 0.00 C ATOM 952 NE ARG A 62 6.862 -10.393 -17.476 1.00 0.00 N ATOM 953 CZ ARG A 62 8.038 -10.918 -17.269 1.00 0.00 C ATOM 954 NH1 ARG A 62 9.082 -10.147 -17.138 1.00 0.00 N ATOM 955 NH2 ARG A 62 8.172 -12.215 -17.197 1.00 0.00 N ATOM 0 H ARG A 62 4.596 -4.662 -18.342 1.00 0.00 H new ATOM 0 HA ARG A 62 3.618 -7.009 -19.660 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.983 -6.613 -18.955 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.493 -6.611 -17.272 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.554 -8.987 -17.667 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.362 -8.959 -19.222 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.546 -8.476 -18.080 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.739 -8.498 -16.525 1.00 0.00 H new ATOM 0 HE ARG A 62 6.048 -10.995 -17.599 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.979 -9.134 -17.197 1.00 0.00 H new ATOM 0 HH12 ARG A 62 10.002 -10.557 -16.976 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.357 -12.819 -17.303 1.00 0.00 H new ATOM 0 HH22 ARG A 62 9.092 -12.624 -17.035 1.00 0.00 H new ATOM 969 N ALA A 63 2.829 -6.685 -16.464 1.00 0.00 N ATOM 970 CA ALA A 63 1.885 -7.208 -15.437 1.00 0.00 C ATOM 971 C ALA A 63 0.461 -6.777 -15.782 1.00 0.00 C ATOM 972 O ALA A 63 -0.497 -7.454 -15.468 1.00 0.00 O ATOM 973 CB ALA A 63 2.261 -6.652 -14.063 1.00 0.00 C ATOM 0 H ALA A 63 3.428 -5.920 -16.154 1.00 0.00 H new ATOM 0 HA ALA A 63 1.943 -8.296 -15.419 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.569 -7.036 -13.313 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.276 -6.960 -13.811 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.206 -5.564 -14.084 1.00 0.00 H new ATOM 979 N THR A 64 0.314 -5.650 -16.415 1.00 0.00 N ATOM 980 CA THR A 64 -1.049 -5.168 -16.768 1.00 0.00 C ATOM 981 C THR A 64 -1.800 -6.253 -17.538 1.00 0.00 C ATOM 982 O THR A 64 -2.947 -6.544 -17.259 1.00 0.00 O ATOM 983 CB THR A 64 -0.921 -3.916 -17.631 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.053 -2.997 -16.987 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.290 -3.266 -17.813 1.00 0.00 C ATOM 0 H THR A 64 1.079 -5.040 -16.704 1.00 0.00 H new ATOM 0 HA THR A 64 -1.604 -4.935 -15.859 1.00 0.00 H new ATOM 0 HB THR A 64 -0.521 -4.191 -18.607 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.866 -3.336 -17.021 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.190 -2.373 -18.430 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.965 -3.970 -18.300 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.694 -2.990 -16.839 1.00 0.00 H new ATOM 993 N GLN A 65 -1.169 -6.852 -18.507 1.00 0.00 N ATOM 994 CA GLN A 65 -1.860 -7.914 -19.290 1.00 0.00 C ATOM 995 C GLN A 65 -1.919 -9.219 -18.489 1.00 0.00 C ATOM 996 O GLN A 65 -2.954 -9.832 -18.366 1.00 0.00 O ATOM 997 CB GLN A 65 -1.112 -8.149 -20.607 1.00 0.00 C ATOM 998 CG GLN A 65 0.086 -9.071 -20.371 1.00 0.00 C ATOM 999 CD GLN A 65 0.970 -9.088 -21.617 1.00 0.00 C ATOM 1000 OE1 GLN A 65 1.201 -8.064 -22.229 1.00 0.00 O ATOM 1001 NE2 GLN A 65 1.484 -10.217 -22.021 1.00 0.00 N ATOM 0 H GLN A 65 -0.209 -6.654 -18.791 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.879 -7.588 -19.501 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -1.784 -8.593 -21.342 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.774 -7.198 -21.018 1.00 0.00 H new ATOM 0 HG2 GLN A 65 0.659 -8.727 -19.510 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -0.258 -10.080 -20.142 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.291 -11.078 -21.508 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.079 -10.239 -22.849 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.813 -9.666 -17.970 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.817 -10.954 -17.213 1.00 0.00 C ATOM 1012 C GLU A 66 -1.635 -10.843 -15.921 1.00 0.00 C ATOM 1013 O GLU A 66 -2.364 -11.750 -15.567 1.00 0.00 O ATOM 1014 CB GLU A 66 0.623 -11.332 -16.866 1.00 0.00 C ATOM 1015 CG GLU A 66 0.640 -12.722 -16.229 1.00 0.00 C ATOM 1016 CD GLU A 66 2.066 -13.069 -15.797 1.00 0.00 C ATOM 1017 OE1 GLU A 66 2.265 -14.168 -15.306 1.00 0.00 O ATOM 1018 OE2 GLU A 66 2.936 -12.230 -15.962 1.00 0.00 O ATOM 0 H GLU A 66 0.092 -9.201 -18.034 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.275 -11.719 -17.840 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.240 -11.323 -17.764 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.048 -10.600 -16.180 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.028 -12.747 -15.368 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.273 -13.463 -16.939 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.505 -9.768 -15.195 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.258 -9.649 -13.911 1.00 0.00 C ATOM 1028 C GLU A 67 -3.758 -9.438 -14.164 1.00 0.00 C ATOM 1029 O GLU A 67 -4.589 -9.976 -13.459 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.716 -8.472 -13.107 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.242 -8.705 -12.766 1.00 0.00 C ATOM 1032 CD GLU A 67 -0.105 -9.948 -11.890 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -1.108 -10.383 -11.352 1.00 0.00 O ATOM 1034 OE2 GLU A 67 1.003 -10.443 -11.770 1.00 0.00 O ATOM 0 H GLU A 67 -0.915 -8.970 -15.431 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.127 -10.577 -13.355 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.824 -7.550 -13.678 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.295 -8.349 -12.191 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.338 -8.828 -13.681 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.163 -7.836 -12.247 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.120 -8.651 -15.144 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.574 -8.412 -15.402 1.00 0.00 C ATOM 1044 C ALA A 68 -5.966 -8.949 -16.773 1.00 0.00 C ATOM 1045 O ALA A 68 -7.122 -9.218 -17.033 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.872 -6.913 -15.361 1.00 0.00 C ATOM 0 H ALA A 68 -3.479 -8.167 -15.773 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.146 -8.928 -14.631 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.933 -6.748 -15.550 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.612 -6.517 -14.379 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.284 -6.404 -16.125 1.00 0.00 H new ATOM 1052 N GLY A 69 -5.027 -9.094 -17.665 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.378 -9.597 -19.017 1.00 0.00 C ATOM 1054 C GLY A 69 -5.469 -8.425 -19.990 1.00 0.00 C ATOM 1055 O GLY A 69 -5.895 -8.582 -21.118 1.00 0.00 O ATOM 0 H GLY A 69 -4.039 -8.887 -17.516 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.626 -10.309 -19.358 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.329 -10.129 -18.983 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.082 -7.248 -19.572 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.168 -6.085 -20.493 1.00 0.00 C ATOM 1061 C ILE A 70 -3.768 -5.706 -20.988 1.00 0.00 C ATOM 1062 O ILE A 70 -2.853 -5.528 -20.210 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.763 -4.885 -19.762 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.903 -5.338 -18.854 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.318 -3.901 -20.791 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.356 -4.155 -18.004 1.00 0.00 C ATOM 0 H ILE A 70 -4.714 -7.046 -18.642 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.801 -6.358 -21.337 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.987 -4.411 -19.161 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.734 -5.714 -19.451 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.573 -6.157 -18.215 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.745 -3.040 -20.277 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.514 -3.569 -21.448 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.091 -4.391 -21.383 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.171 -4.467 -17.351 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.521 -3.801 -17.399 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.700 -3.350 -18.654 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.600 -5.560 -22.274 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.263 -5.174 -22.811 1.00 0.00 C ATOM 1080 C GLU A 71 -2.233 -3.681 -23.096 1.00 0.00 C ATOM 1081 O GLU A 71 -3.241 -3.003 -23.079 1.00 0.00 O ATOM 1082 CB GLU A 71 -1.972 -5.908 -24.118 1.00 0.00 C ATOM 1083 CG GLU A 71 -1.711 -7.383 -23.838 1.00 0.00 C ATOM 1084 CD GLU A 71 -1.404 -8.105 -25.152 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -1.623 -7.511 -26.196 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -0.954 -9.237 -25.093 1.00 0.00 O ATOM 0 H GLU A 71 -4.329 -5.691 -22.975 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.514 -5.439 -22.065 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -2.816 -5.802 -24.800 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.107 -5.464 -24.610 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.875 -7.491 -23.147 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.580 -7.832 -23.358 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.074 -3.172 -23.377 1.00 0.00 N ATOM 1095 CA ALA A 72 -0.948 -1.728 -23.688 1.00 0.00 C ATOM 1096 C ALA A 72 -1.679 -1.436 -24.996 1.00 0.00 C ATOM 1097 O ALA A 72 -2.120 -0.332 -25.246 1.00 0.00 O ATOM 1098 CB ALA A 72 0.524 -1.375 -23.850 1.00 0.00 C ATOM 0 H ALA A 72 -0.201 -3.698 -23.405 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.380 -1.137 -22.880 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.621 -0.314 -24.079 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.055 -1.596 -22.924 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.952 -1.962 -24.663 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.795 -2.424 -25.842 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.480 -2.222 -27.150 1.00 0.00 C ATOM 1106 C GLY A 73 -3.876 -1.636 -26.935 1.00 0.00 C ATOM 1107 O GLY A 73 -4.339 -0.825 -27.712 1.00 0.00 O ATOM 0 H GLY A 73 -1.442 -3.368 -25.682 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.890 -1.553 -27.777 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.555 -3.172 -27.679 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.552 -2.031 -25.892 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.917 -1.481 -25.651 1.00 0.00 C ATOM 1113 C GLN A 74 -5.852 -0.387 -24.583 1.00 0.00 C ATOM 1114 O GLN A 74 -6.849 0.221 -24.246 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.875 -2.597 -25.220 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.229 -3.464 -24.142 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.042 -4.749 -23.978 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.465 -5.813 -23.492 1.00 0.00 O flip ATOM 1119 NE2 GLN A 74 -8.214 -4.785 -24.298 1.00 0.00 N flip ATOM 0 H GLN A 74 -4.223 -2.705 -25.201 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.294 -1.048 -26.578 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.801 -2.164 -24.841 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.139 -3.212 -26.081 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.201 -3.702 -24.417 