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 37 SER OG : rot -24:sc= 0.346 USER MOD Set 1.2: A 117 GLN :FLIP amide:sc= -0.758 F(o=-1.9!,f=-0.41) USER MOD Set 2.1: A 19 CYS SG : rot 63:sc= 1.04 USER MOD Set 2.2: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 47 LYS NZ :NH3+ 153:sc= 0.356 (180deg=0) USER MOD Set 3.2: A 98 TYR OH : rot 180:sc= -2.23! USER MOD Set 4.1: A 86 ASN :FLIP amide:sc= -4.65! C(o=-11!,f=-4.7!) USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -107:sc= -11.4! USER MOD Single : A 35 GLN :FLIP amide:sc= 0.774 F(o=-0.9,f=0.77) USER MOD Single : A 42 HIS :FLIP no HD1:sc= -5.33 F(o=-8.3!,f=-5.3) USER MOD Single : A 44 THR OG1 : rot -110:sc= -2.28 USER MOD Single : A 49 HIS :FLIP no HD1:sc= -2.21! C(o=-7!,f=-2.2!) USER MOD Single : A 59 THR OG1 : rot -70:sc= -2.52! USER MOD Single : A 64 THR OG1 : rot 54:sc= -3.36! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 GLN : amide:sc= -7.03! C(o=-7!,f=-9.2!) 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 104 LYS NZ :NH3+ -134:sc= -1.74! (180deg=-4.05!) USER MOD Single : A 113 SER OG : rot 180:sc= 0.0346 USER MOD Single : A 114 HIS :FLIP no HD1:sc= -2.63! C(o=-4.1!,f=-2.6!) USER MOD Single : A 116 HIS : no HD1:sc= -2.97 X(o=-3,f=-2.9) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -2.7 USER MOD Single : A 129 GLN : amide:sc= -0.0649 K(o=-0.065,f=-0.67) USER MOD Single : A 132 GLN : amide:sc= -0.075 K(o=-0.075,f=-2.1!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl 134:sc= -2.7 (180deg=-6.64!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00902 F(o=-1.4!,f=-0.009) USER MOD Single : A 144 HIS : no HE2:sc= -14.8! C(o=-15!,f=-22!) USER MOD Single : A 145 GLN : amide:sc= -0.134 K(o=-0.13,f=-1.3) USER MOD Single : A 148 CYS SG : rot 76:sc= 0.191 USER MOD Single : A 149 SER OG : rot -34:sc= 0.0442 USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 11.644 -3.708 -6.746 1.00 0.00 N ATOM 106 CA ARG A 9 10.890 -2.592 -7.366 1.00 0.00 C ATOM 107 C ARG A 9 9.938 -3.171 -8.405 1.00 0.00 C ATOM 108 O ARG A 9 10.352 -3.752 -9.388 1.00 0.00 O ATOM 109 CB ARG A 9 11.866 -1.603 -8.015 1.00 0.00 C ATOM 110 CG ARG A 9 11.216 -0.925 -9.226 1.00 0.00 C ATOM 111 CD ARG A 9 12.187 0.102 -9.809 1.00 0.00 C ATOM 112 NE ARG A 9 12.594 1.063 -8.740 1.00 0.00 N ATOM 113 CZ ARG A 9 12.488 2.354 -8.927 1.00 0.00 C ATOM 114 NH1 ARG A 9 12.026 2.825 -10.053 1.00 0.00 N ATOM 115 NH2 ARG A 9 12.851 3.177 -7.980 1.00 0.00 N ATOM 0 HA ARG A 9 10.317 -2.055 -6.610 1.00 0.00 H new ATOM 0 HB2 ARG A 9 12.167 -0.850 -7.287 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.770 -2.126 -8.325 1.00 0.00 H new ATOM 0 HG2 ARG A 9 10.959 -1.669 -9.980 1.00 0.00 H new ATOM 0 HG3 ARG A 9 10.287 -0.438 -8.930 1.00 0.00 H new ATOM 0 HD2 ARG A 9 13.065 -0.401 -10.215 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.716 0.637 -10.634 1.00 0.00 H new ATOM 0 HE ARG A 9 12.958 0.709 -7.855 1.00 0.00 H new ATOM 0 HH11 ARG A 9 11.744 2.185 -10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 9 11.947 3.833 -10.190 1.00 0.00 H new ATOM 0 HH21 ARG A 9 13.215 2.813 -7.100 1.00 0.00 H new ATOM 0 HH22 ARG A 9 12.770 4.184 -8.121 1.00 0.00 H new ATOM 129 N ALA A 10 8.666 -3.024 -8.190 1.00 0.00 N ATOM 130 CA ALA A 10 7.682 -3.569 -9.159 1.00 0.00 C ATOM 131 C ALA A 10 7.005 -2.407 -9.869 1.00 0.00 C ATOM 132 O ALA A 10 7.206 -1.258 -9.532 1.00 0.00 O ATOM 133 CB ALA A 10 6.637 -4.405 -8.416 1.00 0.00 C ATOM 0 H ALA A 10 8.263 -2.548 -7.383 1.00 0.00 H new ATOM 0 HA ALA A 10 8.187 -4.204 -9.887 1.00 0.00 H new ATOM 0 HB1 ALA A 10 5.916 -4.804 -9.129 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.130 -5.229 -7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.120 -3.779 -7.689 1.00 0.00 H new ATOM 139 N CYS A 11 6.222 -2.682 -10.865 1.00 0.00 N ATOM 140 CA CYS A 11 5.561 -1.576 -11.592 1.00 0.00 C ATOM 141 C CYS A 11 4.159 -2.009 -12.017 1.00 0.00 C ATOM 142 O CYS A 11 3.927 -3.153 -12.355 1.00 0.00 O ATOM 143 CB CYS A 11 6.406 -1.223 -12.812 1.00 0.00 C ATOM 144 SG CYS A 11 7.982 -2.110 -12.721 1.00 0.00 S ATOM 0 H CYS A 11 6.012 -3.620 -11.206 1.00 0.00 H new ATOM 0 HA CYS A 11 5.470 -0.700 -10.950 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.876 -1.491 -13.726 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.582 -0.148 -12.849 1.00 0.00 H new ATOM 0 HG CYS A 11 8.933 -1.275 -12.424 1.00 0.00 H new ATOM 150 N GLY A 12 3.218 -1.104 -11.995 1.00 0.00 N ATOM 151 CA GLY A 12 1.827 -1.472 -12.394 1.00 0.00 C ATOM 152 C GLY A 12 1.159 -0.304 -13.121 1.00 0.00 C ATOM 153 O GLY A 12 1.717 0.770 -13.241 1.00 0.00 O ATOM 0 H GLY A 12 3.350 -0.131 -11.720 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.847 -2.349 -13.041 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.247 -1.740 -11.511 1.00 0.00 H new ATOM 157 N LEU A 13 -0.039 -0.507 -13.603 1.00 0.00 N ATOM 158 CA LEU A 13 -0.753 0.588 -14.318 1.00 0.00 C ATOM 159 C LEU A 13 -2.015 0.989 -13.568 1.00 0.00 C ATOM 160 O LEU A 13 -2.890 0.176 -13.341 1.00 0.00 O ATOM 161 CB LEU A 13 -1.218 0.112 -15.699 1.00 0.00 C ATOM 162 CG LEU A 13 -0.045 -0.135 -16.638 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.602 -0.496 -18.013 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.790 1.135 -16.762 1.00 0.00 C ATOM 0 H LEU A 13 -0.553 -1.385 -13.532 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.056 1.422 -14.395 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.796 -0.806 -15.591 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.882 0.858 -16.136 1.00 0.00 H new ATOM 0 HG LEU A 13 0.579 -0.940 -16.250 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.222 -0.677 -18.703 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.213 -1.395 -17.933 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.213 0.326 -18.385 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.629 0.955 -17.435 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.172 1.940 -17.160 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.167 1.420 -15.780 1.00 0.00 H new ATOM 176 N ILE A 14 -2.171 2.242 -13.256 1.00 0.00 N ATOM 177 CA ILE A 14 -3.441 2.657 -12.619 1.00 0.00 C ATOM 178 C ILE A 14 -4.484 2.560 -13.723 1.00 0.00 C ATOM 179 O ILE A 14 -4.720 3.503 -14.451 1.00 0.00 O ATOM 180 CB ILE A 14 -3.334 4.105 -12.132 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.379 4.179 -10.941 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.713 4.629 -11.731 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.942 3.376 -9.765 1.00 0.00 C ATOM 0 H ILE A 14 -1.487 2.982 -13.412 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.691 2.038 -11.757 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.946 4.724 -12.941 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.402 3.788 -11.224 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.233 5.218 -10.646 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.625 5.659 -11.386 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.381 4.590 -12.591 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.118 4.012 -10.929 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.254 3.435 -8.922 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.909 3.786 -9.474 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.064 2.334 -10.061 1.00 0.00 H new ATOM 195 N ILE A 15 -5.078 1.412 -13.887 1.00 0.00 N ATOM 196 CA ILE A 15 -6.064 1.255 -14.987 1.00 0.00 C ATOM 197 C ILE A 15 -7.412 1.819 -14.581 1.00 0.00 C ATOM 198 O ILE A 15 -7.893 1.615 -13.484 1.00 0.00 O ATOM 199 CB ILE A 15 -6.217 -0.216 -15.357 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.910 -0.720 -15.980 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.366 -0.360 -16.355 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.067 -2.189 -16.378 1.00 0.00 C ATOM 0 H ILE A 15 -4.925 0.584 -13.312 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.696 1.806 -15.852 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.436 -0.806 -14.467 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.657 -0.120 -16.854 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.090 -0.610 -15.270 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.483 -1.409 -16.626 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.289 0.003 -15.902 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.146 0.223 -17.249 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.138 -2.547 -16.821 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.300 -2.783 -15.494 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.875 -2.285 -17.103 1.00 0.00 H new ATOM 214 N PHE A 16 -8.021 2.529 -15.479 1.00 0.00 N ATOM 215 CA PHE A 16 -9.344 3.125 -15.193 1.00 0.00 C ATOM 216 C PHE A 16 -10.085 3.339 -16.513 1.00 0.00 C ATOM 217 O PHE A 16 -9.483 3.474 -17.559 1.00 0.00 O ATOM 218 CB PHE A 16 -9.151 4.480 -14.520 1.00 0.00 C ATOM 219 CG PHE A 16 -8.565 5.435 -15.528 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.405 6.091 -16.433 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.183 5.650 -15.571 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.867 6.965 -17.378 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.642 6.526 -16.519 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.485 7.185 -17.423 1.00 0.00 C ATOM 0 H PHE A 16 -7.653 2.724 -16.410 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.912 2.462 -14.541 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.104 4.858 -14.149 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.489 4.385 -13.659 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.471 5.921 -16.400 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.535 5.141 -14.874 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.517 7.472 -18.075 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.576 6.694 -16.554 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.069 7.862 -18.154 1.00 0.00 H new ATOM 234 N ARG A 17 -11.381 3.394 -16.467 1.00 0.00 N ATOM 235 CA ARG A 17 -12.164 3.628 -17.710 1.00 0.00 C ATOM 236 C ARG A 17 -13.142 4.778 -17.478 1.00 0.00 C ATOM 237 O ARG A 17 -13.851 4.811 -16.493 1.00 0.00 O ATOM 238 CB ARG A 17 -12.938 2.358 -18.082 1.00 0.00 C ATOM 239 CG ARG A 17 -13.968 2.671 -19.179 1.00 0.00 C ATOM 240 CD ARG A 17 -13.263 3.184 -20.440 1.00 0.00 C ATOM 241 NE ARG A 17 -14.280 3.481 -21.488 1.00 0.00 N ATOM 242 CZ ARG A 17 -14.086 4.465 -22.326 1.00 0.00 C ATOM 243 NH1 ARG A 17 -12.997 5.181 -22.255 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.982 4.732 -23.236 1.00 0.00 N ATOM 0 H ARG A 17 -11.937 3.287 -15.619 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.487 3.883 -18.525 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.247 1.590 -18.429 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.442 1.959 -17.202 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.542 1.775 -19.414 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.676 3.418 -18.820 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.689 4.081 -20.210 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -12.556 2.438 -20.804 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.127 2.917 -21.551 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -12.295 4.973 -21.545 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.848 5.948 -22.910 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.833 4.173 -23.293 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.831 5.500 -23.890 1.00 0.00 H new ATOM 258 N ARG A 18 -13.189 5.720 -18.377 1.00 0.00 N ATOM 259 CA ARG A 18 -14.128 6.860 -18.200 1.00 0.00 C ATOM 260 C ARG A 18 -15.412 6.585 -18.980 1.00 0.00 C ATOM 261 O ARG A 18 -15.381 6.197 -20.132 1.00 0.00 O ATOM 262 CB ARG A 18 -13.473 8.153 -18.686 1.00 0.00 C ATOM 263 CG ARG A 18 -13.086 8.028 -20.159 1.00 0.00 C ATOM 264 CD ARG A 18 -12.023 9.076 -20.485 1.00 0.00 C ATOM 265 NE ARG A 18 -12.347 9.727 -21.785 1.00 0.00 N ATOM 266 CZ ARG A 18 -11.927 10.938 -22.028 1.00 0.00 C ATOM 267 NH1 ARG A 18 -11.210 11.572 -21.139 1.00 0.00 N ATOM 268 NH2 ARG A 18 -12.220 11.516 -23.160 1.00 0.00 N ATOM 0 H ARG A 18 -12.620 5.750 -19.223 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.372 6.972 -17.144 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.159 8.989 -18.553 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.588 8.368 -18.087 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.704 7.028 -20.364 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.962 8.171 -20.792 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.980 9.824 -19.693 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.040 8.608 -20.536 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.896 9.227 -22.484 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -10.978 11.120 -20.254 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -10.882 12.519 -21.330 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -12.778 11.021 -23.856 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -11.891 12.463 -23.349 1.00 0.00 H new ATOM 282 N CYS A 19 -16.545 6.765 -18.356 1.00 0.00 N ATOM 283 CA CYS A 19 -17.832 6.497 -19.059 1.00 0.00 C ATOM 284 C CYS A 19 -18.370 7.784 -19.679 1.00 0.00 C ATOM 285 O CYS A 19 -17.775 8.838 -19.582 1.00 0.00 O ATOM 286 CB CYS A 19 -18.862 5.947 -18.071 1.00 0.00 C ATOM 287 SG CYS A 19 -18.043 4.842 -16.895 1.00 0.00 S ATOM 0 H CYS A 19 -16.635 7.085 -17.392 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.652 5.764 -19.845 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.345 6.767 -17.540 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.644 5.409 -18.607 1.00 0.00 H new ATOM 0 HG CYS A 19 -17.169 5.513 -16.205 1.00 0.00 H new ATOM 424 N ALA A 28 -17.988 8.859 -13.949 1.00 0.00 N ATOM 425 CA ALA A 28 -17.656 8.317 -15.293 1.00 0.00 C ATOM 426 C ALA A 28 -16.335 7.554 -15.231 1.00 0.00 C ATOM 427 O ALA A 28 -16.092 6.658 -16.013 1.00 0.00 O ATOM 428 CB ALA A 28 -17.528 9.472 -16.290 1.00 0.00 C ATOM 0 HA ALA A 28 -18.448 7.641 -15.614 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.285 9.076 -17.276 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.471 10.016 -16.340 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.737 10.147 -15.965 1.00 0.00 H new ATOM 434 N ILE A 29 -15.478 7.901 -14.310 1.00 0.00 N ATOM 435 CA ILE A 29 -14.169 7.195 -14.212 1.00 0.00 C ATOM 436 C ILE A 29 -14.217 6.132 -13.118 1.00 0.00 C ATOM 437 O ILE A 29 -14.679 6.368 -12.018 1.00 0.00 O ATOM 438 CB ILE A 29 -13.066 8.204 -13.889 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.038 9.291 -14.974 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.719 7.480 -13.826 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.690 9.282 -15.702 1.00 0.00 C ATOM 0 H ILE A 29 -15.627 8.640 -13.623 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.960 6.711 -15.166 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.261 8.672 -12.924 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.845 9.123 -15.687 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.209 10.269 -14.523 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.931 8.197 -13.596 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.753 6.716 -13.049 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.513 7.011 -14.788 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.685 10.057 -16.468 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.889 9.473 -14.987 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.535 8.309 -16.169 1.00 0.00 H new ATOM 453 N GLU A 30 -13.733 4.962 -13.422 1.00 0.00 N ATOM 454 CA GLU A 30 -13.729 3.861 -12.422 1.00 0.00 C ATOM 455 C GLU A 30 -12.352 3.201 -12.420 1.00 0.00 C ATOM 456 O GLU A 30 -11.623 3.280 -13.390 1.00 0.00 O ATOM 457 CB GLU A 30 -14.791 2.826 -12.808 1.00 0.00 C ATOM 458 CG GLU A 30 -16.174 3.480 -12.788 1.00 0.00 C ATOM 459 CD GLU A 30 -17.237 2.435 -13.133 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.407 2.729 -12.958 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.861 1.357 -13.566 1.00 0.00 O ATOM 0 H GLU A 30 -13.336 4.719 -14.330 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.950 4.256 -11.430 