USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 954 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 131 HIS :FLIP no HD1:sc= -0.0597 F(o=-0.75,f=-0.076) USER MOD Set 1.2: A 134 HIS :FLIP no HD1:sc= -0.0167 F(o=-0.75,f=-0.076) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0845 USER MOD Single : A 13 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.43) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0.643 K(o=0.64,f=-0.0082) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.561 X(o=-0.56,f=-0.54) USER MOD Single : A 56 ASN : amide:sc= -0.0013 K(o=-0.0013,f=-0.73) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -56:sc= 1.33 USER MOD Single : A 68 MET CE :methyl 180:sc=-0.00727 (180deg=-0.00727) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -135:sc= -0.357 (180deg=-1.59!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -79:sc= 0.256 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 81 THR OG1 : rot -39:sc= 0.105 USER MOD Single : A 84 SER OG : rot 180:sc= -0.0328 USER MOD Single : A 88 MET CE :methyl 171:sc= -0.671 (180deg=-0.741) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HE2:sc= 1.03 K(o=1,f=-3.3!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= -0.0953 X(o=-0.095,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -154:sc= 0.318 (180deg=0.0725) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HE2:sc=-0.000753 K(o=-0.00075,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 122 N GLY A 10 9.845 -12.893 -39.349 1.00 0.00 N ATOM 123 CA GLY A 10 10.185 -13.275 -37.990 1.00 0.00 C ATOM 124 C GLY A 10 11.196 -14.412 -38.098 1.00 0.00 C ATOM 125 O GLY A 10 11.248 -15.078 -39.136 1.00 0.00 O ATOM 0 HA2 GLY A 10 10.607 -12.431 -37.444 1.00 0.00 H new ATOM 0 HA3 GLY A 10 9.298 -13.596 -37.444 1.00 0.00 H new ATOM 129 N VAL A 11 12.032 -14.616 -37.078 1.00 0.00 N ATOM 130 CA VAL A 11 13.046 -15.668 -37.055 1.00 0.00 C ATOM 131 C VAL A 11 13.523 -15.846 -35.606 1.00 0.00 C ATOM 132 O VAL A 11 13.347 -14.953 -34.773 1.00 0.00 O ATOM 133 CB VAL A 11 14.187 -15.315 -38.050 1.00 0.00 C ATOM 134 CG1 VAL A 11 14.926 -14.020 -37.681 1.00 0.00 C ATOM 135 CG2 VAL A 11 15.189 -16.463 -38.253 1.00 0.00 C ATOM 0 H VAL A 11 12.022 -14.045 -36.233 1.00 0.00 H new ATOM 0 HA VAL A 11 12.642 -16.625 -37.386 1.00 0.00 H new ATOM 0 HB VAL A 11 13.680 -15.149 -39.001 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.711 -13.828 -38.413 1.00 0.00 H new ATOM 0 HG12 VAL A 11 14.222 -13.188 -37.677 1.00 0.00 H new ATOM 0 HG13 VAL A 