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.189 -2.922 -23.197 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.665 -3.953 -24.678 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.747 -5.648 -24.187 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.684 -0.117 -24.065 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.555 0.957 -23.039 1.00 0.00 C ATOM 1130 C LEU A 75 -3.682 2.085 -23.581 1.00 0.00 C ATOM 1131 O LEU A 75 -2.761 1.863 -24.340 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.863 0.429 -21.785 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.547 -0.829 -21.274 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.529 -1.622 -20.460 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.721 -0.444 -20.370 1.00 0.00 C ATOM 0 H LEU A 75 -3.815 -0.593 -24.308 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.560 1.307 -22.802 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.817 0.215 -22.005 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.875 1.194 -21.009 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.919 -1.422 -22.110 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.995 -2.531 -20.081 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.682 -1.885 -21.094 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.181 -1.017 -19.623 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.210 -1.347 -20.005 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.354 0.137 -19.524 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.436 0.152 -20.937 1.00 0.00 H new ATOM 1147 N THR A 76 -3.930 3.284 -23.149 1.00 0.00 N ATOM 1148 CA THR A 76 -3.084 4.426 -23.578 1.00 0.00 C ATOM 1149 C THR A 76 -2.460 5.004 -22.309 1.00 0.00 C ATOM 1150 O THR A 76 -3.152 5.443 -21.414 1.00 0.00 O ATOM 1151 CB THR A 76 -3.940 5.475 -24.304 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.316 5.821 -25.532 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.099 6.729 -23.445 1.00 0.00 C ATOM 0 H THR A 76 -4.689 3.525 -22.512 1.00 0.00 H new ATOM 0 HA THR A 76 -2.309 4.111 -24.276 1.00 0.00 H new ATOM 0 HB THR A 76 -4.927 5.053 -24.492 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.860 6.489 -25.999 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.708 7.460 -23.977 1.00 0.00 H new ATOM 0 HG22 THR A 76 -4.585 6.467 -22.505 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.117 7.156 -23.239 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.164 4.970 -22.193 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.536 5.482 -20.947 1.00 0.00 C ATOM 1163 C ILE A 77 -0.756 6.982 -20.820 1.00 0.00 C ATOM 1164 O ILE A 77 0.059 7.775 -21.246 1.00 0.00 O ATOM 1165 CB ILE A 77 0.966 5.205 -20.954 1.00 0.00 C ATOM 1166 CG1 ILE A 77 1.211 3.695 -21.016 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.590 5.780 -19.676 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.220 3.113 -19.600 1.00 0.00 C ATOM 0 H ILE A 77 -0.519 4.614 -22.898 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.999 4.971 -20.103 1.00 0.00 H new ATOM 0 HB ILE A 77 1.421 5.675 -21.826 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.434 3.215 -21.611 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.162 3.491 -21.509 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.662 5.585 -19.675 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.416 6.855 -19.638 1.00 0.00 H new ATOM 0 HG23 ILE A 77 1.135 5.308 -18.805 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.395 2.038 -19.649 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.013 3.583 -19.018 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.259 3.303 -19.123 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.826 7.383 -20.202 1.00 0.00 N ATOM 1181 CA ILE A 78 -2.045 8.838 -20.023 1.00 0.00 C ATOM 1182 C ILE A 78 -0.767 9.400 -19.438 1.00 0.00 C ATOM 1183 O ILE A 78 -0.322 10.480 -19.768 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.174 9.084 -19.026 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.533 8.905 -19.714 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -3.042 10.501 -18.470 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.899 7.420 -19.713 1.00 0.00 C ATOM 0 H ILE A 78 -2.549 6.775 -19.818 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.306 9.303 -20.974 1.00 0.00 H new ATOM 0 HB ILE A 78 -3.108 8.365 -18.209 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.298 9.482 -19.193 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.490 9.282 -20.736 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.844 10.688 -17.756 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -2.079 10.608 -17.970 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.108 11.220 -19.287 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.864 7.283 -20.200 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.137 6.857 -20.252 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.957 7.060 -18.686 1.00 0.00 H new ATOM 1199 N GLU A 79 -0.180 8.648 -18.558 1.00 0.00 N ATOM 1200 CA GLU A 79 1.074 9.089 -17.910 1.00 0.00 C ATOM 1201 C GLU A 79 0.761 10.275 -16.997 1.00 0.00 C ATOM 1202 O GLU A 79 -0.098 10.193 -16.144 1.00 0.00 O ATOM 1203 CB GLU A 79 2.086 9.480 -18.993 1.00 0.00 C ATOM 1204 CG GLU A 79 3.435 8.859 -18.651 1.00 0.00 C ATOM 1205 CD GLU A 79 4.459 9.217 -19.731 1.00 0.00 C ATOM 1206 OE1 GLU A 79 5.582 8.748 -19.633 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.105 9.951 -20.638 1.00 0.00 O ATOM 0 H GLU A 79 -0.522 7.735 -18.258 1.00 0.00 H new ATOM 0 HA GLU A 79 1.504 8.287 -17.310 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.747 9.133 -19.969 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.174 10.565 -19.053 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.776 9.219 -17.680 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.338 7.776 -18.573 1.00 0.00 H new ATOM 1215 N GLY A 80 1.437 11.374 -17.154 1.00 0.00 N ATOM 1216 CA GLY A 80 1.149 12.537 -16.276 1.00 0.00 C ATOM 1217 C GLY A 80 1.505 12.176 -14.835 1.00 0.00 C ATOM 1218 O GLY A 80 2.289 12.847 -14.195 1.00 0.00 O ATOM 0 H GLY A 80 2.172 11.518 -17.847 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.725 13.404 -16.600 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.096 12.809 -16.346 1.00 0.00 H new ATOM 1222 N PHE A 81 0.943 11.114 -14.320 1.00 0.00 N ATOM 1223 CA PHE A 81 1.270 10.718 -12.923 1.00 0.00 C ATOM 1224 C PHE A 81 2.133 9.457 -12.936 1.00 0.00 C ATOM 1225 O PHE A 81 1.727 8.415 -13.413 1.00 0.00 O ATOM 1226 CB PHE A 81 -0.021 10.437 -12.149 1.00 0.00 C ATOM 1227 CG PHE A 81 0.311 10.228 -10.692 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.344 11.322 -9.819 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.593 8.942 -10.213 1.00 0.00 C ATOM 1230 CE1 PHE A 81 0.656 11.130 -8.467 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.904 8.750 -8.861 1.00 0.00 C ATOM 1232 CZ PHE A 81 0.938 9.843 -7.989 1.00 0.00 C ATOM 0 H PHE A 81 0.278 10.510 -14.803 1.00 0.00 H new ATOM 0 HA PHE A 81 1.814 11.530 -12.440 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.715 11.270 -12.261 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.516 9.554 -12.552 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.129 12.314 -10.188 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.571 8.098 -10.887 1.00 0.00 H new ATOM 0 HE1 PHE A 81 0.679 11.974 -7.793 1.00 0.00 H new ATOM 0 HE2 PHE A 81 1.118 7.758 -8.492 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.182 9.695 -6.947 1.00 0.00 H new ATOM 1242 N LYS A 82 3.315 9.542 -12.396 1.00 0.00 N ATOM 1243 CA LYS A 82 4.210 8.352 -12.349 1.00 0.00 C ATOM 1244 C LYS A 82 5.111 8.469 -11.134 1.00 0.00 C ATOM 1245 O LYS A 82 5.995 9.297 -11.087 1.00 0.00 O ATOM 1246 CB LYS A 82 5.081 8.287 -13.607 1.00 0.00 C ATOM 1247 CG LYS A 82 6.113 7.153 -13.477 1.00 0.00 C ATOM 1248 CD LYS A 82 7.288 7.583 -12.584 1.00 0.00 C ATOM 1249 CE LYS A 82 8.553 6.828 -13.001 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.751 7.557 -12.496 1.00 0.00 N ATOM 0 H LYS A 82 3.703 10.390 -11.982 1.00 0.00 H new ATOM 0 HA LYS A 82 3.602 7.449 -12.293 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.455 8.121 -14.484 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.591 9.239 -13.755 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.636 6.268 -13.057 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.483 6.877 -14.464 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.449 8.658 -12.670 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.058 7.378 -11.539 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.534 5.815 -12.600 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.597 6.741 -14.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.612 7.047 -12.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.769 8.516 -12.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.708 7.618 -11.459 1.00 0.00 H new ATOM 1264 N ARG A 83 4.917 7.636 -10.163 1.00 0.00 N ATOM 1265 CA ARG A 83 5.790 7.692 -8.965 1.00 0.00 C ATOM 1266 C ARG A 83 5.973 6.281 -8.428 1.00 0.00 C ATOM 1267 O ARG A 83 5.308 5.355 -8.851 1.00 0.00 O ATOM 1268 CB ARG A 83 5.169 8.595 -7.894 1.00 0.00 C ATOM 1269 CG ARG A 83 5.191 10.050 -8.372 1.00 0.00 C ATOM 1270 CD ARG A 83 6.640 10.497 -8.602 1.00 0.00 C ATOM 1271 NE ARG A 83 6.863 11.823 -7.965 1.00 0.00 N ATOM 1272 CZ ARG A 83 7.235 11.886 -6.717 1.00 0.00 C ATOM 1273 NH1 ARG A 83 7.368 10.792 -6.021 1.00 0.00 N ATOM 1274 NH2 ARG A 83 7.467 13.044 -6.164 1.00 0.00 N ATOM 0 H ARG A 83 4.193 6.918 -10.144 1.00 0.00 H new ATOM 0 HA ARG A 83 6.760 8.110 -9.236 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.144 8.284 -7.691 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.722 8.500 -6.959 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.619 10.148 -9.295 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.715 10.693 -7.632 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.328 9.762 -8.184 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.847 10.557 -9.670 1.00 0.00 H new ATOM 0 HE ARG A 83 6.725 12.679 -8.502 1.00 0.00 H new ATOM 0 HH11 ARG A 83 7.181 9.887 -6.453 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.659 10.841 -5.045 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.357 13.900 -6.708 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.758 13.094 -5.188 1.00 0.00 H new ATOM 1288 N GLU A 84 6.880 6.095 -7.518 1.00 0.00 N ATOM 1289 CA GLU A 84 7.103 4.730 -6.989 1.00 0.00 C ATOM 1290 C GLU A 84 6.122 4.434 -5.859 1.00 0.00 C ATOM 1291 O GLU A 84 6.281 4.879 -4.739 1.00 0.00 O ATOM 1292 CB GLU A 84 8.535 4.610 -6.473 1.00 0.00 C ATOM 1293 CG GLU A 84 9.510 4.790 -7.639 1.00 0.00 C ATOM 1294 CD GLU A 84 9.786 6.280 -7.856 1.00 0.00 C ATOM 1295 OE1 GLU A 84 9.257 7.078 -7.100 1.00 0.00 O ATOM 1296 OE2 GLU A 84 10.520 6.596 -8.777 1.00 0.00 O ATOM 0 H GLU A 84 7.472 6.824 -7.120 1.00 0.00 H new ATOM 0 HA GLU A 84 6.943 4.009 -7.791 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.722 5.363 -5.708 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.685 3.637 -6.006 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.442 