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.581 2.426 -13.800 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.764 1.986 -12.114 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.373 3.905 -11.804 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.210 4.301 -13.504 1.00 0.00 H new ATOM 469 N PHE A 31 -11.983 2.548 -11.352 1.00 0.00 N ATOM 470 CA PHE A 31 -10.649 1.885 -11.320 1.00 0.00 C ATOM 471 C PHE A 31 -10.830 0.373 -11.355 1.00 0.00 C ATOM 472 O PHE A 31 -11.747 -0.173 -10.776 1.00 0.00 O ATOM 473 CB PHE A 31 -9.898 2.254 -10.042 1.00 0.00 C ATOM 474 CG PHE A 31 -9.553 3.721 -10.042 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.613 4.217 -10.952 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.159 4.579 -9.123 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.285 5.579 -10.943 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.830 5.936 -9.112 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.893 6.439 -10.021 1.00 0.00 C ATOM 0 H PHE A 31 -12.543 2.445 -10.506 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.078 2.220 -12.186 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.510 2.018 -9.172 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -8.988 1.660 -9.963 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.141 3.551 -11.660 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.883 4.193 -8.420 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.563 5.965 -11.647 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.300 6.599 -8.400 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.639 7.489 -10.011 1.00 0.00 H new ATOM 489 N LEU A 32 -9.951 -0.304 -12.027 1.00 0.00 N ATOM 490 CA LEU A 32 -10.043 -1.781 -12.109 1.00 0.00 C ATOM 491 C LEU A 32 -8.992 -2.387 -11.161 1.00 0.00 C ATOM 492 O LEU A 32 -7.800 -2.282 -11.384 1.00 0.00 O ATOM 493 CB LEU A 32 -9.819 -2.177 -13.581 1.00 0.00 C ATOM 494 CG LEU A 32 -9.186 -3.567 -13.714 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.253 -4.648 -13.570 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.559 -3.687 -15.098 1.00 0.00 C ATOM 0 H LEU A 32 -9.164 0.107 -12.529 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.017 -2.159 -11.798 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.772 -2.161 -14.109 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.176 -1.439 -14.061 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.435 -3.695 -12.935 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.791 -5.630 -13.666 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.726 -4.564 -12.592 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.005 -4.523 -14.349 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.104 -4.672 -15.207 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.329 -3.556 -15.859 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.795 -2.919 -15.219 1.00 0.00 H new ATOM 508 N LEU A 33 -9.435 -3.005 -10.092 1.00 0.00 N ATOM 509 CA LEU A 33 -8.485 -3.609 -9.101 1.00 0.00 C ATOM 510 C LEU A 33 -8.586 -5.133 -9.158 1.00 0.00 C ATOM 511 O LEU A 33 -9.523 -5.678 -9.706 1.00 0.00 O ATOM 512 CB LEU A 33 -8.853 -3.157 -7.684 1.00 0.00 C ATOM 513 CG LEU A 33 -8.240 -1.788 -7.374 1.00 0.00 C ATOM 514 CD1 LEU A 33 -8.893 -1.226 -6.110 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.736 -1.941 -7.129 1.00 0.00 C ATOM 0 H LEU A 33 -10.422 -3.118 -9.861 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.473 -3.287 -9.345 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.937 -3.106 -7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.500 -3.891 -6.960 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.406 -1.116 -8.216 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.463 -0.251 -5.881 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.966 -1.121 -6.271 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.716 -1.905 -5.276 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.302 -0.966 -6.909 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.571 -2.611 -6.285 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.263 -2.356 -8.019 1.00 0.00 H new ATOM 527 N LEU A 34 -7.630 -5.829 -8.595 1.00 0.00 N ATOM 528 CA LEU A 34 -7.686 -7.320 -8.625 1.00 0.00 C ATOM 529 C LEU A 34 -7.527 -7.902 -7.219 1.00 0.00 C ATOM 530 O LEU A 34 -6.699 -7.468 -6.444 1.00 0.00 O ATOM 531 CB LEU A 34 -6.559 -7.856 -9.509 1.00 0.00 C ATOM 532 CG LEU A 34 -6.560 -7.139 -10.860 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.592 -7.845 -11.807 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.962 -7.166 -11.470 1.00 0.00 C ATOM 0 H LEU A 34 -6.820 -5.432 -8.120 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.656 -7.616 -9.024 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.599 -7.712 -9.014 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.683 -8.929 -9.658 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.252 -6.104 -10.712 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.590 -7.336 -12.771 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.588 -7.823 -11.383 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.906 -8.880 -11.943 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.950 -6.653 -12.431 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.276 -8.200 -11.614 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.660 -6.665 -10.800 1.00 0.00 H new ATOM 546 N GLN A 35 -8.294 -8.914 -6.902 1.00 0.00 N ATOM 547 CA GLN A 35 -8.162 -9.558 -5.565 1.00 0.00 C ATOM 548 C GLN A 35 -7.409 -10.875 -5.757 1.00 0.00 C ATOM 549 O GLN A 35 -7.885 -11.776 -6.419 1.00 0.00 O ATOM 550 CB GLN A 35 -9.542 -9.835 -4.968 1.00 0.00 C ATOM 551 CG GLN A 35 -9.422 -9.966 -3.449 1.00 0.00 C ATOM 552 CD GLN A 35 -10.800 -10.260 -2.853 1.00 0.00 C ATOM 553 OE1 GLN A 35 -10.920 -11.187 -1.943 1.00 0.00 O flip ATOM 554 NE2 GLN A 35 -11.778 -9.641 -3.221 1.00 0.00 N flip ATOM 0 H GLN A 35 -9.004 -9.320 -7.512 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.624 -8.900 -4.883 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.229 -9.027 -5.221 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.956 -10.750 -5.391 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.726 -10.766 -3.196 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.019 -9.047 -3.025 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.685 -8.916 -3.932 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.693 -9.846 -2.819 1.00 0.00 H new ATOM 563 N ALA A 36 -6.229 -10.989 -5.216 1.00 0.00 N ATOM 564 CA ALA A 36 -5.444 -12.242 -5.410 1.00 0.00 C ATOM 565 C ALA A 36 -5.968 -13.359 -4.506 1.00 0.00 C ATOM 566 O ALA A 36 -6.047 -13.219 -3.301 1.00 0.00 O ATOM 567 CB ALA A 36 -3.974 -11.972 -5.095 1.00 0.00 C ATOM 0 H ALA A 36 -5.774 -10.273 -4.650 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.548 -12.562 -6.447 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.398 -12.886 -5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.595 -11.198 -5.762 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.879 -11.639 -4.062 1.00 0.00 H new ATOM 573 N SER A 37 -6.310 -14.477 -5.091 1.00 0.00 N ATOM 574 CA SER A 37 -6.816 -15.629 -4.290 1.00 0.00 C ATOM 575 C SER A 37 -5.667 -16.617 -4.057 1.00 0.00 C ATOM 576 O SER A 37 -5.789 -17.555 -3.293 1.00 0.00 O ATOM 577 CB SER A 37 -7.941 -16.325 -5.057 1.00 0.00 C ATOM 578 OG SER A 37 -8.352 -17.482 -4.341 1.00 0.00 O ATOM 0 H SER A 37 -6.260 -14.642 -6.096 1.00 0.00 H new ATOM 0 HA SER A 37 -7.197 -15.275 -3.332 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.783 -15.645 -5.186 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.599 -16.603 -6.054 1.00 0.00 H new ATOM 0 HG SER A 37 -7.620 -17.787 -3.765 1.00 0.00 H new ATOM 641 N HIS A 42 -6.685 -9.935 -0.757 1.00 0.00 N ATOM 642 CA HIS A 42 -6.224 -8.519 -0.756 1.00 0.00 C ATOM 643 C HIS A 42 -6.453 -7.915 -2.145 1.00 0.00 C ATOM 644 O HIS A 42 -6.294 -8.575 -3.151 1.00 0.00 O ATOM 645 CB HIS A 42 -4.733 -8.476 -0.409 1.00 0.00 C ATOM 646 CG HIS A 42 -3.922 -8.936 -1.590 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.730 -8.394 -2.836 1.00 0.00 N flip ATOM 648 CD2 HIS A 42 -3.169 -10.102 -1.564 1.00 0.00 C flip ATOM 649 CE1 HIS A 42 -2.873 -9.207 -3.568 1.00 0.00 C flip ATOM 650 NE2 HIS A 42 -2.565 -10.221 -2.760 1.00 0.00 N flip ATOM 0 HA HIS A 42 -6.783 -7.945 -0.017 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.444 -7.463 -0.130 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.532 -9.113 0.452 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.084 -10.788 -0.735 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -2.529 -9.050 -4.580 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -1.948 -10.992 -3.017 1.00 0.00 H new ATOM 659 N TRP A 43 -6.836 -6.667 -2.207 1.00 0.00 N ATOM 660 CA TRP A 43 -7.091 -6.026 -3.530 1.00 0.00 C ATOM 661 C TRP A 43 -5.847 -5.282 -4.010 1.00 0.00 C ATOM 662 O TRP A 43 -5.124 -4.691 -3.235 1.00 0.00 O ATOM 663 CB TRP A 43 -8.252 -5.043 -3.400 1.00 0.00 C ATOM 664 CG TRP A 43 -9.544 -5.786 -3.489 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.338 -6.106 -2.441 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.209 -6.296 -4.675 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.446 -6.787 -2.911 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.411 -6.928 -4.284 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.885 -6.271 -6.040 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.263 -7.516 -5.218 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.736 -6.861 -6.982 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.924 -7.483 -6.573 1.00 0.00 C ATOM 0 H TRP A 43 -6.983 -6.064 -1.398 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.340 -6.800 -4.256 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.189 -4.513 -2.450 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.197 -4.292 -4.188 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.139 -5.868 -1.406 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.196 -7.141 -2.317 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -8.973 -5.793 -6.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.177 -7.993 -4.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.476 -6.837 -8.030 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.576 -7.936 -7.305 1.00 0.00 H new ATOM 683 N THR A 44 -5.594 -5.307 -5.293 1.00 0.00 N ATOM 684 CA THR A 44 -4.399 -4.601 -5.830 1.00 0.00 C ATOM 685 C THR A 44 -4.487 -4.519 -7.353 1.00 0.00 C ATOM 686 O THR A 44 -5.064 -5.374 -7.997 1.00 0.00 O ATOM 687 CB THR A 44 -3.136 -5.372 -5.440 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.047 -4.929 -6.239 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.350 -6.870 -5.665 1.00 0.00 C ATOM 0 H THR A 44 -6.165 -5.786 -5.990 1.00 0.00 H new ATOM 0 HA THR A 44 -4.361 -3.594 -5.415 1.00 0.00 H new ATOM 0 HB THR A 44 -2.918 -5.193 -4.387 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.792 -5.638 -6.866 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.447 -7.413 -5.385 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.184 -7.214 -5.054 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.572 -7.052 -6.717 1.00 0.00 H new ATOM 697 N PRO A 45 -3.902 -3.504 -7.929 1.00 0.00 N ATOM 698 CA PRO A 45 -3.891 -3.306 -9.406 1.00 0.00 C ATOM 699 C PRO A 45 -2.947 -4.296 -10.079 1.00 0.00 C ATOM 700 O PRO A 45 -2.096 -4.879 -9.437 1.00 0.00 O ATOM 701 CB PRO A 45 -3.375 -1.879 -9.577 1.00 0.00 C ATOM 702 CG PRO A 45 -2.531 -1.638 -8.374 1.00 0.00 C ATOM 703 CD PRO A 45 -3.182 -2.424 -7.236 1.00 0.00 C ATOM 0 HA PRO A 45 -4.871 -3.463 -9.857 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.796 -1.774 -10.495 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.196 -1.165 -9.635 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.507 -1.972 -8.543 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.484 -0.575 -8.137 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.438 -2.818 -6.544 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -3.860 -1.800 -6.654 1.00 0.00 H new ATOM 711 N PRO A 46 -3.087 -4.489 -11.357 1.00 0.00 N ATOM 712 CA PRO A 46 -2.215 -5.432 -12.100 1.00 0.00 C ATOM 713 C PRO A 46 -0.764 -4.944 -12.126 1.00 0.00 C ATOM 714 O PRO A 46 -0.369 -4.172 -12.978 1.00 0.00 O ATOM 715 CB PRO A 46 -2.811 -5.467 -13.507 1.00 0.00 C ATOM 716 CG PRO A 46 -3.652 -4.237 -13.635 1.00 0.00 C ATOM 717 CD PRO A 46 -4.075 -3.835 -12.224 1.00 0.00 C ATOM 0 HA PRO A 46 -2.183 -6.418 -11.637 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.025 -5.482 -14.262 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.411 -6.365 -13.653 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.090 -3.434 -14.112 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.525 -4.430 -14.259 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.063 -2.752 -12.097 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.087 -4.171 -12.000 1.00 0.00 H new ATOM 725 N LYS A 47 0.027 -5.382 -11.182 1.00 0.00 N ATOM 726 CA LYS A 47 1.450 -4.942 -11.125 1.00 0.00 C ATOM 727 C LYS A 47 2.346 -6.153 -10.846 1.00 0.00 C ATOM 728 O LYS A 47 1.979 -7.050 -10.112 1.00 0.00 O ATOM 729 CB LYS A 47 1.600 -3.917 -9.996 1.00 0.00 C ATOM 730 CG LYS A 47 1.461 -4.621 -8.646 1.00 0.00 C ATOM 731 CD LYS A 47 1.214 -3.589 -7.550 1.00 0.00 C ATOM 732 CE LYS A 47 1.099 -4.305 -6.207 1.00 0.00 C ATOM 733 NZ LYS A 47 0.994 -3.298 -5.112 1.00 0.00 N ATOM 0 H LYS A 47 -0.254 -6.029 -10.445 1.00 0.00 H new ATOM 0 HA LYS A 47 1.743 -4.493 -12.074 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.570 -3.425 -10.063 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.842 -3.140 -10.093 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.637 -5.334 -8.680 1.00 0.00 H new ATOM 0 HG3 LYS A 47 2.365 -5.189 -8.427 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.030 -2.867 -7.523 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.301 -3.031 -7.758 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.223 -4.954 -6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.969 -4.942 -6.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.478 -3.711 -4.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.947 -3.019 -4.