11 15.371 -14.124 -36.691 1.00 0.00 H new ATOM 0 HG21 VAL A 11 15.960 -16.153 -38.958 1.00 0.00 H new ATOM 0 HG22 VAL A 11 15.651 -16.716 -37.299 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.668 -17.336 -38.646 1.00 0.00 H new ATOM 145 N SER A 12 14.176 -16.969 -35.307 1.00 0.00 N ATOM 146 CA SER A 12 14.717 -17.339 -34.003 1.00 0.00 C ATOM 147 C SER A 12 15.954 -16.550 -33.563 1.00 0.00 C ATOM 148 O SER A 12 16.497 -16.788 -32.489 1.00 0.00 O ATOM 149 CB SER A 12 14.967 -18.855 -34.011 1.00 0.00 C ATOM 150 OG SER A 12 15.529 -19.264 -35.251 1.00 0.00 O ATOM 0 H SER A 12 14.351 -17.686 -36.011 1.00 0.00 H new ATOM 0 HA SER A 12 13.977 -17.070 -33.249 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.639 -19.122 -33.195 1.00 0.00 H new ATOM 0 HB3 SER A 12 14.030 -19.384 -33.838 1.00 0.00 H new ATOM 0 HG SER A 12 15.683 -20.232 -35.237 1.00 0.00 H new ATOM 156 N GLN A 13 16.410 -15.617 -34.388 1.00 0.00 N ATOM 157 CA GLN A 13 17.578 -14.781 -34.102 1.00 0.00 C ATOM 158 C GLN A 13 17.270 -13.868 -32.917 1.00 0.00 C ATOM 159 O GLN A 13 18.022 -13.852 -31.946 1.00 0.00 O ATOM 160 CB GLN A 13 18.022 -13.962 -35.327 1.00 0.00 C ATOM 161 CG GLN A 13 18.500 -14.817 -36.515 1.00 0.00 C ATOM 162 CD GLN A 13 19.677 -15.732 -36.167 1.00 0.00 C ATOM 163 OE1 GLN A 13 20.523 -15.403 -35.351 1.00 0.00 O ATOM 164 NE2 GLN A 13 19.760 -16.910 -36.764 1.00 0.00 N ATOM 0 H GLN A 13 15.976 -15.413 -35.288 1.00 0.00 H new ATOM 0 HA GLN A 13 18.411 -15.437 -33.849 1.00 0.00 H new ATOM 0 HB2 GLN A 13 17.191 -13.338 -35.654 1.00 0.00 H new ATOM 0 HB3 GLN A 13 18.827 -13.290 -35.029 1.00 0.00 H new ATOM 0 HG2 GLN A 13 17.670 -15.425 -36.874 1.00 0.00 H new ATOM 0 HG3 GLN A 13 18.790 -14.159 -37.334 1.00 0.00 H new ATOM 0 HE21 GLN A 13 19.054 -17.187 -37.446 1.00 0.00 H new ATOM 0 HE22 GLN A 13 20.530 -17.541 -36.542 1.00 0.00 H new ATOM 173 N ALA A 14 16.133 -13.159 -32.966 1.00 0.00 N ATOM 174 CA ALA A 14 15.715 -12.253 -31.895 1.00 0.00 C ATOM 175 C ALA A 14 15.415 -12.992 -30.579 1.00 0.00 C ATOM 176 O ALA A 14 15.145 -12.362 -29.563 1.00 0.00 O ATOM 177 CB ALA A 14 14.506 -11.438 -32.359 1.00 0.00 C ATOM 0 H ALA A 14 15.481 -13.200 -33.749 1.00 0.00 H new ATOM 0 HA ALA A 14 16.546 -11.580 -31.682 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.194 -10.763 -31.562 1.00 0.00 H new ATOM 0 HB2 ALA A 14 14.776 -10.857 -33.241 1.00 0.00 H new ATOM 0 HB3 ALA A 14 13.686 -12.112 -32.605 1.00 0.00 H new ATOM 183 N LEU A 15 15.376 -14.325 -30.613 1.00 0.00 N ATOM 184 CA LEU A 15 