4.264 -7.431 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.093 4.352 -8.546 1.00 0.00 H new ATOM 1304 N LEU A 85 5.121 3.650 -6.149 1.00 0.00 N ATOM 1305 CA LEU A 85 4.130 3.273 -5.108 1.00 0.00 C ATOM 1306 C LEU A 85 4.791 2.219 -4.220 1.00 0.00 C ATOM 1307 O LEU A 85 5.384 1.282 -4.710 1.00 0.00 O ATOM 1308 CB LEU A 85 2.898 2.664 -5.792 1.00 0.00 C ATOM 1309 CG LEU A 85 1.641 2.931 -4.952 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.790 4.019 -5.606 1.00 0.00 C ATOM 1311 CD2 LEU A 85 0.801 1.657 -4.851 1.00 0.00 C ATOM 0 H LEU A 85 4.947 3.252 -7.072 1.00 0.00 H new ATOM 0 HA LEU A 85 3.822 4.138 -4.521 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.777 3.091 -6.787 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.037 1.591 -5.921 1.00 0.00 H new ATOM 0 HG LEU A 85 1.955 3.253 -3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.098 4.199 -5.001 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.370 4.939 -5.681 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.490 3.696 -6.603 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.089 1.854 -4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.504 1.337 -5.850 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.389 0.870 -4.378 1.00 0.00 H new ATOM 1323 N ASN A 86 4.734 2.365 -2.927 1.00 0.00 N ATOM 1324 CA ASN A 86 5.402 1.360 -2.051 1.00 0.00 C ATOM 1325 C ASN A 86 4.453 0.894 -0.948 1.00 0.00 C ATOM 1326 O ASN A 86 3.803 1.686 -0.295 1.00 0.00 O ATOM 1327 CB ASN A 86 6.649 1.991 -1.429 1.00 0.00 C ATOM 1328 CG ASN A 86 7.553 2.510 -2.548 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.311 2.145 -3.780 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 8.486 3.249 -2.302 1.00 0.00 N flip ATOM 0 H ASN A 86 4.260 3.127 -2.441 1.00 0.00 H new ATOM 0 HA ASN A 86 5.683 0.494 -2.650 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.367 2.807 -0.764 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.181 1.257 -0.825 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.672 3.532 -1.340 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.083 3.586 -3.058 1.00 0.00 H new ATOM 1480 N THR A 95 9.178 -1.671 -3.682 1.00 0.00 N ATOM 1481 CA THR A 95 8.791 -0.447 -4.431 1.00 0.00 C ATOM 1482 C THR A 95 7.887 -0.820 -5.602 1.00 0.00 C ATOM 1483 O THR A 95 8.096 -1.805 -6.281 1.00 0.00 O ATOM 1484 CB THR A 95 10.036 0.268 -4.960 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.553 1.126 -3.955 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.659 1.090 -6.199 1.00 0.00 C ATOM 0 HA THR A 95 8.256 0.220 -3.755 1.00 0.00 H new ATOM 0 HB THR A 95 10.795 -0.467 -5.229 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.351 1.583 -4.294 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.543 1.601 -6.579 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.264 0.427 -6.969 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.902 1.826 -5.930 1.00 0.00 H new ATOM 1494 N VAL A 96 6.883 -0.027 -5.840 1.00 0.00 N ATOM 1495 CA VAL A 96 5.948 -0.306 -6.960 1.00 0.00 C ATOM 1496 C VAL A 96 5.684 0.996 -7.726 1.00 0.00 C ATOM 1497 O VAL A 96 5.398 2.010 -7.136 1.00 0.00 O ATOM 1498 CB VAL A 96 4.640 -0.839 -6.380 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.591 -0.948 -7.485 1.00 0.00 C ATOM 1500 CG2 VAL A 96 4.882 -2.221 -5.767 1.00 0.00 C ATOM 0 H VAL A 96 6.669 0.811 -5.300 1.00 0.00 H new ATOM 0 HA VAL A 96 6.376 -1.043 -7.640 1.00 0.00 H new ATOM 0 HB VAL A 96 4.281 -0.155 -5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.660 -1.329 -7.066 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.418 0.036 -7.920 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.946 -1.629 -8.258 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.949 -2.603 -5.352 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.243 -2.903 -6.537 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.626 -2.142 -4.974 1.00 0.00 H new ATOM 1510 N ILE A 97 5.774 0.982 -9.029 1.00 0.00 N ATOM 1511 CA ILE A 97 5.521 2.242 -9.795 1.00 0.00 C ATOM 1512 C ILE A 97 4.145 2.158 -10.455 1.00 0.00 C ATOM 1513 O ILE A 97 3.783 1.154 -11.032 1.00 0.00 O ATOM 1514 CB ILE A 97 6.604 2.428 -10.858 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.940 1.943 -10.297 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.722 3.915 -11.214 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.084 2.624 -11.045 1.00 0.00 C ATOM 0 H ILE A 97 6.009 0.165 -9.593 1.00 0.00 H new ATOM 0 HA ILE A 97 5.546 3.096 -9.118 1.00 0.00 H new ATOM 0 HB ILE A 97 6.343 1.858 -11.750 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.003 2.168 -9.232 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.018 0.861 -10.399 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.494 4.048 -11.972 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.768 4.273 -11.601 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.988 4.483 -10.322 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.037 2.278 -10.645 1.00 0.00 H new ATOM 0 HD12 ILE A 97 9.024 2.376 -12.105 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.009 3.704 -10.920 1.00 0.00 H new ATOM 1529 N TYR A 98 3.368 3.200 -10.339 1.00 0.00 N ATOM 1530 CA TYR A 98 1.987 3.186 -10.910 1.00 0.00 C ATOM 1531 C TYR A 98 1.835 4.248 -12.017 1.00 0.00 C ATOM 1532 O TYR A 98 2.195 5.395 -11.850 1.00 0.00 O ATOM 1533 CB TYR A 98 1.014 3.507 -9.767 1.00 0.00 C ATOM 1534 CG TYR A 98 0.584 2.255 -9.016 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.219 1.013 -9.215 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.467 2.353 -8.100 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.793 -0.114 -8.496 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.886 1.230 -7.383 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.258 -0.004 -7.582 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.669 -1.109 -6.865 1.00 0.00 O ATOM 0 H TYR A 98 3.631 4.067 -9.870 1.00 0.00 H new ATOM 0 HA TYR A 98 1.781 2.210 -11.349 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.487 4.202 -9.073 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.134 4.008 -10.170 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.033 0.929 -9.920 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.958 3.302 -7.946 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.278 -1.067 -8.649 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.696 1.315 -6.674 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.231 -0.822 -6.115 1.00 0.00 H new ATOM 1550 N TRP A 99 1.283 3.859 -13.143 1.00 0.00 N ATOM 1551 CA TRP A 99 1.072 4.822 -14.273 1.00 0.00 C ATOM 1552 C TRP A 99 -0.421 4.913 -14.586 1.00 0.00 C ATOM 1553 O TRP A 99 -1.177 4.007 -14.306 1.00 0.00 O ATOM 1554 CB TRP A 99 1.788 4.330 -15.529 1.00 0.00 C ATOM 1555 CG TRP A 99 3.217 4.735 -15.493 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.690 5.942 -15.868 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.365 3.952 -15.077 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.062 5.951 -15.708 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.525 4.746 -15.218 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.507 2.644 -14.594 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.789 4.256 -14.889 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.775 2.144 -14.264 1.00 0.00 C ATOM 1563 CH2 TRP A 99 6.914 2.948 -14.410 1.00 0.00 C ATOM 0 H TRP A 99 0.967 2.907 -13.329 1.00 0.00 H new ATOM 0 HA TRP A 99 1.467 5.794 -13.979 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.711 3.245 -15.600 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.307 4.742 -16.416 1.00 0.00 H new ATOM 0 HD1 TRP A 99 3.094 6.765 -16.233 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.659 6.749 -15.925 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.635 2.018 -14.475 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.663 4.881 -15.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 5.875 1.134 -13.895 1.00 0.00 H new ATOM 0 HH2 TRP A 99 7.888 2.558 -14.153 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.850 5.986 -15.191 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.293 6.100 -15.544 1.00 0.00 C ATOM 1576 C LEU A 100 -2.541 5.385 -16.868 1.00 0.00 C ATOM 1577 O LEU A 100 -1.761 5.480 -17.795 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.692 7.572 -15.677 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.748 8.228 -14.298 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -3.106 9.707 -14.461 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.828 7.546 -13.456 1.00 0.00 C ATOM 0 H LEU A 100 -0.270 6.782 -15.454 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.891 5.643 -14.756 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.974 8.096 -16.308 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.663 7.651 -16.165 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.780 8.130 -13.807 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.148 10.181 -13.481 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.349 10.200 -15.071 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.077 9.795 -14.948 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.870 8.012 -12.472 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.794 7.651 -13.949 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.590 6.488 -13.347 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.627 4.669 -16.964 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.933 3.944 -18.226 1.00 0.00 C ATOM 1595 C ALA A 101 -5.441 3.961 -18.458 1.00 0.00 C ATOM 1596 O ALA A 101 -6.222 3.881 -17.531 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.450 2.494 -18.114 1.00 0.00 C ATOM 0 H ALA A 101 -4.316 4.555 -16.221 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.426 4.429 -19.060 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.675 1.963 -19.039 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.374 2.481 -17.940 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.957 2.005 -17.283 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.856 4.063 -19.687 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.314 4.083 -19.983 1.00 0.00 C ATOM 1605 C GLU A 102 -7.635 2.999 -21.006 1.00 0.00 C ATOM 1606 O GLU A 102 -6.969 2.867 -22.012 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.698 5.449 -20.554 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.205 5.490 -20.809 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.573 6.815 -21.479 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -8.693 7.647 -21.627 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -10.729 6.971 -21.841 1.00 0.00 O ATOM 0 H GLU A 102 -5.247 4.134 -20.502 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.876 3.900 -19.067 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.415 6.239 -19.858 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.156 5.632 -21.482 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.500 4.655 -21.444 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.747 5.383 -19.869 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.651 2.223 -20.764 1.00 0.00 