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.483 -2.461 -5.458 1.00 0.00 H new ATOM 747 N GLY A 48 3.517 -6.190 -11.423 1.00 0.00 N ATOM 748 CA GLY A 48 4.427 -7.348 -11.182 1.00 0.00 C ATOM 749 C GLY A 48 5.843 -6.841 -10.902 1.00 0.00 C ATOM 750 O GLY A 48 6.190 -5.727 -11.243 1.00 0.00 O ATOM 0 H GLY A 48 3.882 -5.472 -12.048 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.067 -7.936 -10.338 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.431 -8.007 -12.051 1.00 0.00 H new ATOM 754 N HIS A 49 6.662 -7.649 -10.286 1.00 0.00 N ATOM 755 CA HIS A 49 8.056 -7.216 -9.980 1.00 0.00 C ATOM 756 C HIS A 49 8.810 -6.968 -11.287 1.00 0.00 C ATOM 757 O HIS A 49 8.355 -7.330 -12.355 1.00 0.00 O ATOM 758 CB HIS A 49 8.766 -8.300 -9.176 1.00 0.00 C ATOM 759 CG HIS A 49 10.235 -7.979 -9.094 1.00 0.00 C ATOM 760 ND1 HIS A 49 10.915 -6.893 -8.593 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.208 -8.841 -9.582 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.281 -7.081 -8.769 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.406 -8.266 -9.367 1.00 0.00 N flip ATOM 0 H HIS A 49 6.426 -8.593 -9.980 1.00 0.00 H new ATOM 0 HA HIS A 49 8.030 -6.296 -9.396 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.340 -8.364 -8.175 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.620 -9.272 -9.647 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.035 -9.799 -10.049 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.075 -6.408 -8.481 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.298 -8.685 -9.629 1.00 0.00 H new ATOM 772 N VAL A 50 9.953 -6.341 -11.218 1.00 0.00 N ATOM 773 CA VAL A 50 10.716 -6.058 -12.465 1.00 0.00 C ATOM 774 C VAL A 50 11.859 -7.063 -12.632 1.00 0.00 C ATOM 775 O VAL A 50 12.647 -7.284 -11.734 1.00 0.00 O ATOM 776 CB VAL A 50 11.280 -4.631 -12.394 1.00 0.00 C ATOM 777 CG1 VAL A 50 12.780 -4.661 -12.082 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.059 -3.929 -13.735 1.00 0.00 C ATOM 0 H VAL A 50 10.389 -6.014 -10.356 1.00 0.00 H new ATOM 0 HA VAL A 50 10.050 -6.149 -13.323 1.00 0.00 H new ATOM 0 HB VAL A 50 10.764 -4.091 -11.600 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.162 -3.641 -12.036 1.00 0.00 H new ATOM 0 HG12 VAL A 50 12.942 -5.154 -11.123 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.304 -5.210 -12.865 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.459 -2.916 -13.686 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.569 -4.482 -14.524 1.00 0.00 H new ATOM 0 HG23 VAL A 50 9.992 -3.888 -13.952 1.00 0.00 H new ATOM 841 N ASP A 55 11.658 -3.383 -18.413 1.00 0.00 N ATOM 842 CA ASP A 55 11.808 -2.012 -17.850 1.00 0.00 C ATOM 843 C ASP A 55 10.775 -1.804 -16.743 1.00 0.00 C ATOM 844 O ASP A 55 9.942 -2.653 -16.492 1.00 0.00 O ATOM 845 CB ASP A 55 11.580 -0.978 -18.952 1.00 0.00 C ATOM 846 CG ASP A 55 12.374 0.293 -18.644 1.00 0.00 C ATOM 847 OD1 ASP A 55 11.931 1.356 -19.045 1.00 0.00 O ATOM 848 OD2 ASP A 55 13.413 0.183 -18.012 1.00 0.00 O ATOM 0 HA ASP A 55 12.813 -1.895 -17.443 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.888 -1.386 -19.915 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.518 -0.744 -19.030 1.00 0.00 H new ATOM 854 N ASP A 56 10.819 -0.685 -16.076 1.00 0.00 N ATOM 855 CA ASP A 56 9.835 -0.434 -14.984 1.00 0.00 C ATOM 856 C ASP A 56 8.422 -0.350 -15.573 1.00 0.00 C ATOM 857 O ASP A 56 7.564 -1.147 -15.251 1.00 0.00 O ATOM 858 CB ASP A 56 10.178 0.877 -14.277 1.00 0.00 C ATOM 859 CG ASP A 56 11.532 0.742 -13.579 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.009 -0.375 -13.465 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.070 1.758 -13.174 1.00 0.00 O ATOM 0 H ASP A 56 11.491 0.065 -16.238 1.00 0.00 H new ATOM 0 HA ASP A 56 9.876 -1.252 -14.265 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.209 1.694 -14.998 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.405 1.123 -13.549 1.00 0.00 H new ATOM 867 N LEU A 57 8.168 0.593 -16.444 1.00 0.00 N ATOM 868 CA LEU A 57 6.804 0.678 -17.042 1.00 0.00 C ATOM 869 C LEU A 57 6.558 -0.558 -17.895 1.00 0.00 C ATOM 870 O LEU A 57 5.489 -1.135 -17.879 1.00 0.00 O ATOM 871 CB LEU A 57 6.670 1.931 -17.915 1.00 0.00 C ATOM 872 CG LEU A 57 5.344 1.876 -18.690 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.165 2.164 -17.757 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.368 2.913 -19.814 1.00 0.00 C ATOM 0 H LEU A 57 8.834 1.297 -16.762 1.00 0.00 H new ATOM 0 HA LEU A 57 6.070 0.735 -16.238 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.703 2.826 -17.293 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.507 1.994 -18.610 1.00 0.00 H new ATOM 0 HG LEU A 57 5.224 0.877 -19.110 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.234 2.121 -18.323 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.141 1.420 -16.961 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.279 3.157 -17.322 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.428 2.875 -20.364 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.499 3.908 -19.388 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.194 2.696 -20.491 1.00 0.00 H new ATOM 886 N GLU A 58 7.542 -0.980 -18.636 1.00 0.00 N ATOM 887 CA GLU A 58 7.354 -2.186 -19.475 1.00 0.00 C ATOM 888 C GLU A 58 6.932 -3.323 -18.552 1.00 0.00 C ATOM 889 O GLU A 58 6.121 -4.158 -18.901 1.00 0.00 O ATOM 890 CB GLU A 58 8.672 -2.526 -20.174 1.00 0.00 C ATOM 891 CG GLU A 58 9.029 -1.405 -21.155 1.00 0.00 C ATOM 892 CD GLU A 58 7.956 -1.316 -22.242 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.211 -2.269 -22.390 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.897 -0.294 -22.906 1.00 0.00 O ATOM 0 H GLU A 58 8.462 -0.543 -18.695 1.00 0.00 H new ATOM 0 HA GLU A 58 6.594 -2.022 -20.239 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.467 -2.647 -19.438 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.582 -3.474 -20.704 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.105 -0.455 -20.626 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.003 -1.598 -21.605 1.00 0.00 H new ATOM 902 N THR A 59 7.453 -3.334 -17.355 1.00 0.00 N ATOM 903 CA THR A 59 7.058 -4.383 -16.382 1.00 0.00 C ATOM 904 C THR A 59 5.589 -4.164 -16.026 1.00 0.00 C ATOM 905 O THR A 59 4.803 -5.088 -15.969 1.00 0.00 O ATOM 906 CB THR A 59 7.915 -4.262 -15.123 1.00 0.00 C ATOM 907 OG1 THR A 59 9.012 -5.161 -15.206 1.00 0.00 O ATOM 908 CG2 THR A 59 7.068 -4.587 -13.892 1.00 0.00 C ATOM 0 H THR A 59 8.136 -2.659 -17.012 1.00 0.00 H new ATOM 0 HA THR A 59 7.202 -5.375 -16.811 1.00 0.00 H new ATOM 0 HB THR A 59 8.293 -3.243 -15.038 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.687 -6.082 -15.123 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.681 -4.500 -12.995 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.233 -3.889 -13.830 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.685 -5.604 -13.972 1.00 0.00 H new ATOM 916 N ALA A 60 5.211 -2.932 -15.804 1.00 0.00 N ATOM 917 CA ALA A 60 3.791 -2.642 -15.480 1.00 0.00 C ATOM 918 C ALA A 60 2.951 -3.074 -16.672 1.00 0.00 C ATOM 919 O ALA A 60 1.970 -3.775 -16.539 1.00 0.00 O ATOM 920 CB ALA A 60 3.614 -1.142 -15.249 1.00 0.00 C ATOM 0 H ALA A 60 5.826 -2.119 -15.834 1.00 0.00 H new ATOM 0 HA ALA A 60 3.486 -3.174 -14.579 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.571 -0.931 -15.011 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.247 -0.824 -14.420 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.898 -0.599 -16.151 1.00 0.00 H new ATOM 926 N LEU A 61 3.359 -2.681 -17.845 1.00 0.00 N ATOM 927 CA LEU A 61 2.621 -3.084 -19.067 1.00 0.00 C ATOM 928 C LEU A 61 2.622 -4.609 -19.136 1.00 0.00 C ATOM 929 O LEU A 61 1.648 -5.229 -19.513 1.00 0.00 O ATOM 930 CB LEU A 61 3.325 -2.490 -20.291 1.00 0.00 C ATOM 931 CG LEU A 61 3.147 -0.969 -20.281 1.00 0.00 C ATOM 932 CD1 LEU A 61 4.065 -0.327 -21.321 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.696 -0.621 -20.618 1.00 0.00 C ATOM 0 H LEU A 61 4.177 -2.094 -18.008 1.00 0.00 H new ATOM 0 HA LEU A 61 1.594 -2.720 -19.045 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.385 -2.745 -20.276 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.909 -2.912 -21.206 1.00 0.00 H new ATOM 0 HG LEU A 61 3.400 -0.591 -19.290 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.931 0.755 -21.306 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.102 -0.567 -21.088 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.817 -0.710 -22.311 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.570 0.462 -20.611 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.449 -1.008 -21.607 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.033 -1.068 -19.877 1.00 0.00 H new ATOM 945 N ARG A 62 3.709 -5.215 -18.745 1.00 0.00 N ATOM 946 CA ARG A 62 3.787 -6.699 -18.752 1.00 0.00 C ATOM 947 C ARG A 62 2.789 -7.264 -17.739 1.00 0.00 C ATOM 948 O ARG A 62 1.998 -8.133 -18.048 1.00 0.00 O ATOM 949 CB ARG A 62 5.203 -7.125 -18.357 1.00 0.00 C ATOM 950 CG ARG A 62 5.283 -8.648 -18.248 1.00 0.00 C ATOM 951 CD ARG A 62 6.633 -9.035 -17.643 1.00 0.00 C ATOM 952 NE ARG A 62 6.712 -10.517 -17.511 1.00 0.00 N ATOM 953 CZ ARG A 62 7.816 -11.079 -17.105 1.00 0.00 C ATOM 954 NH1 ARG A 62 8.857 -10.343 -16.824 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.881 -12.376 -16.979 1.00 0.00 N ATOM 0 H ARG A 62 4.551 -4.741 -18.419 1.00 0.00 H new ATOM 0 HA ARG A 62 3.550 -7.077 -19.747 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.918 -6.768 -19.098 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.476 -6.670 -17.405 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.470 -9.024 -17.626 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.168 -9.102 -19.232 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.444 -8.672 -18.274 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.754 -8.565 -16.667 1.00 0.00 H new ATOM 0 HE ARG A 62 5.901 -11.093 -17.739 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.806 -9.329 -16.922 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.721 -10.782 -16.506 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.068 -12.951 -17.198 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.745 -12.815 -16.661 1.00 0.00 H new ATOM 969 N ALA A 63 2.822 -6.775 -16.528 1.00 0.00 N ATOM 970 CA ALA A 63 1.878 -7.287 -15.498 1.00 0.00 C ATOM 971 C ALA A 63 0.466 -6.808 -15.813 1.00 0.00 C ATOM 972 O ALA A 63 -0.507 -7.468 -15.508 1.00 0.00 O ATOM 973 CB ALA A 63 2.287 -6.778 -14.115 1.00 0.00 C ATOM 0 H ALA A 63 3.460 -6.046 -16.210 1.00 0.00 H new ATOM 0 HA ALA A 63 1.905 -8.377 -15.504 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.591 -7.157 -13.367 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.294 -7.125 -13.883 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.268 -5.688 -14.108 1.00 0.00 H new ATOM 979 N THR A 64 0.340 -5.667 -16.424 1.00 0.00 N ATOM 980 CA THR A 64 -1.015 -5.158 -16.750 1.00 0.00 C ATOM 981 C THR A 64 -1.771 -6.249 -17.500 1.00 0.00 C ATOM 982 O THR A 64 -2.914 -6.544 -17.210 1.00 0.00 O ATOM 983 CB THR A 64 -0.879 -3.917 -17.629 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.029 -2.983 -16.982 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.250 -3.284 -17.851 1.00 0.00 C ATOM 0 H THR A 64 1.114 -5.067 -16.711 1.00 0.00 H new ATOM 0 HA THR A 64 -1.557 -4.895 -15.842 1.00 0.00 H new ATOM 0 HB THR A 64 -0.457 -4.200 -18.593 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.820 -3.416 -16.754 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.145 -2.399 -18.479 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.907 -4.002 -18.342 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.679 -2.998 -16.890 1.00 0.00 H new ATOM 993 N GLN A 65 -1.129 -6.868 -18.447 1.00 0.00 N ATOM 994 CA GLN A 65 -1.787 -7.961 -19.210 1.00 0.00 C ATOM 995 C GLN A 65 -1.816 -9.248 -18.374 1.00 0.00 C ATOM 996 O GLN A 65 -2.838 -9.877 -18.216 1.00 0.00 O ATOM 997 CB GLN A 65 -1.010 -8.212 -20.504 1.00 0.00 C ATOM 998 CG GLN A 65 -1.091 -9.692 -20.879 1.00 0.00 C ATOM 999 CD GLN A 65 -0.566 -9.886 -22.303 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.582 -9.603 -22.584 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -1.365 -10.358 -23.220 1.00 0.00 N ATOM 0 H GLN A 65 -0.170 -6.662 -18.727 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.810 -7.667 -19.443 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -1.419 -7.601 -21.309 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.031 -7.916 -20.377 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.505 -10.288 -20.179 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.122 -10.040 -20.809 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -2.328 -10.595 -22.984 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -1.026 -10.490 -24.173 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.687 -9.659 -17.868 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.631 -10.926 -17.081 1.00 0.00 C ATOM 1012 C GLU A 66 -1.553 -10.872 -15.856 1.00 0.00 C ATOM 1013 O GLU A 66 -2.190 -11.851 -15.518 1.00 0.00 O ATOM 1014 CB GLU A 66 0.808 -11.161 -16.617 1.00 0.00 C ATOM 1015 CG GLU A 66 0.921 -12.545 -15.975 1.00 0.00 C ATOM 1016 CD GLU A 66 2.336 -12.740 -15.429 1.00 0.00 C ATOM 1017 OE1 GLU A 66 2.612 -13.815 -14.924 1.00 0.00 O ATOM 1018 OE2 GLU A 66 3.119 -11.809 -15.524 1.00 0.00 O ATOM 0 H GLU A 66 0.204 -9.171 -17.965 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.968 -11.741 -17.722 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.491 -11.085 -17.463 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.100 -10.392 -15.902 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.192 -12.645 -15.171 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.693 -13.318 -16.709 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.621 -9.765 -15.170 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.494 -9.711 -13.959 1.00 0.00 C ATOM 1028 C GLU A 67 -3.968 -9.529 -14.341 1.00 0.00 C ATOM 1029 O GLU A 67 -4.815 -10.302 -13.937 1.00 0.00 O ATOM 1030 CB GLU A 67 -2.063 -8.558 -13.052 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.956 -9.029 -12.102 1.00 0.00 C ATOM 1032 CD GLU A 67 0.304 -9.357 -12.903 1.00 0.00 C ATOM 1033 OE1 GLU A 67 0.421 -8.866 -14.011 1.00 0.00 O ATOM 1034 OE2 GLU A 67 1.133 -10.093 -12.393 1.00 0.00 O ATOM 0 H GLU A 67 -1.118 -8.905 -15.389 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.387 -10.658 -13.431 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.706 -7.723 -13.655 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.916 -8.196 -12.479 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.740 -8.254 -11.367 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.287 -9.909 -11.550 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.297 -8.507 -15.087 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.731 -8.290 -15.448 1.00 0.00 C ATOM 1044 C ALA A 68 -6.022 -8.788 -16.861 1.00 0.00 C ATOM 1045 O ALA A 68 -7.159 -8.829 -17.287 1.00 0.00 O ATOM 1046 CB ALA A 68 -6.059 -6.804 -15.376 1.00 0.00 C ATOM 0 H ALA A 68 -3.643 -7.819 -15.459 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.345 -8.849 -14.742 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.105 -6.649 -15.640 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.882 -6.441 -14.363 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.424 -6.257 -16.073 1.00 0.00 H new ATOM 1052 N GLY A 69 -5.023 -9.171 -17.598 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.286 -9.663 -18.978 1.00 0.00 C ATOM 1054 C GLY A 69 -5.379 -8.479 -19.940 1.00 0.00 C ATOM 1055 O GLY A 69 -5.760 -8.633 -21.083 1.00 0.00 O ATOM 0 H GLY A 69 -4.044 -9.166 -17.311 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.489 -10.337 -19.292 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.214 -10.235 -19.000 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.034 -7.292 -19.502 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.121 -6.129 -20.426 1.00 0.00 C ATOM 1061 C ILE A 70 -3.720 -5.766 -20.916 1.00 0.00 C ATOM 1062 O ILE A 70 -2.815 -5.545 -20.137 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.708 -4.918 -19.702 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.883 -5.347 -18.828 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.218 -3.917 -20.739 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.252 -4.192 -17.901 1.00 0.00 C ATOM 0 H ILE A 70 -4.702 -7.084 -18.560 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.762 -6.398 -21.265 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.935 -4.468 -19.079 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.736 -5.620 -19.449 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.618 -6.229 -18.245 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.639 -3.049 -20.231 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.392 -3.600 -21.375 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -6.987 -4.387 -21.351 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.091 -4.485 -17.270 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.397 -3.942 -17.274 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.532 -3.323 -18.496 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.538 -5.689 -22.204 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.198 -5.330 -22.740 1.00 0.00 C ATOM 1080 C GLU A 71 -2.189 -3.854 -23.122 1.00 0.00 C ATOM 1081 O GLU A 71 -3.221 -3.233 -23.279 1.00 0.00 O ATOM 1082 CB GLU A 71 -1.886 -6.180 -23.971 1.00 0.00 C ATOM 1083 CG GLU A 71 -2.855 -5.829 -25.101 1.00 0.00 C ATOM 1084 CD GLU A 71 -2.615 -6.766 -26.286 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -1.561 -6.665 -26.891 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -3.490 -7.568 -26.570 1.00 0.00 O ATOM 0 H GLU A 71 -4.258 -5.859 -22.907 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.441 -5.517 -21.978 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.859 -6.007 -24.293 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.969 -7.238 -23.724 