15.147 -15.202 -29.482 1.00 0.00 C ATOM 185 C LEU A 15 16.513 -15.617 -28.931 1.00 0.00 C ATOM 186 O LEU A 15 16.777 -15.428 -27.747 1.00 0.00 O ATOM 187 CB LEU A 15 14.281 -16.381 -29.949 1.00 0.00 C ATOM 188 CG LEU A 15 14.327 -17.644 -29.075 1.00 0.00 C ATOM 189 CD1 LEU A 15 13.614 -17.433 -27.738 1.00 0.00 C ATOM 190 CD2 LEU A 15 13.675 -18.776 -29.871 1.00 0.00 C ATOM 0 H LEU A 15 15.512 -14.842 -31.482 1.00 0.00 H new ATOM 0 HA LEU A 15 14.603 -14.717 -28.672 1.00 0.00 H new ATOM 0 HB2 LEU A 15 13.246 -16.043 -30.009 1.00 0.00 H new ATOM 0 HB3 LEU A 15 14.587 -16.652 -30.959 1.00 0.00 H new ATOM 0 HG LEU A 15 15.361 -17.891 -28.834 1.00 0.00 H new ATOM 0 HD11 LEU A 15 13.668 -18.348 -27.148 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.096 -16.621 -27.193 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.570 -17.179 -27.919 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.690 -19.692 -29.280 1.00 0.00 H new ATOM 0 HD22 LEU A 15 12.644 -18.510 -30.103 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.227 -18.934 -30.798 1.00 0.00 H new ATOM 202 N LEU A 16 17.383 -16.183 -29.774 1.00 0.00 N ATOM 203 CA LEU A 16 18.720 -16.641 -29.389 1.00 0.00 C ATOM 204 C LEU A 16 19.636 -15.500 -28.948 1.00 0.00 C ATOM 205 O LEU A 16 20.539 -15.743 -28.149 1.00 0.00 O ATOM 206 CB LEU A 16 19.374 -17.428 -30.543 1.00 0.00 C ATOM 207 CG LEU A 16 19.192 -18.955 -30.445 1.00 0.00 C ATOM 208 CD1 LEU A 16 17.725 -19.400 -30.425 1.00 0.00 C ATOM 209 CD2 LEU A 16 19.898 -19.637 -31.621 1.00 0.00 C ATOM 0 H LEU A 16 17.173 -16.338 -30.760 1.00 0.00 H new ATOM 0 HA LEU A 16 18.588 -17.296 -28.528 1.00 0.00 H new ATOM 0 HB2 LEU A 16 18.954 -17.083 -31.488 1.00 0.00 H new ATOM 0 HB3 LEU A 16 20.440 -17.201 -30.566 1.00 0.00 H new ATOM 0 HG LEU A 16 19.632 -19.252 -29.493 1.00 0.00 H new ATOM 0 HD11 LEU A 16 17.675 -20.487 -30.355 1.00 0.00 H new ATOM 0 HD12 LEU A 16 17.222 -18.957 -29.565 1.00 0.00 H new ATOM 0 HD13 LEU A 16 17.233 -19.073 -31.341 1.00 0.00 H new ATOM 0 HD21 LEU A 16 19.767 -20.717 -31.548 1.00 0.00 H new ATOM 0 HD22 LEU A 16 19.469 -19.282 -32.558 1.00 0.00 H new ATOM 0 HD23 LEU A 16 20.961 -19.398 -31.595 1.00 0.00 H new ATOM 221 N GLU A 17 19.413 -14.264 -29.402 1.00 0.00 N ATOM 222 CA GLU A 17 20.247 -13.125 -29.019 1.00 0.00 C ATOM 223 C GLU A 17 20.287 -12.919 -27.500 1.00 0.00 C ATOM 224 O GLU A 17 21.282 -12.420 -26.966 1.00 0.00 O ATOM 225 CB GLU A 17 19.800 -11.857 -29.763 1.00 0.00 C ATOM 226 CG GLU A 17 18.381 -11.360 -29.423 1.00 0.00 C ATOM 