N ATOM 1620 CA VAL A 103 -9.000 1.155 -21.739 1.00 0.00 C ATOM 1621 C VAL A 103 -9.893 1.737 -22.829 1.00 0.00 C ATOM 1622 O VAL A 103 -11.042 2.050 -22.602 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.745 0.018 -21.033 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.807 -0.694 -20.064 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.929 0.577 -20.249 1.00 0.00 C ATOM 0 H VAL A 103 -9.251 2.280 -19.941 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.083 0.764 -22.179 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.101 -0.684 -21.786 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.343 -1.501 -19.565 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.960 -1.106 -20.613 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.446 0.016 -19.320 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.453 -0.239 -19.750 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.570 1.287 -19.504 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.612 1.083 -20.932 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.382 1.861 -24.020 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.222 2.398 -25.119 1.00 0.00 C ATOM 1637 C LYS A 104 -11.302 1.366 -25.412 1.00 0.00 C ATOM 1638 O LYS A 104 -12.232 1.604 -26.158 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.356 2.630 -26.356 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.765 1.300 -26.823 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.680 1.565 -27.866 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.472 2.219 -27.190 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.227 1.822 -27.907 1.00 0.00 N ATOM 0 H LYS A 104 -8.426 1.615 -24.277 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.675 3.349 -24.839 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.953 3.074 -27.152 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.557 3.334 -26.126 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.345 0.758 -25.975 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.547 0.671 -27.248 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.382 0.631 -28.342 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.066 2.214 -28.652 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.580 3.304 -27.199 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.416 1.913 -26.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.418 2.344 -27.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.070 0.801 -27.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.323 2.044 -28.919 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.186 0.220 -24.798 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.199 -0.847 -24.998 1.00 0.00 C ATOM 1659 C ASP A 105 -13.139 -0.861 -23.795 1.00 0.00 C ATOM 1660 O ASP A 105 -12.832 -1.424 -22.760 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.498 -2.204 -25.107 1.00 0.00 C ATOM 1662 CG ASP A 105 -10.904 -2.368 -26.507 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -11.187 -1.537 -27.354 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -10.171 -3.324 -26.709 1.00 0.00 O ATOM 0 H ASP A 105 -10.426 -0.021 -24.162 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.762 -0.657 -25.912 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.711 -2.279 -24.357 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.207 -3.007 -24.906 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.283 -0.255 -23.921 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.240 -0.244 -22.785 1.00 0.00 C ATOM 1672 C TYR A 106 -15.491 -1.693 -22.375 1.00 0.00 C ATOM 1673 O TYR A 106 -15.740 -1.997 -21.226 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.555 0.409 -23.232 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.442 0.668 -22.034 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.258 -0.353 -21.531 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.460 1.936 -21.437 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -19.090 -0.107 -20.429 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.290 2.181 -20.334 1.00 0.00 C ATOM 1680 CZ TYR A 106 -19.105 1.159 -19.831 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.925 1.402 -18.747 1.00 0.00 O ATOM 0 H TYR A 106 -14.596 0.233 -24.760 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.838 0.322 -21.945 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.347 1.346 -23.749 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.069 -0.240 -23.941 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.247 -1.330 -21.992 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.834 2.725 -21.827 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.719 -0.894 -20.041 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.301 3.157 -19.872 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.813 2.330 -18.453 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.424 -2.584 -23.321 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.650 -4.024 -23.024 1.00 0.00 C ATOM 1693 C ASP A 107 -14.306 -4.757 -22.977 1.00 0.00 C ATOM 1694 O ASP A 107 -14.228 -5.937 -23.255 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.526 -4.633 -24.120 1.00 0.00 C ATOM 1696 CG ASP A 107 -17.926 -4.021 -24.050 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.224 -3.382 -23.053 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -18.678 -4.202 -24.994 1.00 0.00 O ATOM 0 H ASP A 107 -15.220 -2.374 -24.298 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.148 -4.123 -22.059 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.084 -4.447 -25.099 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -16.583 -5.714 -23.996 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.246 -4.069 -22.641 1.00 0.00 N ATOM 1705 CA VAL A 108 -11.915 -4.738 -22.590 1.00 0.00 C ATOM 1706 C VAL A 108 -12.061 -6.101 -21.922 1.00 0.00 C ATOM 1707 O VAL A 108 -12.912 -6.301 -21.078 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.930 -3.875 -21.801 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.499 -3.579 -20.415 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.600 -4.614 -21.663 1.00 0.00 C ATOM 0 H VAL A 108 -13.245 -3.078 -22.401 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.536 -4.870 -23.603 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.769 -2.936 -22.331 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.794 -2.964 -19.856 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.445 -3.046 -20.516 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.665 -4.515 -19.882 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.898 -3.998 -21.100 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.760 -5.555 -21.137 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.192 -4.817 -22.653 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.245 -7.043 -22.300 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.350 -8.392 -21.695 1.00 0.00 C ATOM 1722 C GLU A 109 -10.402 -8.494 -20.507 1.00 0.00 C ATOM 1723 O GLU A 109 -9.198 -8.565 -20.656 1.00 0.00 O ATOM 1724 CB GLU A 109 -10.985 -9.455 -22.734 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.262 -10.842 -22.154 1.00 0.00 C ATOM 1726 CD GLU A 109 -12.772 -11.055 -22.036 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.501 -10.414 -22.774 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.173 -11.858 -21.209 1.00 0.00 O ATOM 0 H GLU A 109 -10.512 -6.935 -23.001 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.374 -8.555 -21.358 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.566 -9.306 -23.644 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -9.934 -9.366 -23.009 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.825 -11.609 -22.794 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.793 -10.938 -21.175 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.948 -8.511 -19.331 1.00 0.00 N ATOM 1737 CA ILE A 110 -10.100 -8.619 -18.114 1.00 0.00 C ATOM 1738 C ILE A 110 -9.735 -10.083 -17.885 1.00 0.00 C ATOM 1739 O ILE A 110 -10.429 -10.807 -17.200 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.868 -8.099 -16.898 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.249 -6.631 -17.101 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.990 -8.229 -15.655 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.007 -5.764 -17.072 1.00 0.00 C ATOM 0 H ILE A 110 -11.951 -8.455 -19.156 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.196 -8.026 -18.252 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.778 -8.686 -16.773 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.765 -6.509 -18.053 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.941 -6.315 -16.320 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -10.533 -7.859 -14.785 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.729 -9.276 -15.502 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.080 -7.644 -15.790 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.288 -4.721 -17.217 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.508 -5.875 -16.109 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.330 -6.072 -17.869 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.647 -10.524 -18.447 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.242 -11.945 -18.250 1.00 0.00 C ATOM 1757 C ARG A 111 -7.243 -12.036 -17.108 1.00 0.00 C ATOM 1758 O ARG A 111 -6.193 -11.426 -17.133 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.609 -12.491 -19.527 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.695 -13.124 -20.389 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.220 -13.194 -21.840 1.00 0.00 C ATOM 1762 NE ARG A 111 -6.973 -14.007 -21.912 1.00 0.00 N ATOM 1763 CZ ARG A 111 -6.725 -14.736 -22.966 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.565 -14.749 -23.966 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -5.635 -15.450 -23.020 1.00 0.00 N ATOM 0 H ARG A 111 -8.023 -9.968 -19.031 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.126 -12.536 -18.010 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.114 -11.689 -20.074 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.845 -13.229 -19.283 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.928 -14.124 -20.023 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.613 -12.539 -20.324 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -8.994 -13.638 -22.467 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.036 -12.190 -22.223 1.00 0.00 H new ATOM 0 HE ARG A 111 -6.312 -13.994 -21.136 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -8.416 -14.189 -23.924 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -7.370 -15.319 -24.789 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -4.978 -15.438 -22.240 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -5.439 -16.020 -23.843 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.561 -12.796 -16.104 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.627 -12.923 -14.957 1.00 0.00 C ATOM 1781 C LEU A 112 -5.801 -14.195 -15.127 1.00 0.00 C ATOM 1782 O LEU A 112 -6.297 -15.294 -14.976 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.424 -13.020 -13.656 