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.884 -5.920 -24.754 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.713 -4.793 -25.408 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.028 -3.290 -23.270 1.00 0.00 N ATOM 1095 CA ALA A 72 -0.944 -1.853 -23.639 1.00 0.00 C ATOM 1096 C ALA A 72 -1.624 -1.639 -24.992 1.00 0.00 C ATOM 1097 O ALA A 72 -2.060 -0.552 -25.315 1.00 0.00 O ATOM 1098 CB ALA A 72 0.522 -1.437 -23.729 1.00 0.00 C ATOM 0 H ALA A 72 -0.131 -3.762 -23.151 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.444 -1.249 -22.882 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.585 -0.383 -24.000 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.004 -1.593 -22.764 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.025 -2.037 -24.488 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.715 -2.669 -25.786 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.360 -2.533 -27.121 1.00 0.00 C ATOM 1106 C GLY A 73 -3.756 -1.926 -26.966 1.00 0.00 C ATOM 1107 O GLY A 73 -4.212 -1.184 -27.812 1.00 0.00 O ATOM 0 H GLY A 73 -1.369 -3.603 -25.566 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.749 -1.902 -27.767 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.430 -3.509 -27.602 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.439 -2.231 -25.895 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.804 -1.661 -25.706 1.00 0.00 C ATOM 1113 C GLN A 74 -5.759 -0.535 -24.671 1.00 0.00 C ATOM 1114 O GLN A 74 -6.767 0.070 -24.360 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.776 -2.756 -25.251 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.150 -3.591 -24.134 1.00 0.00 C ATOM 1117 CD GLN A 74 -6.979 -4.860 -23.930 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.518 -5.815 -23.336 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -8.197 -4.910 -24.396 1.00 0.00 N ATOM 0 H GLN A 74 -4.114 -2.845 -25.148 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.153 -1.256 -26.656 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.704 -2.305 -24.900 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.032 -3.398 -26.094 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.123 -3.851 -24.390 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.112 -3.014 -23.210 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.586 -4.110 -24.895 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.760 -5.750 -24.261 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.602 -0.240 -24.138 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.508 0.856 -23.129 1.00 0.00 C ATOM 1130 C LEU A 75 -3.662 2.007 -23.660 1.00 0.00 C ATOM 1131 O LEU A 75 -2.691 1.813 -24.363 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.814 0.358 -21.864 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.527 -0.862 -21.310 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.547 -1.647 -20.446 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.707 -0.408 -20.450 1.00 0.00 C ATOM 0 H LEU A 75 -3.722 -0.708 -24.356 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.526 1.184 -22.919 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.776 0.110 -22.086 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.800 1.149 -21.115 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.891 -1.487 -22.126 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.045 -2.528 -20.040 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.696 -1.958 -21.052 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.199 -1.017 -19.627 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.223 -1.281 -20.050 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.342 0.207 -19.627 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.399 0.174 -21.059 1.00 0.00 H new ATOM 1147 N THR A 76 -3.993 3.200 -23.262 1.00 0.00 N ATOM 1148 CA THR A 76 -3.185 4.376 -23.662 1.00 0.00 C ATOM 1149 C THR A 76 -2.613 4.952 -22.368 1.00 0.00 C ATOM 1150 O THR A 76 -3.344 5.256 -21.445 1.00 0.00 O ATOM 1151 CB THR A 76 -4.068 5.406 -24.380 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.363 5.932 -25.495 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.436 6.550 -23.429 1.00 0.00 C ATOM 0 H THR A 76 -4.797 3.411 -22.671 1.00 0.00 H new ATOM 0 HA THR A 76 -2.389 4.104 -24.355 1.00 0.00 H new ATOM 0 HB THR A 76 -4.983 4.916 -24.713 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.925 6.589 -25.957 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.062 7.272 -23.953 1.00 0.00 H new ATOM 0 HG22 THR A 76 -4.981 6.151 -22.573 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.527 7.042 -23.083 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.323 5.069 -22.255 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.765 5.584 -20.977 1.00 0.00 C ATOM 1163 C ILE A 77 -0.890 7.097 -20.912 1.00 0.00 C ATOM 1164 O ILE A 77 -0.193 7.823 -21.594 1.00 0.00 O ATOM 1165 CB ILE A 77 0.705 5.209 -20.836 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.872 3.703 -21.055 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.172 5.589 -19.425 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.326 3.041 -19.752 1.00 0.00 C ATOM 0 H ILE A 77 -0.641 4.836 -22.977 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.334 5.132 -20.165 1.00 0.00 H new ATOM 0 HB ILE A 77 1.302 5.740 -21.577 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.070 3.267 -21.387 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.603 3.519 -21.842 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.223 5.327 -19.307 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.046 6.662 -19.277 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.578 5.049 -18.687 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.444 1.969 -19.910 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.279 3.469 -19.439 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.579 3.213 -18.977 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.741 7.576 -20.059 1.00 0.00 N ATOM 1181 CA ILE A 78 -1.881 9.043 -19.901 1.00 0.00 C ATOM 1182 C ILE A 78 -0.561 9.564 -19.379 1.00 0.00 C ATOM 1183 O ILE A 78 -0.199 10.709 -19.563 1.00 0.00 O ATOM 1184 CB ILE A 78 -2.960 9.352 -18.873 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.338 9.167 -19.505 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.785 10.789 -18.381 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.511 7.699 -19.889 1.00 0.00 C ATOM 0 H ILE A 78 -2.348 7.014 -19.462 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.150 9.503 -20.852 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.873 8.672 -18.026 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.118 9.468 -18.805 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.437 9.802 -20.386 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.555 11.018 -17.644 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.801 10.900 -17.925 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.874 11.475 -19.223 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.492 7.554 -20.342 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.737 7.416 -20.602 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.428 7.077 -18.997 1.00 0.00 H new ATOM 1199 N GLU A 79 0.143 8.717 -18.691 1.00 0.00 N ATOM 1200 CA GLU A 79 1.436 9.130 -18.101 1.00 0.00 C ATOM 1201 C GLU A 79 1.177 10.310 -17.184 1.00 0.00 C ATOM 1202 O GLU A 79 0.365 10.239 -16.283 1.00 0.00 O ATOM 1203 CB GLU A 79 2.414 9.540 -19.203 1.00 0.00 C ATOM 1204 CG GLU A 79 2.751 8.322 -20.059 1.00 0.00 C ATOM 1205 CD GLU A 79 3.854 8.681 -21.053 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.359 7.779 -21.699 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.176 9.853 -21.152 1.00 0.00 O ATOM 0 H GLU A 79 -0.125 7.749 -18.512 1.00 0.00 H new ATOM 0 HA GLU A 79 1.874 8.301 -17.545 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.975 10.323 -19.821 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.322 9.952 -18.764 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.075 7.497 -19.424 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.863 7.984 -20.593 1.00 0.00 H new ATOM 1215 N GLY A 80 1.846 11.396 -17.408 1.00 0.00 N ATOM 1216 CA GLY A 80 1.621 12.585 -16.545 1.00 0.00 C ATOM 1217 C GLY A 80 1.912 12.209 -15.094 1.00 0.00 C ATOM 1218 O GLY A 80 2.773 12.782 -14.457 1.00 0.00 O ATOM 0 H GLY A 80 2.538 11.516 -18.148 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.267 13.405 -16.858 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.593 12.933 -16.645 1.00 0.00 H new ATOM 1222 N PHE A 81 1.207 11.243 -14.564 1.00 0.00 N ATOM 1223 CA PHE A 81 1.465 10.840 -13.157 1.00 0.00 C ATOM 1224 C PHE A 81 2.287 9.551 -13.141 1.00 0.00 C ATOM 1225 O PHE A 81 1.847 8.514 -13.596 1.00 0.00 O ATOM 1226 CB PHE A 81 0.137 10.596 -12.437 1.00 0.00 C ATOM 1227 CG PHE A 81 0.405 10.346 -10.971 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.736 9.059 -10.529 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.324 11.401 -10.054 1.00 0.00 C ATOM 1230 CE1 PHE A 81 0.986 8.827 -9.171 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.575 11.169 -8.696 1.00 0.00 C ATOM 1232 CZ PHE A 81 0.906 9.881 -8.255 1.00 0.00 C ATOM 0 H PHE A 81 0.472 10.723 -15.042 1.00 0.00 H new ATOM 0 HA PHE A 81 2.013 11.635 -12.651 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.519 11.458 -12.557 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.377 9.741 -12.876 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.798 8.245 -11.236 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.068 12.394 -10.394 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.241 7.834 -8.831 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.513 11.983 -7.989 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.099 9.702 -7.208 1.00 0.00 H new ATOM 1242 N LYS A 82 3.469 9.609 -12.597 1.00 0.00 N ATOM 1243 CA LYS A 82 4.322 8.393 -12.518 1.00 0.00 C ATOM 1244 C LYS A 82 5.242 8.532 -11.320 1.00 0.00 C ATOM 1245 O LYS A 82 6.133 9.355 -11.306 1.00 0.00 O ATOM 1246 CB LYS A 82 5.172 8.250 -13.785 1.00 0.00 C ATOM 1247 CG LYS A 82 6.177 7.096 -13.622 1.00 0.00 C ATOM 1248 CD LYS A 82 7.356 7.522 -12.735 1.00 0.00 C ATOM 1249 CE LYS A 82 8.601 6.714 -13.110 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.816 7.423 -12.618 1.00 0.00 N ATOM 0 H LYS A 82 3.883 10.453 -12.201 1.00 0.00 H new ATOM 0 HA LYS A 82 3.687 7.512 -12.421 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.528 8.063 -14.645 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.704 9.181 -13.982 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.678 6.233 -13.182 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.545 6.787 -14.600 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.551 8.587 -12.859 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.110 7.363 -11.685 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.546 5.717 -12.673 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.653 6.586 -14.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.664 6.876 -12.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.869 8.365 -13.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.765 7.523 -11.584 1.00 0.00 H new ATOM 1264 N ARG A 83 5.052 7.728 -10.325 1.00 0.00 N ATOM 1265 CA ARG A 83 5.935 7.806 -9.140 1.00 0.00 C ATOM 1266 C ARG A 83 6.119 6.407 -8.574 1.00 0.00 C ATOM 1267 O ARG A 83 5.418 5.484 -8.936 1.00 0.00 O ATOM 1268 CB ARG A 83 5.326 8.729 -8.082 1.00 0.00 C ATOM 1269 CG ARG A 83 5.353 10.177 -8.589 1.00 0.00 C ATOM 1270 CD ARG A 83 6.805 10.611 -8.819 1.00 0.00 C ATOM 1271 NE ARG A 83 7.036 11.934 -8.175 1.00 0.00 N ATOM 1272 CZ ARG A 83 6.611 13.023 -8.753 1.00 0.00 C ATOM 1273 NH1 ARG A 83 5.967 12.952 -9.887 1.00 0.00 N ATOM 1274 NH2 ARG A 83 6.829 14.183 -8.197 1.00 0.00 N ATOM 0 H ARG A 83 4.322 7.017 -10.279 1.00 0.00 H new ATOM 0 HA ARG A 83 6.902 8.215 -9.431 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.301 8.427 -7.867 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.884 8.649 -7.149 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.786 10.259 -9.516 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.876 10.836 -7.864 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.487 9.869 -8.405 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.012 10.673 -9.887 1.00 0.00 H new ATOM 0 HE ARG A 83 7.526 11.988 -7.282 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.796 12.045 -10.321 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.635 13.804 -10.339 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.331 14.238 -7.311 1.00 0.00 H new ATOM 0 HH22 ARG A 83 6.497 15.035 -8.648 1.00 0.00 H new ATOM 1288 N GLU A 84 7.061 6.230 -7.699 1.00 0.00 N ATOM 1289 CA GLU A 84 7.282 4.877 -7.137 1.00 0.00 C ATOM 1290 C GLU A 84 6.314 4.637 -5.982 1.00 0.00 C ATOM 1291 O GLU A 84 6.509 5.109 -4.880 1.00 0.00 O ATOM 1292 CB GLU A 84 8.721 4.763 -6.642 1.00 0.00 C ATOM 1293 CG GLU A 84 9.676 4.956 -7.820 1.00 0.00 C ATOM 1294 CD GLU A 84 9.928 6.450 -8.039 1.00 0.00 C ATOM 1295 OE1 GLU A 84 10.673 6.778 -8.947 1.00 0.00 O ATOM 1296 OE2 GLU A 84 9.372 7.240 -7.294 1.00 0.00 O ATOM 0 H GLU A 84 7.684 6.959 -7.350 1.00 0.00 H new ATOM 0 HA GLU A 84 7.107 4.128 -7.909 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.915 5.513 -5.875 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.884 3.788 -6.183 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.618 4.443 -7.625 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.252 4.513 -8.721 1.00 0.00 H new ATOM 1304 N LEU A 85 5.281 3.878 -6.226 1.00 0.00 N ATOM 1305 CA LEU A 85 4.308 3.570 -5.150 1.00 0.00 C ATOM 1306 C LEU A 85 4.998 2.604 -4.191 1.00 0.00 C ATOM 1307 O LEU A 85 5.559 1.613 -4.611 1.00 0.00 O ATOM 1308 CB LEU A 85 3.072 2.893 -5.758 1.00 0.00 C ATOM 1309 CG LEU A 85 1.844 3.164 -4.881 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.913 4.181 -5.551 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.071 1.867 -4.665 1.00 0.00 C ATOM 0 H LEU A 85 5.071 3.457 -7.131 1.00 0.00 H new ATOM 0 HA LEU A 85 3.991 4.476 -4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.900 3.269 -6.766 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.239 1.819 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 85 2.188 3.564 -3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.048 4.359 -4.912 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.448 5.118 -5.706 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.579 3.791 -6.512 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.199 2.063 -4.041 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.747 1.472 -5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.714 1.138 -4.171 1.00 0.00 H new ATOM 1323 N ASN A 86 5.001 2.881 -2.919 1.00 0.00 N ATOM 1324 CA ASN A 86 5.702 1.957 -1.982 1.00 0.00 C ATOM 1325 C ASN A 86 4.785 1.567 -0.827 1.00 0.00 C ATOM 1326 O ASN A 86 4.206 2.402 -0.161 1.00 0.00 O ATOM 1327 CB ASN A 86 6.956 2.644 -1.448 1.00 0.00 C ATOM 1328 CG ASN A 86 7.907 2.903 -2.618 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.577 2.474 -3.808 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 8.959 3.487 -2.449 1.00 0.00 N flip ATOM 0 H ASN A 86 4.557 3.693 -2.490 1.00 0.00 H new ATOM 0 HA ASN A 86 5.981 1.049 -2.516 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.694 3.582 -0.959 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.440 2.018 -0.698 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.214 3.820 -1.519 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.588 3.644 -3.237 1.00 0.00 H new ATOM 1480 N THR A 95 9.423 -1.428 -3.526 1.00 0.00 N ATOM 1481 CA THR A 95 9.050 -0.258 -4.369 1.00 0.00 C ATOM 1482 C THR A 95 8.110 -0.700 -5.485 1.00 0.00 C ATOM 1483 O THR A 95 8.212 -1.785 -6.020 1.00 0.00 O ATOM 1484 CB THR A 95 10.303 0.380 -4.977 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.956 1.169 -3.992 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.904 1.260 -6.166 1.00 0.00 C ATOM 0 HA THR A 95 8.546 0.477 -3.741 1.00 0.00 H new ATOM 0 HB THR A 95 10.981 -0.401 -5.321 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.759 