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.577 -12.018 -13.685 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.329 -12.068 -12.353 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.026 -10.609 -13.911 1.00 0.00 C ATOM 0 H LEU A 112 -8.424 -13.334 -16.027 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.973 -12.052 -14.922 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.811 -14.031 -13.529 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.775 -12.818 -12.804 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.259 -12.272 -14.496 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.152 -11.353 -12.373 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.724 -13.072 -12.195 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.648 -11.815 -11.541 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.850 -9.895 -13.931 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.343 -10.351 -13.102 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.493 -10.575 -14.861 1.00 0.00 H new ATOM 1798 N SER A 113 -4.542 -14.060 -15.432 1.00 0.00 N ATOM 1799 CA SER A 113 -3.690 -15.266 -15.597 1.00 0.00 C ATOM 1800 C SER A 113 -3.472 -15.902 -14.223 1.00 0.00 C ATOM 1801 O SER A 113 -3.716 -15.286 -13.205 1.00 0.00 O ATOM 1802 CB SER A 113 -2.343 -14.866 -16.199 1.00 0.00 C ATOM 1803 OG SER A 113 -2.555 -14.298 -17.483 1.00 0.00 O ATOM 0 H SER A 113 -4.068 -13.168 -15.574 1.00 0.00 H new ATOM 0 HA SER A 113 -4.177 -15.978 -16.263 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.840 -14.149 -15.550 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.693 -15.737 -16.277 1.00 0.00 H new ATOM 0 HG SER A 113 -1.694 -14.038 -17.872 1.00 0.00 H new ATOM 1809 N HIS A 114 -3.024 -17.125 -14.182 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.804 -17.785 -12.865 1.00 0.00 C ATOM 1811 C HIS A 114 -2.219 -16.766 -11.885 1.00 0.00 C ATOM 1812 O HIS A 114 -1.027 -16.519 -11.863 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.831 -18.958 -13.030 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.691 -18.800 -12.063 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -0.654 -18.746 -10.690 1.00 0.00 N flip ATOM 1816 CD2 HIS A 114 0.623 -18.645 -12.483 1.00 0.00 C flip ATOM 1817 CE1 HIS A 114 0.657 -18.558 -10.269 1.00 0.00 C flip ATOM 1818 NE2 HIS A 114 1.386 -18.503 -11.385 1.00 0.00 N flip ATOM 0 H HIS A 114 -2.801 -17.694 -14.999 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.753 -18.160 -12.482 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -2.347 -19.901 -12.850 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.454 -18.991 -14.052 1.00 0.00 H new ATOM 0 HD2 HIS A 114 0.970 -18.639 -13.506 1.00 0.00 H new ATOM 0 HE1 HIS A 114 1.011 -18.474 -9.252 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.397 -18.370 -11.403 1.00 0.00 H new ATOM 1827 N GLU A 115 -3.045 -16.161 -11.078 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.535 -15.154 -10.104 1.00 0.00 C ATOM 1829 C GLU A 115 -3.717 -14.488 -9.401 1.00 0.00 C ATOM 1830 O GLU A 115 -3.878 -14.588 -8.200 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.730 -14.084 -10.846 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.435 -13.805 -10.085 1.00 0.00 C ATOM 1833 CD GLU A 115 0.381 -12.757 -10.842 1.00 0.00 C ATOM 1834 OE1 GLU A 115 0.032 -12.472 -11.975 1.00 0.00 O ATOM 1835 OE2 GLU A 115 1.339 -12.257 -10.276 1.00 0.00 O ATOM 0 H GLU A 115 -4.052 -16.320 -11.050 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.898 -15.650 -9.372 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.505 -14.419 -11.858 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.316 -13.169 -10.936 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.660 -13.450 -9.079 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.142 -14.723 -9.977 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.542 -13.806 -10.146 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.715 -13.124 -9.537 1.00 0.00 C ATOM 1845 C HIS A 116 -7.003 -13.810 -9.997 1.00 0.00 C ATOM 1846 O HIS A 116 -7.151 -14.168 -11.148 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.743 -11.659 -9.984 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.612 -10.909 -9.337 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.306 -10.992 -9.799 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.579 -10.048 -8.267 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.548 -10.202 -9.014 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.277 -9.606 -8.068 1.00 0.00 N ATOM 0 H HIS A 116 -4.452 -13.692 -11.156 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.638 -13.178 -8.451 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.658 -11.598 -11.069 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.696 -11.204 -9.713 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.433 -9.759 -7.672 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.483 -10.068 -9.135 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.947 -8.961 -7.350 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.940 -13.993 -9.106 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.221 -14.648 -9.493 1.00 0.00 C ATOM 1863 C GLN A 117 -10.375 -13.670 -9.266 1.00 0.00 C ATOM 1864 O GLN A 117 -11.529 -14.049 -9.266 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.437 -15.902 -8.643 1.00 0.00 C ATOM 1866 CG GLN A 117 -8.289 -16.886 -8.879 1.00 0.00 C ATOM 1867 CD GLN A 117 -8.537 -18.160 -8.071 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.641 -18.412 -7.632 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -7.544 -18.978 -7.847 1.00 0.00 N ATOM 0 H GLN A 117 -7.873 -13.717 -8.126 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.182 -14.931 -10.545 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.488 -15.634 -7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.388 -16.369 -8.900 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -8.212 -17.124 -9.940 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.342 -16.434 -8.584 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -6.617 -18.767 -8.215 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -7.696 -19.828 -7.304 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.075 -12.416 -9.063 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.163 -11.429 -8.827 1.00 0.00 C ATOM 1880 C ALA A 118 -10.780 -10.067 -9.405 1.00 0.00 C ATOM 1881 O ALA A 118 -9.683 -9.585 -9.206 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.387 -11.273 -7.323 1.00 0.00 C ATOM 0 H ALA A 118 -9.129 -12.035 -9.051 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.071 -11.787 -9.313 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.184 -10.550 -7.147 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.669 -12.235 -6.895 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.468 -10.922 -6.853 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.690 -9.430 -10.091 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.403 -8.081 -10.650 1.00 0.00 C ATOM 1890 C TYR A 119 -12.717 -7.310 -10.767 1.00 0.00 C ATOM 1891 O TYR A 119 -13.736 -7.862 -11.130 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.727 -8.206 -12.019 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.730 -8.570 -13.081 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.059 -9.910 -13.297 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.312 -7.568 -13.866 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -12.982 -10.252 -14.291 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.235 -7.907 -14.861 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.569 -9.251 -15.076 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.480 -9.587 -16.058 1.00 0.00 O ATOM 0 H TYR A 119 -12.624 -9.789 -10.288 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.723 -7.543 -9.989 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.243 -7.264 -12.278 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.946 -8.965 -11.976 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.601 -10.682 -12.697 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -12.049 -6.533 -13.704 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.242 -11.288 -14.453 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.690 -7.134 -15.463 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.791 -8.774 -16.508 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.714 -6.045 -10.443 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.981 -5.264 -10.517 1.00 0.00 C ATOM 1911 C ARG A 120 -13.701 -3.843 -11.002 1.00 0.00 C ATOM 1912 O ARG A 120 -12.652 -3.286 -10.755 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.593 -5.150 -9.120 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.829 -6.530 -8.510 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.159 -6.366 -7.019 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.573 -6.757 -6.775 1.00 0.00 N ATOM 1917 CZ ARG A 120 -16.954 -7.980 -7.003 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.094 -8.852 -7.453 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.189 -8.333 -6.785 1.00 0.00 N ATOM 0 H ARG A 120 -11.895 -5.522 -10.132 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.655 -5.776 -11.204 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.931 -4.572 -8.475 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.537 -4.607 -9.176 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.648 -7.034 -9.024 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.943 -7.153 -8.634 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.491 -6.984 -6.418 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.999 -5.332 -6.712 1.00 0.00 H new ATOM 0 HE ARG A 120 -17.242 -6.069 -6.430 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.128 -8.574 -7.624 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.388 -9.812 -7.633 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.860 -7.650 -6.435 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -18.484 -9.293 -6.965 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.660 -3.234 -11.640 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.491 -1.826 -12.090 1.00 0.00 C ATOM 1935 C TRP A 121 -15.279 -0.948 -11.110 1.00 0.00 C ATOM 1936 O TRP A 121 -16.494 -0.971 -11.090 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.058 -1.664 -13.503 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.098 -2.220 -14.509 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.122 -3.481 -15.004 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.982 -1.549 -15.158 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.091 -3.621 -15.919 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.359 -2.457 -16.047 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.456 -0.253 -15.061 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.254 -2.084 -16.813 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.344 0.123 -15.829 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.744 -0.791 -16.704 1.00 0.00 C ATOM 0 H TRP A 121 -15.560 -3.655 -11.870 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.439 -1.543 -12.110 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.016 -2.178 -13.580 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.244 -0.610 -13.710 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.829 -4.251 -14.730 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.896 -4.479 -16.435 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.910 0.461 -14.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.796 -2.793 -17.487 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.948 1.124 -15.745 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.888 -0.495 -17.293 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.606 -0.211 -10.263 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.340 0.613 -9.253 1.00 0.00 C ATOM 1959 C LEU A 122 -14.895 2.075 -9.301 1.00 0.00 C ATOM 1960 O LEU A 122 -13.993 2.444 -10.022 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.061 0.072 -7.848 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.547 -1.369 -7.918 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.168 -1.444 -7.270 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.510 -2.293 -7.172 1.00 0.00 C ATOM 0 H LEU A 122 -13.589 -0.144 -10.226 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.403 0.556 -9.486 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.325 0.703 -7.349 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -15.972 0.111 -7.250 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.480 -1.681 -8.960 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.799 -2.468 -7.318 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.480 -0.785 -7.800 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.238 -1.132 -6.228 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.143 -3.318 -7.223 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.578 -1.983 -6.129 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.497 -2.238 -7.632 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.534 2.910 -8.520 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.168 4.353 -8.497 1.00 0.00 C ATOM 1978 C GLY A 123 -14.019 4.588 -7.509 1.00 0.00 C ATOM 1979 O GLY A 123 -13.501 3.669 -6.906 1.00 0.00 O ATOM 0 H GLY A 123 -16.297 2.649 -7.895 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.872 4.677 -9.495 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.033 4.951 -8.210 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.619 5.821 -7.351 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.501 6.149 -6.416 1.00 0.00 C ATOM 1985 C LEU A 124 -12.822 5.700 -4.990 1.00 0.00 C ATOM 1986 O LEU A 124 -12.009 5.092 -4.325 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.293 7.663 -6.426 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.321 8.072 -5.318 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.060 7.212 -5.381 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.937 9.540 -5.510 1.00 0.00 C ATOM 0 H LEU A 124 -14.022 6.624 -7.834 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.602 5.627 -6.744 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.904 7.977 -7.395 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.248 8.169 -6.286 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.800 7.931 -4.349 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.375 7.512 -4.588 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.328 6.163 -5.252 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.576 7.346 -6.348 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.244 9.841 -4.724 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.461 9.667 -6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.832 10.160 -5.461 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.988 6.009 -4.504 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.324 5.612 -3.109 1.00 0.00 C ATOM 2004 C GLU A 125 -14.267 4.089 -2.965 1.00 0.00 C ATOM 2005 O GLU A 125 -13.615 3.572 -2.080 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.719 6.123 -2.752 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.781 5.182 -3.317 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.162 5.818 -3.152 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -19.128 5.209 -3.578 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.230 6.906 -2.604 1.00 0.00 O ATOM 0 H GLU A 125 -14.718 6.515 -5.005 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.597 6.053 -2.427 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.823 6.194 -1.669 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.861 7.127 -3.152 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.583 4.983 -4.370 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.746 4.223 -2.800 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.932 3.358 -3.820 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.884 1.874 -3.704 1.00 0.00 C ATOM 2020 C GLU A 126 -13.459 1.399 -3.964 1.00 0.00 C ATOM 2021 O GLU A 126 -12.996 0.441 -3.384 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.833 1.231 -4.713 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.804 -0.282 -4.536 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.061 -0.893 -5.157 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.791 -0.163 -5.809 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.278 -2.077 -4.963 1.00 0.00 O ATOM 0 H GLU A 126 -15.500 3.721 -4.585 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.194 1.583 -2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.846 1.607 -4.568 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.537 1.496 -5.728 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -14.914 -0.697 -5.008 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.750 -0.534 -3.477 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.753 2.064 -4.828 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.354 1.651 -5.104 1.00 0.00 C ATOM 2036 C ALA A 127 -10.492 1.991 -3.886 1.00 0.00 C ATOM 2037 O ALA A 127 -9.482 1.367 -3.628 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.832 2.408 -6.325 1.00 0.00 C ATOM 0 H ALA A 127 -13.082 2.873 -5.354 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.314 0.580 -5.301 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.805 2.106 -6.529 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.456 2.179 -7.189 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.863 3.480 -6.129 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.885 2.994 -3.147 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.100 3.409 -1.950 1.00 0.00 C ATOM 2046 C CYS A 128 -10.175 2.335 -0.858 1.00 0.00 C ATOM 2047 O CYS A 128 -9.193 2.032 -0.210 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.668 4.727 -1.415 1.00 0.00 C ATOM 2049 SG CYS A 128 -10.747 4.670 0.392 1.00 0.00 S ATOM 0 H CYS A 128 -11.723 3.548 -3.324 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.056 3.540 -2.235 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.042 5.560 -1.735 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.663 4.899 -1.827 1.00 0.00 H new ATOM 0 HG CYS A 128 -11.821 4.036 0.760 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.326 1.757 -0.638 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.428 0.712 0.426 1.00 0.00 C ATOM 2057 C GLN A 129 -10.634 -0.525 0.009 1.00 0.00 C ATOM 2058 O GLN A 129 -9.835 -1.046 0.760 1.00 0.00 O ATOM 2059 CB GLN A 129 -12.892 0.306 0.653 1.00 0.00 C ATOM 2060 CG GLN A 129 -13.752 0.719 -0.540 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.401 2.072 -0.252 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -13.705 2.993 0.353 1.00 0.00 O flip ATOM 2063 NE2 GLN A 129 -15.551 2.293 -0.578 1.00 0.00 N flip ATOM 0 H GLN A 129 -12.190 1.959 -1.141 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.025 1.126 1.350 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -12.958 -0.772 0.801 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.269 0.776 1.561 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.140 0.781 -1.440 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.519 -0.032 -0.727 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.095 1.571 -1.051 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -15.972 3.200 -0.378 1.00 0.00 H new ATOM 2072 N LEU A 130 -10.855 -1.001 -1.182 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.127 -2.211 -1.649 1.00 0.00 C ATOM 2074 C LEU A 130 -8.620 -1.935 -1.684 1.00 0.00 C ATOM 2075 O LEU A 130 -7.818 -2.773 -1.322 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.594 -2.551 -3.062 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.122 -2.594 -3.123 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.554 -2.791 -4.570 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.655 -3.758 -2.293 1.00 0.00 C ATOM 0 H LEU A 130 -11.511 -0.603 -1.855 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.329 -3.038 -0.968 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.216 -1.809 -3.765 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.184 -3.515 -3.365 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.518 -1.659 -2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.642 -2.823 -4.624 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.185 -1.963 -5.176 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.144 -3.728 -4.948 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.744 -3.775 -2.347 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.258 -4.695 -2.683 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.345 -3.637 -1.255 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.225 -0.774 -2.129 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.770 -0.460 -2.201 1.00 0.00 C ATOM 2093 C ALA A 131 -6.123 -0.680 -0.830 1.00 0.00 C ATOM 2094 O ALA A 131 -5.071 -1.279 -0.722 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.596 0.994 -2.635 1.00 0.00 C ATOM 0 H ALA A 131 -8.846 -0.030 -2.446 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.287 -1.116 -2.925 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.534 1.233 -2.690 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -7.052 1.138 -3.615 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.078 1.650 -1.910 1.00 0.00 H new ATOM 2101 N GLN A 132 -6.757 -0.231 0.218 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.203 -0.444 1.590 1.00 0.00 C ATOM 2103 C GLN A 132 -4.807 0.188 1.742 1.00 0.00 C ATOM 2104 O GLN A 132 -4.289 0.285 2.836 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.115 -1.957 1.846 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.576 -2.230 3.252 1.00 0.00 C ATOM 2107 CD GLN A 132 -6.597 -1.764 4.292 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -7.731 -2.203 4.287 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -6.241 -0.886 5.189 1.00 0.00 N ATOM 0 H GLN A 132 -7.641 0.278 0.185 1.00 0.00 H new ATOM 0 HA GLN A 132 -6.862 0.035 2.314 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.100 -2.409 1.733 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -5.465 -2.421 1.104 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -5.376 -3.294 3.375 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.630 -1.709 3.397 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.290 -0.518 5.193 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -6.914 -0.568 5.886 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.185 0.610 0.675 1.00 0.00 N ATOM 2119 CA PHE A 133 -2.820 1.211 0.812 1.00 0.00 C ATOM 2120 C PHE A 133 -2.886 2.737 0.636 1.00 0.00 C ATOM 2121 O PHE A 133 -3.598 3.246 -0.207 1.00 0.00 O ATOM 2122 CB PHE A 133 -1.903 0.591 -0.240 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.368 -0.821 -0.512 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.419 -1.742 0.540 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -2.764 -1.208 -1.805 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.860 -3.048 0.308 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.204 -2.519 -2.034 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.253 -3.436 -0.977 1.00 0.00 C ATOM 0 H PHE A 133 -4.553 0.568 -0.275 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.426 1.005 1.807 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -1.926 1.180 -1.157 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -0.871 0.589 0.111 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -2.117 -1.443 1.533 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -2.729 -0.498 -2.618 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.897 -3.758 1.121 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -3.505 -2.822 -3.026 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.595 -4.445 -1.154 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.157 3.468 1.448 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.184 4.964 1.358 1.00 0.00 C ATOM 2140 C LYS A 134 -1.602 5.447 0.026 1.00 0.00 C ATOM 2141 O LYS A 134 -2.232 6.201 -0.690 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.377 5.554 2.520 1.00 0.00 C ATOM 2143 CG LYS A 134 0.112 5.239 2.341 1.00 0.00 C ATOM 2144 CD LYS A 134 0.873 5.635 3.608 1.00 0.00 C ATOM 2145 CE LYS A 134 2.381 5.564 3.351 1.00 0.00 C ATOM 2146 NZ LYS A 134 3.029 6.818 3.827 1.00 0.00 N ATOM 0 H LYS A 134 -1.543 3.092 2.171 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.220 5.298 1.416 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.525 6.633 2.565 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -1.732 5.143 3.465 1.00 0.00 H new ATOM 0 HG2 LYS A 134 0.248 4.177 2.139 1.00 0.00 H new ATOM 0 HG3 LYS A 134 0.508 5.780 1.482 1.00 0.00 H new ATOM 0 HD2 LYS A 134 0.594 6.644 3.911 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.603 4.970 4.428 1.00 0.00 H new ATOM 0 HE2 LYS A 134 2.808 4.704 3.867 1.00 0.00 H new ATOM 0 HE3 LYS A 134 2.573 5.425 2.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 4.053 6.768 3.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 2.630 7.631 3.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.858 6.932 4.846 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.416 5.029 -0.326 1.00 0.00 N ATOM 2161 CA GLU A 135 0.161 5.490 -1.620 1.00 0.00 C ATOM 2162 C GLU A 135 -0.803 5.082 -2.726 1.00 0.00 C ATOM 2163 O GLU A 135 -1.021 5.804 -3.677 1.00 0.00 O ATOM 2164 CB GLU A 135 1.529 4.840 -1.845 1.00 0.00 C ATOM 2165 CG GLU A 135 2.482 5.255 -0.721 1.00 0.00 C ATOM 2166 CD GLU A 135 3.898 4.779 -1.048 1.00 0.00 C ATOM 2167 OE1 GLU A 135 4.734 4.806 -0.157 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.125 4.407 -2.186 1.00 0.00 O ATOM 0 H GLU A 135 0.171 4.397 0.218 1.00 0.00 H new ATOM 0 HA GLU A 135 0.298 6.571 -1.615 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.428 3.755 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.934 5.144 -2.810 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.470 6.338 -0.602 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.153 4.826 0.226 1.00 0.00 H new ATOM 2176 N MET A 136 -1.399 3.935 -2.584 1.00 0.00 N ATOM 2177 CA MET A 136 -2.379 3.458 -3.595 1.00 0.00 C ATOM 2178 C MET A 136 -3.611 4.366 -3.570 1.00 0.00 C ATOM 2179 O MET A 136 -4.097 4.802 -4.596 1.00 0.00 O ATOM 2180 CB MET A 136 -2.777 2.036 -3.227 1.00 0.00 C ATOM 2181 CG MET A 136 -3.320 1.291 -4.437 1.00 0.00 C ATOM 2182 SD MET A 136 -4.065 2.445 -5.609 1.00 0.00 S ATOM 2183 CE MET A 136 -4.274 1.235 -6.930 1.00 0.00 C ATOM 0 H MET A 136 -1.247 3.299 -1.801 1.00 0.00 H new ATOM 0 HA MET A 136 -1.945 3.480 -4.595 1.00 0.00 H new ATOM 0 HB2 MET A 136 -1.914 1.505 -2.826 1.00 0.00 H new ATOM 0 HB3 MET A 136 -3.531 2.058 -2.440 1.00 0.00 H new ATOM 0 HG2 MET A 136 -2.515 0.739 -4.923 1.00 0.00 H new ATOM 0 HG3 MET A 136 -4.061 0.559 -4.118 1.00 0.00 H new ATOM 0 HE1 MET A 136 -3.646 1.510 -7.778 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.985 0.248 -6.569 1.00 0.00 H new ATOM 0 HE3 MET A 136 -5.318 1.215 -7.243 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.117 4.667 -2.401 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.310 5.556 -2.319 1.00 0.00 C ATOM 2195 C LYS A 137 -4.968 6.888 -2.977 1.00 0.00 C ATOM 2196 O LYS A 137 -5.717 7.406 -3.781 1.00 0.00 O ATOM 2197 CB LYS A 137 -5.689 5.783 -0.853 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.961 6.632 -0.777 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.297 6.924 0.687 1.00 0.00 C ATOM 2200 CE LYS A 137 -8.615 7.698 0.761 1.00 0.00 C ATOM 2201 NZ LYS A 137 -8.851 8.154 2.161 1.00 0.00 N ATOM 0 H LYS A 137 -3.757 4.337 -1.506 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.154 5.094 -2.830 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.848 4.826 -0.356 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -4.874 6.283 -0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -6.820 7.566 -1.321 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -7.789 6.107 -1.253 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.378 5.992 1.246 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.496 7.503 1.147 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -8.583 8.556 0.089 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -9.439 7.065 0.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -9.747 8.680 2.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -8.900 7.328 2.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -8.071 8.773 2.461 1.00 0.00 H new ATOM 2215 N ALA A 138 -3.827 7.437 -2.661 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.428 8.722 -3.289 1.00 0.00 C ATOM 2217 C ALA A 138 -3.173 8.474 -4.776 1.00 0.00 C ATOM 2218 O ALA A 138 -3.447 9.311 -5.612 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.156 9.250 -2.629 1.00 0.00 C ATOM 0 H ALA A 138 -3.157 7.050 -1.996 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.220 9.460 -3.162 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.869 10.193 -3.095 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.337 9.410 -1.566 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.353 8.524 -2.755 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.664 7.318 -5.111 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.408 7.007 -6.544 1.00 0.00 C ATOM 2227 C ALA A 139 -3.731 7.089 -7.301 1.00 0.00 C ATOM 2228 O ALA A 139 -3.824 7.683 -8.355 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.844 5.591 -6.661 1.00 0.00 C ATOM 0 H ALA A 139 -2.416 6.578 -4.454 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.693 7.716 -6.961 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.655 5.360 -7.709 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.911 5.523 -6.101 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.563 4.878 -6.256 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.761 6.506 -6.753 1.00 0.00 N ATOM 2236 CA LEU A 140 -6.089 6.561 -7.417 1.00 0.00 C ATOM 2237 C LEU A 140 -6.622 7.988 -7.333 1.00 0.00 C ATOM 2238 O LEU A 140 -7.178 8.515 -8.277 1.00 0.00 O ATOM 2239 CB LEU A 140 -7.050 5.622 -6.690 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.652 4.171 -6.955 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -7.107 3.302 -5.783 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.335 3.691 -8.235 1.00 0.00 C ATOM 0 H LEU A 140 -4.738 5.993 -5.872 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.999 6.258 -8.460 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.031 5.825 -5.619 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -8.071 5.797 -7.029 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.570 4.099 -7.066 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.825 2.265 -5.968 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.631 3.650 -4.866 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.190 3.370 -5.678 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.055 2.656 -8.430 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.417 3.759 -8.118 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.021 4.316 -9.071 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.450 8.618 -6.202 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.939 10.014 -6.040 1.00 0.00 C ATOM 2256 C GLN A 141 -6.065 10.960 -6.864 1.00 0.00 C ATOM 2257 O GLN A 141 -6.557 11.766 -7.630 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.878 10.398 -4.557 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.281 11.801 -4.400 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.393 12.245 -2.941 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -7.145 11.565 -2.120 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.794 13.224 -2.547 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.990 8.223 -5.382 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.969 10.090 -6.390 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.878 10.370 -4.125 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.274 9.674 -4.010 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.236 11.800 -4.711 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.805 12.505 -5.046 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.206 13.755 -3.190 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -5.878 13.516 -1.573 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.770 10.865 -6.724 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.878 11.757 -7.514 1.00 0.00 C ATOM 2273 C GLU A 142 -4.027 11.405 -8.991 1.00 0.00 C ATOM 2274 O GLU A 142 -4.037 12.266 -9.848 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.428 11.563 -7.065 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.283 12.035 -5.615 1.00 0.00 C ATOM 2277 CD GLU A 142 -0.830 11.873 -5.163 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -0.485 12.433 -4.134 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -0.090 11.189 -5.846 1.00 0.00 O ATOM 0 H GLU A 142 -4.295 10.212 -6.101 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.151 12.800 -7.357 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.146 10.513 -7.148 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.756 12.126 -7.712 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.586 13.079 -5.530 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -2.942 11.458 -4.967 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.170 10.145 -9.296 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.350 9.745 -10.716 1.00 0.00 