1.577 -4.379 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.796 1.714 -6.598 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.406 0.650 -6.919 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.226 2.043 -5.827 1.00 0.00 H new ATOM 1494 N VAL A 96 7.187 0.148 -5.827 1.00 0.00 N ATOM 1495 CA VAL A 96 6.210 -0.175 -6.899 1.00 0.00 C ATOM 1496 C VAL A 96 5.908 1.100 -7.687 1.00 0.00 C ATOM 1497 O VAL A 96 5.752 2.153 -7.116 1.00 0.00 O ATOM 1498 CB VAL A 96 4.934 -0.711 -6.249 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.775 -0.689 -7.247 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.174 -2.152 -5.783 1.00 0.00 C ATOM 0 H VAL A 96 7.066 1.067 -5.402 1.00 0.00 H new ATOM 0 HA VAL A 96 6.612 -0.928 -7.577 1.00 0.00 H new ATOM 0 HB VAL A 96 4.678 -0.079 -5.399 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.875 -1.074 -6.768 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.600 0.334 -7.579 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.023 -1.312 -8.106 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.267 -2.540 -5.318 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.437 -2.772 -6.640 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.989 -2.169 -5.059 1.00 0.00 H new ATOM 1510 N ILE A 97 5.829 1.026 -8.989 1.00 0.00 N ATOM 1511 CA ILE A 97 5.540 2.262 -9.774 1.00 0.00 C ATOM 1512 C ILE A 97 4.149 2.155 -10.392 1.00 0.00 C ATOM 1513 O ILE A 97 3.781 1.141 -10.949 1.00 0.00 O ATOM 1514 CB ILE A 97 6.591 2.431 -10.865 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.927 1.912 -10.336 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.727 3.920 -11.211 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.066 2.520 -11.147 1.00 0.00 C ATOM 0 H ILE A 97 5.950 0.175 -9.538 1.00 0.00 H new ATOM 0 HA ILE A 97 5.571 3.131 -9.117 1.00 0.00 H new ATOM 0 HB ILE A 97 6.299 1.877 -11.757 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.038 2.170 -9.283 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.959 0.825 -10.403 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.478 4.045 -11.991 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.769 4.300 -11.565 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.031 4.474 -10.323 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.019 2.150 -10.770 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.957 2.240 -12.195 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.037 3.606 -11.057 1.00 0.00 H new ATOM 1529 N TYR A 98 3.369 3.193 -10.270 1.00 0.00 N ATOM 1530 CA TYR A 98 1.979 3.168 -10.811 1.00 0.00 C ATOM 1531 C TYR A 98 1.815 4.213 -11.924 1.00 0.00 C ATOM 1532 O TYR A 98 2.155 5.369 -11.765 1.00 0.00 O ATOM 1533 CB TYR A 98 1.020 3.494 -9.655 1.00 0.00 C ATOM 1534 CG TYR A 98 0.626 2.244 -8.883 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.299 1.023 -9.067 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.427 2.318 -7.964 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.914 -0.109 -8.337 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.805 1.189 -7.237 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.138 -0.025 -7.422 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.517 -1.140 -6.701 1.00 0.00 O ATOM 0 H TYR A 98 3.637 4.066 -9.815 1.00 0.00 H new ATOM 0 HA TYR A 98 1.762 2.186 -11.232 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.494 4.206 -8.979 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.125 3.976 -10.049 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.114 0.958 -9.772 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.949 3.252 -7.817 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.430 -1.046 -8.482 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.617 1.253 -6.528 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.263 -0.909 -6.109 1.00 0.00 H new ATOM 1550 N TRP A 99 1.286 3.805 -13.050 1.00 0.00 N ATOM 1551 CA TRP A 99 1.079 4.752 -14.188 1.00 0.00 C ATOM 1552 C TRP A 99 -0.411 4.891 -14.481 1.00 0.00 C ATOM 1553 O TRP A 99 -1.199 4.030 -14.151 1.00 0.00 O ATOM 1554 CB TRP A 99 1.758 4.212 -15.444 1.00 0.00 C ATOM 1555 CG TRP A 99 3.184 4.627 -15.468 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.636 5.826 -15.890 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.351 3.861 -15.073 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.013 5.848 -15.770 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.500 4.657 -15.271 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.520 2.564 -14.564 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.776 4.183 -14.972 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.800 2.081 -14.266 1.00 0.00 C ATOM 1563 CH2 TRP A 99 6.927 2.889 -14.469 1.00 0.00 C ATOM 0 H TRP A 99 0.986 2.847 -13.231 1.00 0.00 H new ATOM 0 HA TRP A 99 1.504 5.718 -13.915 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.687 3.125 -15.467 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.247 4.584 -16.332 1.00 0.00 H new ATOM 0 HD1 TRP A 99 3.023 6.635 -16.260 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.597 6.646 -16.020 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.658 1.935 -14.401 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.641 4.811 -15.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 5.919 1.080 -13.878 1.00 0.00 H new ATOM 0 HH2 TRP A 99 7.912 2.511 -14.237 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.801 5.951 -15.128 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.237 6.119 -15.471 1.00 0.00 C ATOM 1576 C LEU A 100 -2.503 5.444 -16.817 1.00 0.00 C ATOM 1577 O LEU A 100 -1.767 5.619 -17.767 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.576 7.610 -15.554 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.583 8.217 -14.152 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.787 9.729 -14.254 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.735 7.611 -13.349 1.00 0.00 C ATOM 0 H LEU A 100 -0.188 6.707 -15.434 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.860 5.661 -14.703 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.846 8.124 -16.179 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.550 7.745 -16.024 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.634 8.007 -13.658 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.792 10.164 -13.254 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.976 10.167 -14.836 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.738 9.936 -14.744 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.745 8.040 -12.347 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.680 7.829 -13.847 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.602 6.531 -13.280 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.544 4.663 -16.902 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.848 3.967 -18.184 1.00 0.00 C ATOM 1595 C ALA A 101 -5.360 3.957 -18.411 1.00 0.00 C ATOM 1596 O ALA A 101 -6.139 3.856 -17.486 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.337 2.524 -18.112 1.00 0.00 C ATOM 0 H ALA A 101 -4.197 4.477 -16.141 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.359 4.488 -19.007 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.558 2.013 -19.049 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.260 2.527 -17.946 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.829 2.004 -17.290 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.776 4.059 -19.642 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.233 4.054 -19.944 1.00 0.00 C ATOM 1605 C GLU A 102 -7.539 2.958 -20.964 1.00 0.00 C ATOM 1606 O GLU A 102 -6.832 2.793 -21.938 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.632 5.410 -20.529 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.134 5.424 -20.816 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.505 6.727 -21.526 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.654 6.860 -21.912 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.633 7.567 -21.673 1.00 0.00 O ATOM 0 H GLU A 102 -5.166 4.146 -20.455 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.793 3.867 -19.028 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.378 6.207 -19.831 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.075 5.600 -21.446 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.405 4.570 -21.436 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.694 5.332 -19.885 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.596 2.221 -20.765 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.940 1.156 -21.745 1.00 0.00 C ATOM 1621 C VAL A 103 -9.854 1.745 -22.815 1.00 0.00 C ATOM 1622 O VAL A 103 -10.971 2.141 -22.545 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.661 -0.002 -21.044 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.708 -0.710 -20.088 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.844 0.531 -20.249 1.00 0.00 C ATOM 0 H VAL A 103 -9.232 2.309 -19.972 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.024 0.777 -22.198 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.009 -0.704 -21.802 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.230 -1.530 -19.595 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.858 -1.103 -20.646 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.353 -0.003 -19.338 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.352 -0.296 -19.754 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.490 1.240 -19.501 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.539 1.032 -20.923 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.396 1.791 -24.032 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.246 2.337 -25.120 1.00 0.00 C ATOM 1637 C LYS A 104 -11.390 1.357 -25.357 1.00 0.00 C ATOM 1638 O LYS A 104 -12.319 1.624 -26.093 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.407 2.497 -26.390 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.841 1.139 -26.806 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.792 1.341 -27.903 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.523 1.946 -27.297 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.368 1.043 -27.561 1.00 0.00 N ATOM 0 H LYS A 104 -8.470 1.474 -24.320 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.646 3.314 -24.848 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.019 2.908 -27.193 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.595 3.202 -26.215 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.393 0.640 -25.946 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.642 0.494 -27.167 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.561 0.388 -28.379 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.185 1.998 -28.679 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.335 2.930 -27.727 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.651 2.086 -26.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.814 0.924 -26.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.717 0.116 -27.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.765 1.457 -28.300 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.325 0.225 -24.712 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.398 -0.790 -24.857 1.00 0.00 C ATOM 1659 C ASP A 105 -13.239 -0.814 -23.584 1.00 0.00 C ATOM 1660 O ASP A 105 -12.861 -1.399 -22.589 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.773 -2.169 -25.071 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.349 -2.324 -26.532 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -10.710 -3.317 -26.838 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -11.674 -1.451 -27.319 1.00 0.00 O ATOM 0 H ASP A 105 -10.565 -0.040 -24.085 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.025 -0.538 -25.712 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.910 -2.293 -24.417 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.488 -2.948 -24.806 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.380 -0.190 -23.606 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.246 -0.185 -22.399 1.00 0.00 C ATOM 1672 C TYR A 106 -15.491 -1.636 -21.984 1.00 0.00 C ATOM 1673 O TYR A 106 -15.632 -1.951 -20.819 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.580 0.488 -22.737 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.388 0.691 -21.477 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.175 -0.352 -20.979 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.357 1.923 -20.817 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.933 -0.163 -19.818 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.114 2.113 -19.653 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.902 1.070 -19.154 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.650 1.255 -18.009 1.00 0.00 O ATOM 0 H TYR A 106 -14.751 0.318 -24.409 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.768 0.362 -21.587 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.400 1.447 -23.223 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.139 -0.127 -23.443 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.198 -1.303 -21.490 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.750 2.728 -21.204 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.542 -0.968 -19.434 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.089 3.064 -19.141 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.514 2.166 -17.673 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.537 -2.520 -22.942 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.768 -3.959 -22.638 1.00 0.00 C ATOM 1693 C ASP A 107 -14.439 -4.717 -22.700 1.00 0.00 C ATOM 1694 O ASP A 107 -14.407 -5.905 -22.955 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.735 -4.551 -23.666 1.00 0.00 C ATOM 1696 CG ASP A 107 -18.121 -3.934 -23.479 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.348 -3.340 -22.439 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -18.934 -4.066 -24.380 1.00 0.00 O ATOM 0 H ASP A 107 -15.423 -2.304 -23.932 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.194 -4.051 -21.639 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.372 -4.357 -24.675 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -16.789 -5.633 -23.549 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.340 -4.045 -22.477 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.024 -4.740 -22.535 1.00 0.00 C ATOM 1706 C VAL A 108 -12.144 -6.102 -21.860 1.00 0.00 C ATOM 1707 O VAL A 108 -12.953 -6.300 -20.975 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.961 -3.898 -21.828 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.411 -3.590 -20.401 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.640 -4.665 -21.795 1.00 0.00 C ATOM 0 H VAL A 108 -13.298 -3.050 -22.258 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.729 -4.877 -23.576 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.824 -2.963 -22.370 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.651 -2.990 -19.901 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.350 -3.037 -20.427 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.554 -4.523 -19.855 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.883 -4.064 -21.291 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.777 -5.603 -21.256 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.316 -4.876 -22.814 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.355 -7.050 -22.280 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.433 -8.402 -21.677 1.00 0.00 C ATOM 1722 C GLU A 109 -10.458 -8.498 -20.514 1.00 0.00 C ATOM 1723 O GLU A 109 -9.258 -8.555 -20.691 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.083 -9.457 -22.728 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.288 -10.852 -22.136 1.00 0.00 C ATOM 1726 CD GLU A 109 -12.779 -11.090 -21.893 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.578 -10.459 -22.563 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.096 -11.900 -21.036 1.00 0.00 O ATOM 0 H GLU A 109 -10.658 -6.943 -23.017 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.446 -8.577 -21.316 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.710 -9.329 -23.611 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.049 -9.335 -23.051 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.894 -11.608 -22.815 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.737 -10.946 -21.200 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.976 -8.520 -19.329 1.00 0.00 N ATOM 1737 CA ILE A 110 -10.103 -8.618 -18.130 1.00 0.00 C ATOM 1738 C ILE A 110 -9.693 -10.072 -17.908 1.00 0.00 C ATOM 1739 O ILE A 110 -10.339 -10.803 -17.182 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.868 -8.129 -16.899 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.272 -6.662 -17.077 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.982 -8.267 -15.664 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.036 -5.785 -17.080 1.00 0.00 C ATOM 0 H ILE A 110 -11.976 -8.474 -19.132 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.216 -8.004 -18.285 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.768 -8.732 -16.776 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.820 -6.537 -18.011 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.942 -6.360 -16.272 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -10.525 -7.919 -14.786 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.706 -9.313 -15.529 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.081 -7.668 -15.794 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.330 -4.743 -17.207 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.506 -5.900 -16.135 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.382 -6.080 -17.901 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.616 -10.499 -18.505 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.177 -11.907 -18.292 1.00 0.00 C ATOM 1757 C ARG A 111 -7.275 -11.957 -17.068 1.00 0.00 C ATOM 1758 O ARG A 111 -6.432 -11.108 -16.876 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.393 -12.417 -19.495 1.00 0.00 C ATOM 1760 CG ARG A 111 -7.945 -13.779 -19.920 1.00 0.00 C ATOM 1761 CD ARG A 111 -7.713 -14.807 -18.808 1.00 0.00 C ATOM 1762 NE ARG A 111 -6.265 -14.846 -18.458 1.00 0.00 N ATOM 1763 CZ ARG A 111 -5.440 -15.562 -19.171 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -5.882 -16.233 -20.199 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -4.175 -15.608 -18.859 1.00 0.00 N ATOM 0 H ARG A 111 -8.026 -9.943 -19.124 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.058 -12.533 -18.153 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.469 -11.708 -20.320 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.336 -12.503 -19.244 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.010 -13.698 -20.135 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -7.458 -14.108 -20.838 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -8.303 -14.547 -17.929 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.045 -15.792 -19.135 1.00 0.00 H new ATOM 0 HE ARG A 111 -5.919 -14.313 -17.661 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -6.871 -16.197 -20.444 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -5.238 -16.793 -20.757 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -3.828 -15.083 -18.056 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.532 -16.169 -19.418 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.436 -12.940 -16.237 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.572 -13.018 -15.031 1.00 0.00 C ATOM 1781 C LEU A 112 -5.684 -14.256 -15.115 1.00 0.00 C ATOM 1782 O LEU A 112 -6.071 -15.337 -14.719 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.443 -13.106 -13.781 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.604 -12.114 -13.882 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.443 -12.198 -12.607 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.063 -10.689 -14.042 1.00 0.00 C ATOM 0 H LEU A 112 -8.122 -13.688 -16.337 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.949 -12.125 -14.979 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.828 -14.119 -13.667 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.845 -12.890 -12.895 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.217 -12.361 -14.749 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.273 -11.494 -12.670 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.833 -13.210 -12.494 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.822 -11.950 -11.746 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.896 -9.989 -14.113 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.448 -10.434 -13.179 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.460 -10.628 -14.948 1.00 0.00 H new ATOM 1798 N SER A 113 -4.491 -14.109 -15.619 1.00 0.00 N ATOM 1799 CA SER A 113 -3.578 -15.281 -15.714 1.00 0.00 C ATOM 1800 C SER A 113 -3.356 -15.852 -14.310 1.00 0.00 C ATOM 1801 O SER A 113 -3.606 -15.195 -13.321 1.00 0.00 O ATOM 1802 CB SER A 113 -2.237 -14.842 -16.304 1.00 0.00 C ATOM 1803 OG SER A 113 -2.456 -14.261 -17.583 1.00 0.00 O ATOM 0 H SER A 113 -4.109 -13.230 -15.969 1.00 0.00 H new ATOM 0 HA SER A 113 -4.020 -16.041 -16.358 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.753 -14.123 -15.643 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.567 -15.697 -16.390 1.00 0.00 H new ATOM 0 HG SER A 113 -1.599 -13.977 -17.964 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.900 -17.073 -14.215 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.676 -17.680 -12.871 1.00 0.00 C ATOM 1811 C HIS A 114 -2.106 -16.627 -11.916 1.00 0.00 C ATOM 1812 O HIS A 114 -0.917 -16.375 -11.886 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.691 -18.848 -12.990 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.572 -18.663 -11.999 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -0.568 -18.567 -10.628 1.00 0.00 N flip ATOM 1816 CD2 HIS A 114 0.751 -18.521 -12.393 1.00 0.00 C flip ATOM 1817 CE1 HIS A 114 0.731 -18.369 -10.181 1.00 0.00 C flip ATOM 1818 NE2 HIS A 114 1.488 -18.348 -11.279 1.00 0.00 N flip ATOM 0 H HIS A 114 -2.674 -17.674 -15.007 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.626 -18.045 -12.481 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -2.204 -19.791 -12.803 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.290 -18.898 -14.002 1.00 0.00 H new ATOM 0 HD2 HIS A 114 1.122 -18.545 -13.407 1.00 0.00 H new ATOM 0 HE1 HIS A 114 1.060 -18.256 -9.159 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.500 -18.217 -11.275 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.946 -16.008 -11.131 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.451 -14.977 -10.173 1.00 0.00 C ATOM 1829 C GLU A 115 -3.641 -14.325 -9.471 1.00 0.00 C ATOM 1830 O GLU A 115 -3.789 -14.408 -8.268 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.664 -13.901 -10.926 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.392 -13.569 -10.145 1.00 0.00 C ATOM 1833 CD GLU A 115 0.340 -12.410 -10.821 1.00 0.00 C ATOM 1834 OE1 GLU A 115 1.355 -11.986 -10.294 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -0.130 -11.963 -11.857 1.00 0.00 O ATOM 0 H GLU A 115 -3.953 -16.171 -11.111 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.802 -15.454 -9.439 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.410 -14.252 -11.926 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.274 -13.006 -11.048 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.643 -13.304 -9.118 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.257 -14.444 -10.099 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.486 -13.674 -10.219 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.668 -13.005 -9.606 1.00 0.00 C ATOM 1845 C HIS A 116 -6.948 -13.728 -10.032 1.00 0.00 C ATOM 1846 O HIS A 116 -7.105 -14.110 -11.174 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.727 -11.551 -10.077 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.616 -10.767 -9.433 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.308 -10.811 -9.899 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.603 -9.912 -8.358 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.570 -10.005 -9.113 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.314 -9.434 -8.162 1.00 0.00 N ATOM 0 H HIS A 116 -4.410 -13.576 -11.231 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.579 -13.037 -8.520 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.636 -11.506 -11.162 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.691 -11.113 -9.819 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.462 -9.652 -7.758 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.510 -9.841 -9.236 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -3.001 -8.783 -7.442 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.866 -13.915 -9.125 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.137 -14.605 -9.479 1.00 0.00 C ATOM 1863 C GLN A 117 -10.308 -13.639 -9.301 1.00 0.00 C ATOM 1864 O GLN A 117 -11.456 -14.025 -9.390 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.332 -15.821 -8.572 1.00 0.00 C ATOM 1866 CG GLN A 117 -8.192 -16.816 -8.797 1.00 0.00 C ATOM 1867 CD GLN A 117 -8.460 -18.088 -7.990 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.518 -18.153 -7.231 1.00 0.00 O flip ATOM 1869 NE2 GLN A 117 -7.698 -19.033 -8.053 1.00 0.00 N flip ATOM 0 H GLN A 117 -7.790 -13.619 -8.152 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.093 -14.934 -10.517 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.355 -15.509 -7.528 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.290 -16.296 -8.784 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -8.108 -17.056 -9.857 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.243 -16.373 -8.494 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -6.870 -18.982 -8.647 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -7.886 -19.877 -7.512 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.034 -12.389 -9.044 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.146 -11.415 -8.853 1.00 0.00 C ATOM 1880 C ALA A 118 -10.767 -10.055 -9.435 1.00 0.00 C ATOM 1881 O ALA A 118 -9.672 -9.569 -9.239 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.419 -11.249 -7.360 1.00 0.00 C ATOM 0 H ALA A 118 -9.094 -12.002 -8.958 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.033 -11.791 -9.363 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.232 -10.537 -7.216 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.699 -12.212 -6.932 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.521 -10.880 -6.865 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.677 -9.426 -10.125 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.388 -8.084 -10.695 1.00 0.00 C ATOM 1890 C TYR A 119 -12.704 -7.317 -10.825 1.00 0.00 C ATOM 1891 O TYR A 119 -13.722 -7.873 -11.185 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.721 -8.236 -12.059 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.737 -8.615 -13.100 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.100 -9.954 -13.259 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.303 -7.631 -13.913 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.035 -10.311 -14.235 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.237 -7.983 -14.890 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.604 -9.324 -15.053 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.528 -9.677 -16.017 1.00 0.00 O ATOM 0 H TYR A 119 -12.611 -9.786 -10.318 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.710 -7.535 -10.042 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.235 -7.301 -12.339 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.943 -8.997 -12.007 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.659 -10.712 -12.629 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -12.018 -6.597 -13.786 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.319 -11.346 -14.359 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.675 -7.222 -15.519 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.825 -8.875 -16.495 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.706 -6.048 -10.513 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.975 -5.271 -10.602 1.00 0.00 C ATOM 1911 C ARG A 120 -13.698 -3.845 -11.079 1.00 0.00 C ATOM 1912 O ARG A 120 -12.653 -3.284 -10.819 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.606 -5.173 -9.212 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.849 -6.564 -8.627 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.222 -6.427 -7.145 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.679 -6.688 -6.964 1.00 0.00 N ATOM 1917 CZ ARG A 120 -17.316 -6.161 -5.953 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.675 -5.408 -5.101 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.592 -6.388 -5.795 1.00 0.00 N ATOM 0 H ARG A 120 -11.890 -5.520 -10.203 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.637 -5.779 -11.303 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.953 -4.604 -8.550 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.549 -4.629 -9.273 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.649 -7.066 -9.171 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.955 -7.179 -8.735 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.641 -7.129 -6.548 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.976 -5.426 -6.790 1.00 0.00 H new ATOM 0 HE ARG A 120 -17.178 -7.278 -7.630 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.678 -5.232 -5.225 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -17.171 -4.996 -4.311 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -19.092 -6.977 -6.461 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -19.089 -5.976 -5.005 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.656 -3.237 -11.722 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.487 -1.824 -12.159 1.00 0.00 C ATOM 1935 C TRP A 121 -15.261 -0.955 -11.163 1.00 0.00 C ATOM 1936 O TRP A 121 -16.475 -0.960 -11.144 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.065 -1.645 -13.566 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.112 -2.200 -14.580 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.153 -3.454 -15.086 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.985 -1.537 -15.222 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.121 -3.603 -15.997 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.374 -2.448 -16.115 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.440 -0.247 -15.117 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.261 -2.089 -16.876 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.320 0.115 -15.881 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.732 -0.804 -16.758 1.00 0.00 C ATOM 0 H TRP A 121 -15.552 -3.660 -11.964 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.434 -1.544 -12.186 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.027 -2.152 -13.641 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.246 -0.588 -13.763 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.873 -4.215 -14.822 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.935 -4.461 -16.517 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.886 0.471 -14.