C ATOM 2289 C GLY A 143 -5.654 10.354 -11.226 1.00 0.00 C ATOM 2290 O GLY A 143 -5.727 10.866 -12.324 1.00 0.00 O ATOM 0 H GLY A 143 -4.170 9.378 -8.624 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.509 10.091 -11.317 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.379 8.659 -10.803 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.681 10.318 -10.419 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.987 10.905 -10.830 1.00 0.00 C ATOM 2296 C HIS A 144 -7.804 12.400 -11.099 1.00 0.00 C ATOM 2297 O HIS A 144 -8.402 12.961 -11.995 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.002 10.720 -9.697 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.097 9.786 -10.136 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.629 8.821 -9.292 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.776 9.665 -11.322 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.586 8.168 -9.978 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.711 8.641 -11.216 1.00 0.00 N ATOM 0 H HIS A 144 -6.670 9.904 -9.487 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.346 10.408 -11.732 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.504 10.321 -8.813 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.426 11.684 -9.416 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.347 8.640 -8.329 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.610 10.270 -12.201 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.179 7.361 -9.574 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.985 13.045 -10.317 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.756 14.507 -10.501 1.00 0.00 C ATOM 2314 C GLN A 145 -6.288 14.794 -11.932 1.00 0.00 C ATOM 2315 O GLN A 145 -6.763 15.707 -12.578 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.680 14.965 -9.516 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.466 16.473 -9.643 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.634 17.210 -8.988 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -6.849 17.097 -7.797 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -7.405 17.968 -9.719 1.00 0.00 N ATOM 0 H GLN A 145 -6.460 12.620 -9.553 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.687 15.044 -10.320 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.977 14.716 -8.497 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.746 14.439 -9.713 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.528 16.759 -9.167 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.389 16.753 -10.694 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -7.226 18.064 -10.719 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -8.186 18.464 -9.291 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.354 14.033 -12.428 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.854 14.278 -13.811 1.00 0.00 C ATOM 2331 C PHE A 146 -5.976 14.041 -14.822 1.00 0.00 C ATOM 2332 O PHE A 146 -6.137 14.787 -15.766 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.699 13.325 -14.113 1.00 0.00 C ATOM 2334 CG PHE A 146 -3.046 13.714 -15.421 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.625 13.330 -16.639 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.858 14.455 -15.417 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.015 13.686 -17.844 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.252 14.808 -16.629 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.835 14.420 -17.840 1.00 0.00 C ATOM 0 H PHE A 146 -4.915 13.253 -11.938 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.511 15.310 -13.886 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.967 13.358 -13.306 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.066 12.300 -14.169 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.542 12.759 -16.645 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.410 14.754 -14.481 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.462 13.390 -18.782 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.335 15.379 -16.629 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.367 14.692 -18.774 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.744 12.999 -14.639 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.841 12.700 -15.604 1.00 0.00 C ATOM 2351 C LEU A 147 -8.722 13.936 -15.790 1.00 0.00 C ATOM 2352 O LEU A 147 -9.086 14.288 -16.894 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.677 11.534 -15.070 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.752 10.345 -14.783 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.582 9.106 -14.456 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.879 10.058 -16.007 1.00 0.00 C ATOM 0 H LEU A 147 -6.658 12.343 -13.863 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.414 12.427 -16.569 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.200 11.831 -14.161 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.438 11.252 -15.798 1.00 0.00 H new ATOM 0 HG LEU A 147 -7.117 10.591 -13.932 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.918 8.266 -14.253 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -9.198 9.302 -13.578 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.224 8.864 -15.303 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.224 9.212 -15.797 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.515 9.821 -16.860 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.275 10.936 -16.237 1.00 0.00 H new ATOM 2368 N CYS A 148 -9.056 14.611 -14.728 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.895 15.830 -14.867 1.00 0.00 C ATOM 2370 C CYS A 148 -9.137 16.855 -15.714 1.00 0.00 C ATOM 2371 O CYS A 148 -9.722 17.685 -16.381 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.182 16.416 -13.482 1.00 0.00 C ATOM 2373 SG CYS A 148 -11.180 15.244 -12.529 1.00 0.00 S ATOM 0 H CYS A 148 -8.786 14.373 -13.774 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.840 15.578 -15.349 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.247 16.622 -12.961 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.709 17.365 -13.579 1.00 0.00 H new ATOM 0 HG CYS A 148 -11.423 15.738 -11.351 1.00 0.00 H new ATOM 2379 N SER A 149 -7.832 16.802 -15.679 1.00 0.00 N ATOM 2380 CA SER A 149 -7.019 17.769 -16.466 1.00 0.00 C ATOM 2381 C SER A 149 -6.970 17.347 -17.938 1.00 0.00 C ATOM 2382 O SER A 149 -6.476 18.073 -18.780 1.00 0.00 O ATOM 2383 CB SER A 149 -5.595 17.796 -15.910 1.00 0.00 C ATOM 2384 OG SER A 149 -4.922 18.950 -16.395 1.00 0.00 O ATOM 0 H SER A 149 -7.294 16.127 -15.136 1.00 0.00 H new ATOM 0 HA SER A 149 -7.473 18.757 -16.392 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.618 17.806 -14.820 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.059 16.896 -16.209 1.00 0.00 H new ATOM 0 HG SER A 149 -5.281 19.193 -17.274 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.468 16.186 -18.261 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.435 15.736 -19.677 1.00 0.00 C ATOM 2392 C ILE A 150 -8.756 16.075 -20.347 1.00 0.00 C ATOM 2393 O ILE A 150 -9.384 17.075 -20.059 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.239 14.224 -19.734 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.210 13.802 -18.696 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -6.735 13.826 -21.116 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.887 12.323 -18.894 1.00 0.00 C ATOM 0 H ILE A 150 -7.895 15.532 -17.606 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.613 16.237 -20.188 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.191 13.734 -19.531 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.306 14.402 -18.796 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.596 13.972 -17.691 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.595 12.746 -21.155 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.464 14.125 -21.869 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.785 14.322 -21.313 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.150 12.009 -18.155 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.795 11.733 -18.773 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.485 12.169 -19.895 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.182 15.232 -21.237 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.472 15.470 -21.934 1.00 0.00 C ATOM 2411 C GLU A 151 -11.571 14.831 -21.102 1.00 0.00 C ATOM 2412 O GLU A 151 -12.704 14.695 -21.521 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.420 14.845 -23.329 1.00 0.00 C ATOM 2414 CG GLU A 151 -9.108 15.250 -23.997 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.178 14.970 -25.500 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -8.243 15.336 -26.194 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -10.166 14.400 -25.933 1.00 0.00 O ATOM 0 H GLU A 151 -8.690 14.383 -21.515 1.00 0.00 H new ATOM 0 HA GLU A 151 -10.665 16.537 -22.047 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.490 13.759 -23.260 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.268 15.181 -23.926 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -8.914 16.309 -23.825 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -8.279 14.698 -23.554 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.222 14.441 -19.913 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.212 13.801 -19.004 1.00 0.00 C ATOM 2427 C ALA A 152 -13.288 14.817 -18.622 1.00 0.00 C ATOM 2428 O ALA A 152 -14.448 14.482 -18.480 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.511 13.316 -17.731 1.00 0.00 C ATOM 0 H ALA A 152 -10.283 14.538 -19.526 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.668 12.954 -19.516 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.240 12.849 -17.070 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.741 12.590 -17.993 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.052 14.164 -17.223 1.00 0.00 H new ATOM 2435 N LEU A 153 -12.914 16.055 -18.448 1.00 0.00 N ATOM 2436 CA LEU A 153 -13.919 17.084 -18.069 1.00 0.00 C ATOM 2437 C LEU A 153 -14.660 16.628 -16.812 1.00 0.00 C ATOM 2438 O LEU A 153 -14.377 15.563 -16.267 1.00 0.00 O ATOM 2439 CB LEU A 153 -14.918 17.265 -19.216 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.164 17.642 -20.493 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -15.162 17.894 -21.623 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -13.347 18.912 -20.244 1.00 0.00 C ATOM 0 H LEU A 153 -11.958 16.396 -18.552 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.418 18.032 -17.872 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -15.481 16.344 -19.371 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -15.640 18.042 -18.964 1.00 0.00 H new ATOM 0 HG LEU A 153 -13.497 16.827 -20.774 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -14.623 18.162 -22.532 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -15.746 16.991 -21.801 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -15.830 18.709 -21.344 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -12.809 19.182 -21.153 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -14.016 19.725 -19.963 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -12.634 18.734 -19.439 1.00 0.00 H new