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.812 -2.802 -17.552 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.909 1.110 -15.792 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.870 -0.518 -17.342 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.577 -0.242 -10.305 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.300 0.579 -9.286 1.00 0.00 C ATOM 1959 C LEU A 122 -14.854 2.041 -9.332 1.00 0.00 C ATOM 1960 O LEU A 122 -13.953 2.412 -10.056 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.019 0.040 -7.882 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.508 -1.407 -7.933 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.142 -1.475 -7.254 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.481 -2.332 -7.193 1.00 0.00 C ATOM 0 H LEU A 122 -13.559 -0.192 -10.265 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.364 0.518 -9.515 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.280 0.672 -7.388 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -15.929 0.086 -7.283 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.429 -1.726 -8.972 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.771 -2.499 -7.285 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.444 -0.820 -7.775 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.235 -1.154 -6.216 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.111 -3.357 -7.234 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.563 -2.017 -6.153 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.462 -2.281 -7.666 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.490 2.870 -8.542 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.129 4.315 -8.508 1.00 0.00 C ATOM 1978 C GLY A 123 -13.953 4.542 -7.551 1.00 0.00 C ATOM 1979 O GLY A 123 -13.411 3.616 -6.983 1.00 0.00 O ATOM 0 H GLY A 123 -16.249 2.602 -7.916 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.864 4.655 -9.509 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -15.988 4.905 -8.188 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.553 5.774 -7.385 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.403 6.089 -6.482 1.00 0.00 C ATOM 1985 C LEU A 124 -12.661 5.594 -5.058 1.00 0.00 C ATOM 1986 O LEU A 124 -11.825 4.953 -4.458 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.205 7.606 -6.462 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.216 8.006 -5.360 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -9.933 7.180 -5.467 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.871 9.487 -5.517 1.00 0.00 C ATOM 0 H LEU A 124 -13.976 6.584 -7.839 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.512 5.585 -6.857 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.835 7.943 -7.430 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.162 8.101 -6.297 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.674 7.823 -4.388 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.242 7.477 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.172 6.122 -5.361 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.469 7.352 -6.438 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.168 9.781 -4.738 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.419 9.654 -6.495 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.779 10.083 -5.430 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.798 5.898 -4.502 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.072 5.460 -3.104 1.00 0.00 C ATOM 2004 C GLU A 125 -14.027 3.930 -3.009 1.00 0.00 C ATOM 2005 O GLU A 125 -13.322 3.380 -2.188 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.444 5.975 -2.667 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.535 5.043 -3.186 1.00 0.00 C ATOM 2008 CD GLU A 125 -17.903 5.691 -2.967 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -17.932 6.849 -2.580 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.896 5.019 -3.184 1.00 0.00 O ATOM 0 H GLU A 125 -14.546 6.427 -4.950 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.307 5.870 -2.444 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.491 6.035 -1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.603 6.984 -3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.382 4.840 -4.246 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.487 4.085 -2.668 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.754 3.233 -3.841 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.711 1.745 -3.773 1.00 0.00 C ATOM 2020 C GLU A 126 -13.298 1.287 -4.126 1.00 0.00 C ATOM 2021 O GLU A 126 -12.777 0.344 -3.568 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.703 1.147 -4.766 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.767 -0.367 -4.560 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.188 -0.860 -4.833 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.559 -1.879 -4.273 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.882 -0.213 -5.599 1.00 0.00 O ATOM 0 H GLU A 126 -15.368 3.624 -4.556 1.00 0.00 H new ATOM 0 HA GLU A 126 -14.978 1.413 -2.769 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.690 1.588 -4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.397 1.375 -5.787 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.064 -0.865 -5.227 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.473 -0.619 -3.541 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.662 1.962 -5.044 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.274 1.576 -5.405 1.00 0.00 C ATOM 2036 C ALA A 127 -10.389 1.851 -4.193 1.00 0.00 C ATOM 2037 O ALA A 127 -9.562 1.047 -3.809 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.808 2.410 -6.598 1.00 0.00 C ATOM 0 H ALA A 127 -13.042 2.758 -5.555 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.221 0.522 -5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.789 2.127 -6.864 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.468 2.231 -7.447 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.834 3.468 -6.335 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.595 2.978 -3.563 1.00 0.00 N ATOM 2045 CA CYS A 128 -9.814 3.315 -2.344 1.00 0.00 C ATOM 2046 C CYS A 128 -10.277 2.376 -1.234 1.00 0.00 C ATOM 2047 O CYS A 128 -9.522 1.966 -0.376 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.107 4.761 -1.943 1.00 0.00 C ATOM 2049 SG CYS A 128 -10.259 4.872 -0.143 1.00 0.00 S ATOM 0 H CYS A 128 -11.277 3.682 -3.846 1.00 0.00 H new ATOM 0 HA CYS A 128 -8.744 3.206 -2.522 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -9.308 5.415 -2.292 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.027 5.101 -2.418 1.00 0.00 H new ATOM 0 HG CYS A 128 -10.506 6.102 0.197 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.532 2.033 -1.273 1.00 0.00 N ATOM 2056 CA GLN A 129 -12.119 1.112 -0.263 1.00 0.00 C ATOM 2057 C GLN A 129 -11.342 -0.201 -0.255 1.00 0.00 C ATOM 2058 O GLN A 129 -10.969 -0.717 0.779 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.557 0.823 -0.698 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.241 -0.144 0.261 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.742 0.616 1.490 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -15.343 1.665 1.366 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -14.522 0.127 2.679 1.00 0.00 N ATOM 0 H GLN A 129 -12.191 2.360 -1.979 1.00 0.00 H new ATOM 0 HA GLN A 129 -12.082 1.558 0.731 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -14.120 1.755 -0.742 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.558 0.403 -1.704 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -15.075 -0.637 -0.238 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -13.544 -0.925 0.564 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -14.018 -0.753 2.783 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -14.854 0.625 3.505 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.125 -0.751 -1.412 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.406 -2.045 -1.511 1.00 0.00 C ATOM 2074 C LEU A 130 -8.895 -1.833 -1.374 1.00 0.00 C ATOM 2075 O LEU A 130 -8.211 -2.596 -0.722 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.719 -2.652 -2.873 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.240 -2.732 -3.047 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.596 -2.710 -4.526 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.767 -4.030 -2.441 1.00 0.00 C ATOM 0 H LEU A 130 -11.419 -0.354 -2.304 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.728 -2.710 -0.710 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.281 -2.045 -3.665 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.278 -3.646 -2.952 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.691 -1.877 -2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.678 -2.767 -4.641 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.232 -1.785 -4.974 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.133 -3.562 -5.024 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.848 -4.079 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.304 -4.880 -2.942 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.526 -4.060 -1.378 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.365 -0.809 -1.988 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.897 -0.572 -1.892 1.00 0.00 C ATOM 2093 C ALA A 131 -6.498 -0.400 -0.425 1.00 0.00 C ATOM 2094 O ALA A 131 -5.462 -0.861 0.001 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.528 0.688 -2.677 1.00 0.00 C ATOM 0 H ALA A 131 -8.882 -0.131 -2.548 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.366 -1.426 -2.311 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.454 0.860 -2.606 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.806 0.559 -3.723 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.061 1.544 -2.262 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.316 0.252 0.350 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.997 0.453 1.796 1.00 0.00 C ATOM 2103 C GLN A 132 -5.538 0.897 1.984 1.00 0.00 C ATOM 2104 O GLN A 132 -5.107 1.147 3.092 1.00 0.00 O ATOM 2105 CB GLN A 132 -7.253 -0.843 2.580 1.00 0.00 C ATOM 2106 CG GLN A 132 -6.265 -1.936 2.156 1.00 0.00 C ATOM 2107 CD GLN A 132 -6.340 -3.101 3.145 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -6.941 -2.983 4.195 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -5.753 -4.228 2.852 1.00 0.00 N ATOM 0 H GLN A 132 -8.200 0.659 0.045 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.647 1.240 2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.156 -0.653 3.649 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -8.274 -1.182 2.408 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -6.500 -2.283 1.150 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.252 -1.534 2.126 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.249 -4.326 1.971 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.798 -5.011 3.504 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.772 1.005 0.930 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.355 1.441 1.095 1.00 0.00 C ATOM 2120 C PHE A 133 -3.294 2.963 0.975 1.00 0.00 C ATOM 2121 O PHE A 133 -3.906 3.550 0.105 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.470 0.822 0.008 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.782 -0.648 -0.153 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.360 -1.565 0.816 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.486 -1.093 -1.282 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.644 -2.928 0.660 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.767 -2.454 -1.437 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.347 -3.372 -0.467 1.00 0.00 C ATOM 0 H PHE A 133 -5.063 0.812 -0.028 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.994 1.115 2.071 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.629 1.340 -0.938 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.419 0.951 0.269 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.816 -1.222 1.684 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.811 -0.385 -2.030 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.321 -3.636 1.409 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.309 -2.797 -2.306 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.565 -4.423 -0.588 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.567 3.611 1.840 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.480 5.096 1.769 1.00 0.00 C ATOM 2140 C LYS A 134 -1.947 5.506 0.399 1.00 0.00 C ATOM 2141 O LYS A 134 -2.405 6.460 -0.197 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.526 5.605 2.852 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.122 4.444 3.761 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.207 4.961 4.874 1.00 0.00 C ATOM 2145 CE LYS A 134 0.408 3.775 5.622 1.00 0.00 C ATOM 2146 NZ LYS A 134 -0.139 3.720 7.007 1.00 0.00 N ATOM 0 H LYS A 134 -2.030 3.178 2.592 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.470 5.525 1.923 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -0.641 6.047 2.394 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -2.008 6.389 3.437 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -2.009 3.980 4.191 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -0.609 3.676 3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 134 0.580 5.586 4.451 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -0.774 5.586 5.564 1.00 0.00 H new ATOM 0 HE2 LYS A 134 0.187 2.846 5.096 1.00 0.00 H new ATOM 0 HE3 LYS A 134 1.493 3.874 5.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 0.280 2.914 7.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 0.093 4.602 7.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -1.172 3.606 6.968 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.975 4.798 -0.105 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.412 5.158 -1.432 1.00 0.00 C ATOM 2162 C GLU A 135 -1.453 4.913 -2.524 1.00 0.00 C ATOM 2163 O GLU A 135 -1.723 5.777 -3.334 1.00 0.00 O ATOM 2164 CB GLU A 135 0.822 4.308 -1.708 1.00 0.00 C ATOM 2165 CG GLU A 135 1.886 4.584 -0.646 1.00 0.00 C ATOM 2166 CD GLU A 135 2.317 6.050 -0.720 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.890 6.528 0.244 1.00 0.00 O ATOM 2168 OE2 GLU A 135 2.069 6.668 -1.743 1.00 0.00 O ATOM 0 H GLU A 135 -0.548 3.988 0.345 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.137 6.213 -1.429 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.556 3.251 -1.704 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.216 4.533 -2.699 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.492 4.360 0.345 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.747 3.933 -0.801 1.00 0.00 H new ATOM 2176 N MET A 136 -2.047 3.748 -2.558 1.00 0.00 N ATOM 2177 CA MET A 136 -3.067 3.476 -3.610 1.00 0.00 C ATOM 2178 C MET A 136 -4.213 4.462 -3.482 1.00 0.00 C ATOM 2179 O MET A 136 -4.676 5.021 -4.457 1.00 0.00 O ATOM 2180 CB MET A 136 -3.645 2.079 -3.445 1.00 0.00 C ATOM 2181 CG MET A 136 -2.624 1.033 -3.873 1.00 0.00 C ATOM 2182 SD MET A 136 -3.469 -0.260 -4.810 1.00 0.00 S ATOM 2183 CE MET A 136 -4.172 0.815 -6.090 1.00 0.00 C ATOM 0 H MET A 136 -1.871 2.981 -1.909 1.00 0.00 H new ATOM 0 HA MET A 136 -2.580 3.569 -4.581 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.930 1.916 -2.406 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.551 1.979 -4.043 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.846 1.493 -4.482 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.133 0.605 -2.999 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.010 0.367 -7.070 1.00 0.00 H new ATOM 0 HE2 MET A 136 -5.242 0.934 -5.918 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.688 1.791 -6.052 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.682 4.680 -2.292 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.800 5.630 -2.127 1.00 0.00 C ATOM 2195 C LYS A 137 -5.363 6.963 -2.725 1.00 0.00 C ATOM 2196 O LYS A 137 -6.087 7.587 -3.473 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.115 5.794 -0.639 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.700 4.483 -0.100 1.00 0.00 C ATOM 2199 CD LYS A 137 -6.705 4.514 1.430 1.00 0.00 C ATOM 2200 CE LYS A 137 -7.659 5.604 1.921 1.00 0.00 C ATOM 2201 NZ LYS A 137 -6.869 6.735 2.485 1.00 0.00 N ATOM 0 H LYS A 137 -4.342 4.245 -1.435 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.697 5.268 -2.629 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.210 6.055 -0.090 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -6.823 6.610 -0.493 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.714 4.345 -0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -6.111 3.637 -0.455 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.013 3.545 1.822 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -5.698 4.704 1.803 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -8.282 5.955 1.098 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -8.330 5.201 2.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -7.516 7.477 2.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -6.293 6.393 3.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -6.246 7.124 1.749 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.165 7.384 -2.422 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.654 8.658 -2.996 1.00 0.00 C ATOM 2217 C ALA A 138 -3.324 8.444 -4.478 1.00 0.00 C ATOM 2218 O ALA A 138 -3.616 9.276 -5.312 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.401 9.103 -2.247 1.00 0.00 C ATOM 0 H ALA A 138 -3.518 6.899 -1.800 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.415 9.432 -2.897 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.034 10.036 -2.674 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.641 9.255 -1.195 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.632 8.336 -2.337 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.716 7.330 -4.815 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.381 7.080 -6.245 1.00 0.00 C ATOM 2227 C ALA A 139 -3.666 7.156 -7.067 1.00 0.00 C ATOM 2228 O ALA A 139 -3.718 7.789 -8.103 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.756 5.687 -6.402 1.00 0.00 C ATOM 0 H ALA A 139 -2.442 6.593 -4.166 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.667 7.828 -6.591 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.514 5.513 -7.450 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.846 5.627 -5.805 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.463 4.930 -6.062 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.711 6.530 -6.602 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.999 6.583 -7.340 1.00 0.00 C ATOM 2237 C LEU A 140 -6.549 8.008 -7.274 1.00 0.00 C ATOM 2238 O LEU A 140 -7.073 8.532 -8.236 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.994 5.627 -6.685 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.534 4.185 -6.893 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -7.018 3.326 -5.725 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.137 3.649 -8.190 1.00 0.00 C ATOM 0 H LEU A 140 -4.726 5.984 -5.741 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.844 6.293 -8.379 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.074 5.844 -5.620 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.986 5.768 -7.114 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.446 4.152 -6.948 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.691 2.296 -5.871 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.602 3.710 -4.794 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.106 3.358 -5.677 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.812 2.620 -8.344 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.225 3.681 -8.126 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.805 4.263 -9.027 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.425 8.637 -6.136 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.929 10.031 -5.988 1.00 0.00 C ATOM 2256 C GLN A 141 -6.048 10.977 -6.802 1.00 0.00 C ATOM 2257 O GLN A 141 -6.533 11.783 -7.570 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.903 10.418 -4.506 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.260 11.794 -4.319 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.347 12.188 -2.844 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -6.978 11.406 -2.013 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.836 13.215 -2.445 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.994 8.243 -5.300 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.953 10.101 -6.356 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.918 10.428 -4.110 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.347 9.671 -3.939 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.219 11.770 -4.641 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.768 12.534 -4.937 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.343 13.826 -3.096 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -5.900 13.467 -1.459 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.755 10.876 -6.654 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.855 11.763 -7.437 1.00 0.00 C ATOM 2273 C GLU A 142 -3.991 11.409 -8.915 1.00 0.00 C ATOM 2274 O GLU A 142 -3.966 12.265 -9.778 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.409 11.552 -6.985 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.257 12.012 -5.533 1.00 0.00 C ATOM 2277 CD GLU A 142 -0.799 11.859 -5.099 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -0.036 11.273 -5.849 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -0.470 12.333 -4.024 1.00 0.00 O ATOM 0 H GLU A 142 -4.287 10.221 -6.028 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.126 12.807 -7.279 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.138 10.500 -7.075 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.730 12.112 -7.628 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.569 13.052 -5.435 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -2.904 11.422 -4.884 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.157 10.150 -9.213 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.319 9.738 -10.632 1.00 0.00 C ATOM 2289 C GLY A 143 -5.594 10.373 -11.183 1.00 0.00 C ATOM 2290 O GLY A 143 -5.610 10.916 -12.270 1.00 0.00 O ATOM 0 H GLY A 143 -4.187 9.390 -8.534 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.456 10.053 -11.218 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.375 8.652 -10.706 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.658 10.324 -10.429 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.936 10.935 -10.888 1.00 0.00 C ATOM 2296 C HIS A 144 -7.722 12.430 -11.125 1.00 0.00 C ATOM 2297 O HIS A 144 -8.278 13.012 -12.035 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.004 10.751 -9.807 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.021 9.738 -10.255 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.553 8.794 -9.387 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.629 9.518 -11.467 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.440 8.058 -10.083 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.522 8.459 -11.349 1.00 0.00 N ATOM 0 H HIS A 144 -6.696 9.884 -9.509 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.259 10.454 -11.811 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.539 10.425 -8.877 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.493 11.703 -9.602 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.315 8.679 -8.402 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.442 10.080 -12.370 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -12.013 7.244 -9.666 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.926 13.055 -10.302 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.678 14.514 -10.463 1.00 0.00 C ATOM 2314 C GLN A 145 -6.191 14.811 -11.883 1.00 0.00 C ATOM 2315 O GLN A 145 -6.673 15.715 -12.536 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.610 14.950 -9.456 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.381 16.458 -9.566 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.601 17.204 -9.023 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -7.220 16.769 -8.074 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -6.973 18.320 -9.590 1.00 0.00 N ATOM 0 H GLN A 145 -6.435 12.616 -9.523 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.604 15.061 -10.286 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.924 14.693 -8.444 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.679 14.416 -9.646 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.490 16.742 -9.007 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.206 16.734 -10.606 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -6.452 18.685 -10.388 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -7.784 18.827 -9.235 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.241 14.060 -12.368 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.731 14.309 -13.747 1.00 0.00 C ATOM 2331 C PHE A 146 -5.849 14.047 -14.757 1.00 0.00 C ATOM 2332 O PHE A 146 -6.074 14.824 -15.661 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.561 13.368 -14.042 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.856 13.804 -15.307 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.456 13.604 -16.559 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.589 14.398 -15.231 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -2.791 13.996 -17.723 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -0.929 14.792 -16.401 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.533 14.588 -17.645 1.00 0.00 C ATOM 0 H PHE A 146 -4.797 13.287 -11.872 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.396 15.343 -13.825 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.861 13.370 -13.206 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.924 12.346 -14.151 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.432 13.147 -16.623 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.122 14.552 -14.270 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.254 13.840 -18.686 1.00 0.00 H new ATOM 0 HE2 PHE A 146 0.046 15.253 -16.343 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.023 14.890 -18.548 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.542 12.946 -14.611 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.638 12.616 -15.568 1.00 0.00 C ATOM 2351 C LEU A 147 -8.608 13.790 -15.669 1.00 0.00 C ATOM 2352 O LEU A 147 -9.015 14.177 -16.745 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.382 11.374 -15.075 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.382 10.233 -14.874 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.127 8.955 -14.491 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.602 10.001 -16.168 1.00 0.00 C ATOM 0 H LEU A 147 -6.395 12.262 -13.869 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.213 12.420 -16.553 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.896 11.592 -14.139 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.144 11.082 -15.797 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.689 10.499 -14.076 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.411 8.145 -14.349 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.678 9.119 -13.565 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.824 8.688 -15.286 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -5.890 9.188 -16.023 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.294 9.739 -16.968 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.064 10.910 -16.437 1.00 0.00 H new ATOM 2368 N CYS A 148 -8.973 14.371 -14.560 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.905 15.529 -14.610 1.00 0.00 C ATOM 2370 C CYS A 148 -9.245 16.654 -15.407 1.00 0.00 C ATOM 2371 O CYS A 148 -9.905 17.492 -15.989 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.200 16.012 -13.188 1.00 0.00 C ATOM 2373 SG CYS A 148 -11.113 14.733 -12.290 1.00 0.00 S ATOM 0 H CYS A 148 -8.668 14.095 -13.627 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.840 15.234 -15.087 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.268 16.240 -12.670 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.781 16.934 -13.219 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.300 13.778 -11.948 1.00 0.00 H new ATOM 2379 N SER A 149 -7.941 16.679 -15.426 1.00 0.00 N ATOM 2380 CA SER A 149 -7.220 17.750 -16.170 1.00 0.00 C ATOM 2381 C SER A 149 -7.166 17.416 -17.662 1.00 0.00 C ATOM 2382 O SER A 149 -6.797 18.241 -18.473 1.00 0.00 O ATOM 2383 CB SER A 149 -5.791 17.852 -15.639 1.00 0.00 C ATOM 2384 OG SER A 149 -5.227 19.092 -16.043 1.00 0.00 O ATOM 0 H SER A 149 -7.341 16.001 -14.956 1.00 0.00 H new ATOM 0 HA SER A 149 -7.748 18.694 -16.031 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.789 17.775 -14.552 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.190 17.025 -16.018 1.00 0.00 H new ATOM 0 HG SER A 149 -5.568 19.333 -16.929 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.516 16.218 -18.034 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.466 15.854 -19.471 1.00 0.00 C ATOM 2392 C ILE A 150 -8.823 16.112 -20.105 1.00 0.00 C ATOM 2393 O ILE A 150 -9.521 17.045 -19.762 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.128 14.373 -19.612 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -5.998 14.017 -18.655 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -6.678 14.084 -21.041 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.558 12.574 -18.902 1.00 0.00 C ATOM 0 H ILE A 150 -7.833 15.479 -17.406 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.704 16.455 -19.967 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.012 13.779 -19.378 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.157 14.695 -18.800 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.329 14.136 -17.623 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.437 13.026 -21.140 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.480 14.340 -21.734 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.795 14.680 -21.272 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.749 12.318 -18.218 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.401 11.903 -18.735 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.210 12.471 -19.930 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.199 15.277 -21.022 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.514 15.443 -21.692 1.00 0.00 C ATOM 2411 C GLU A 151 -11.546 14.673 -20.892 1.00 0.00 C ATOM 2412 O GLU A 151 -12.665 14.458 -21.314 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.430 14.895 -23.112 1.00 0.00 C ATOM 2414 CG GLU A 151 -9.160 15.433 -23.763 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.216 15.202 -25.273 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.157 14.569 -25.721 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -8.315 15.663 -25.956 1.00 0.00 O ATOM 0 H GLU A 151 -8.649 14.479 -21.341 1.00 0.00 H new ATOM 0 HA GLU A 151 -10.793 16.495 -21.743 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.416 13.805 -23.097 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.307 15.195 -23.686 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.055 16.497 -23.552 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -8.286 14.937 -23.342 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.154 14.256 -19.731 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.073 13.487 -18.852 1.00 0.00 C ATOM 2427 C ALA A 152 -13.224 14.388 -18.403 1.00 0.00 C ATOM 2428 O ALA A 152 -14.354 13.957 -18.287 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.305 12.994 -17.626 1.00 0.00 C ATOM 0 H ALA A 152 -10.224 14.415 -19.344 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.473 12.634 -19.400 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -11.976 12.429 -16.979 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.484 12.352 -17.945 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -10.907 13.848 -17.079 1.00 0.00 H new ATOM 2435 N LEU A 153 -12.942 15.639 -18.147 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.017 16.570 -17.703 1.00 0.00 C ATOM 2437 C LEU A 153 -14.677 16.019 -16.439 1.00 0.00 C ATOM 2438 O LEU A 153 -14.289 14.967 -15.936 1.00 0.00 O ATOM 2439 CB LEU A 153 -15.067 16.701 -18.810 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.376 17.049 -20.130 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -15.431 17.307 -21.206 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -13.518 18.301 -19.943 1.00 0.00 C ATOM 0 H LEU A 153 -12.014 16.054 -18.227 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.586 17.549 -17.492 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -15.621 15.768 -18.912 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -15.790 17.475 -18.551 1.00 0.00 H new ATOM 0 HG LEU A 153 -13.741 16.218 -20.437 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -14.939 17.555 -22.146 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -16.040 16.413 -21.340 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -16.067 18.137 -20.900 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -13.026 18.549 -20.884 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -14.151 19.133 -19.635 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -12.765 18.115 -19.177 1.00 0.00 H new