227 CD GLU A 17 18.262 -10.668 -28.059 1.00 0.00 C ATOM 228 OE1 GLU A 17 19.121 -9.807 -27.763 1.00 0.00 O ATOM 229 OE2 GLU A 17 17.329 -10.988 -27.287 1.00 0.00 O ATOM 0 H GLU A 17 18.654 -14.027 -30.041 1.00 0.00 H new ATOM 0 HA GLU A 17 21.271 -13.347 -29.319 1.00 0.00 H new ATOM 0 HB2 GLU A 17 20.509 -11.058 -29.545 1.00 0.00 H new ATOM 0 HB3 GLU A 17 19.854 -12.047 -30.835 1.00 0.00 H new ATOM 0 HG2 GLU A 17 18.057 -10.666 -30.198 1.00 0.00 H new ATOM 0 HG3 GLU A 17 17.697 -12.208 -29.448 1.00 0.00 H new ATOM 236 N ARG A 18 19.242 -13.348 -26.784 1.00 0.00 N ATOM 237 CA ARG A 18 19.164 -13.213 -25.334 1.00 0.00 C ATOM 238 C ARG A 18 20.210 -14.054 -24.610 1.00 0.00 C ATOM 239 O ARG A 18 20.400 -13.828 -23.418 1.00 0.00 O ATOM 240 CB ARG A 18 17.745 -13.526 -24.840 1.00 0.00 C ATOM 241 CG ARG A 18 17.449 -15.030 -24.691 1.00 0.00 C ATOM 242 CD ARG A 18 15.944 -15.277 -24.557 1.00 0.00 C ATOM 243 NE ARG A 18 15.445 -14.730 -23.286 1.00 0.00 N ATOM 244 CZ ARG A 18 14.405 -15.172 -22.580 1.00 0.00 C ATOM 245 NH1 ARG A 18 13.510 -16.006 -23.101 1.00 0.00 N ATOM 246 NH2 ARG A 18 14.280 -14.776 -21.325 1.00 0.00 N ATOM 0 H ARG A 18 18.427 -13.799 -27.199 1.00 0.00 H new ATOM 0 HA ARG A 18 19.391 -12.175 -25.092 1.00 0.00 H new ATOM 0 HB2 ARG A 18 17.591 -13.039 -23.877 1.00 0.00 H new ATOM 0 HB3 ARG A 18 17.026 -13.092 -25.535 1.00 0.00 H new ATOM 0 HG2 ARG A 18 17.835 -15.569 -25.556 1.00 0.00 H new ATOM 0 HG3 ARG A 18 17.966 -15.422 -23.815 1.00 0.00 H new ATOM 0 HD2 ARG A 18 15.417 -14.813 -25.391 1.00 0.00 H new ATOM 0 HD3 ARG A 18 15.739 -16.346 -24.605 1.00 0.00 H new ATOM 0 HE ARG A 18 15.948 -13.928 -22.905 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.610 -16.324 -24.065 1.00 0.00 H new ATOM 0 HH12 ARG A 18 12.724 -16.328 -22.537 1.00 0.00 H new ATOM 0 HH21 ARG A 18 14.971 -14.146 -20.918 1.00 0.00 H new ATOM 0 HH22 ARG A 18 13.492 -15.100 -20.764 1.00 0.00 H new ATOM 260 N ILE A 19 20.842 -15.024 -25.283 1.00 0.00 N ATOM 261 CA ILE A 19 21.870 -15.882 -24.706 1.00 0.00 C ATOM 262 C ILE A 19 23.047 -14.970 -24.379 1.00 0.00 C ATOM 263 O ILE A 19 23.205 -14.634 -23.215 1.00 0.00 O ATOM 264 CB ILE A 19 22.215 -17.067 -25.642 1.00 0.00 C ATOM 265 CG1 ILE A 19 20.974 -17.974 -25.824 1.00 0.00 C ATOM 266 CG2 ILE A 19 23.397 -17.890 -25.088 1.00 0.00 C ATOM 267 CD1 ILE A 19 21.149 -19.049 -26.902 1.00 0.00 C ATOM 0 H ILE A 19 20.645 -15.234 -26.262 1.00 0.00 H new ATOM 0 HA ILE A 19 21.533 -16.372 -23.793 1.00 0.00 H new ATOM 0 HB ILE A 19 22.511 -16.662 -26.610 1.00 0.00 H new ATOM 0 HG12 ILE A 19 20.746 -18.458 -24.874 1.00 0.00 H new ATOM 0 HG13 ILE A 19 20.115 -17.353 -26.079 1.00 0.00 H new ATOM 0 HG21 ILE A 19 23.616 -18.715 -25.766 1.00 0.00 H new ATOM 0 HG22 ILE A 19 24.275 -17.251 -24.999 1.00 0.00 H new ATOM 0 HG23 ILE A 19 23.136 -18.287 -24.107 1.00 0.00 H new ATOM 0 HD11 ILE A 19 20.239 -19.645 -26.972 1.00 0.00 H new ATOM 0 HD12 ILE A 19 21.346 -18.573 -27.862 1.00 0.00 H new ATOM 0 HD13 ILE A 19 21.987 -19.695 -26.639 1.00 0.00 H new ATOM 279 N ARG A 20 23.780 -14.454 -25.380 1.00 0.00 N ATOM 280 CA ARG A 20 24.942 -13.576 -25.157 1.00 0.00 C ATOM 281 C ARG A 20 24.659 -12.390 -24.240 1.00 0.00 C ATOM 282 O ARG A 20 25.579 -11.837 -23.633 1.00 0.00 O ATOM 283 CB ARG A 20 25.615 -13.170 -26.479 1.00 0.00 C ATOM 284 CG ARG A 20 24.752 -12.370 -27.473 1.00 0.00 C ATOM 285 CD ARG A 20 24.644 -10.868 -27.154 1.00 0.00 C ATOM 286 NE ARG A 20 23.250 -10.389 -27.128 1.00 0.00 N ATOM 287 CZ ARG A 20 22.845 -9.112 -27.133 1.00 0.00 C ATOM 288 NH1 ARG A 20 23.729 -8.115 -27.135 1.00 0.00 N ATOM 289 NH2 ARG A 20 21.554 -8.826 -27.137 1.00 0.00 N ATOM 0 H ARG A 20 23.584 -14.633 -26.365 1.00 0.00 H new ATOM 0 HA ARG A 20 25.665 -14.176 -24.605 1.00 0.00 H new ATOM 0 HB2 ARG A 20 26.500 -12.579 -26.244 1.00 0.00 H new ATOM 0 HB3 ARG A 20 25.960 -14.075 -26.978 1.00 0.00 H new ATOM 0 HG2 ARG A 20 25.168 -12.488 -28.474 1.00 0.00 H new ATOM 0 HG3 ARG A 20 23.750 -12.798 -27.492 1.00 0.00 H new ATOM 0 HD2 ARG A 20 25.109 -10.672 -26.188 1.00 0.00 H new ATOM 0 HD3 ARG A 20 25.204 -10.302 -27.898 1.00 0.00 H new ATOM 0 HE ARG A 20 22.521 -11.101 -27.104 1.00 0.00 H new ATOM 0 HH11 ARG A 20 24.728 -8.319 -27.133 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.406 -7.147 -27.139 1.00 0.00 H new ATOM 0 HH21 ARG A 20 20.865 -9.578 -27.136 1.00 0.00 H new ATOM 0 HH22 ARG A 20 21.247 -7.853 -27.141 1.00 0.00 H new ATOM 303 N ALA A 21 23.399 -11.960 -24.145 1.00 0.00 N ATOM 304 CA ALA A 21 23.010 -10.864 -23.281 1.00 0.00 C ATOM 305 C ALA A 21 23.208 -11.222 -21.798 1.00 0.00 C ATOM 306 O ALA A 21 23.173 -10.329 -20.958 1.00 0.00 O ATOM 307 CB ALA A 21 21.545 -10.520 -23.522 1.00 0.00 C ATOM 0 H ALA A 21 22.625 -12.368 -24.669 1.00 0.00 H new ATOM 0 HA ALA A 21 23.642 -10.008 -23.516 1.00 0.00 H new ATOM 0 HB1 ALA A 21 21.253 -9.695 -22.872 1.00 0.00 H new ATOM 0 HB2 ALA A 21 21.406 -10.228 -24.563 1.00 0.00 H new ATOM 0 HB3 ALA A 21 20.926 -11.390 -23.304 1.00 0.00 H new ATOM 313 N LYS A 22 23.385 -12.501 -21.449 1.00 0.00 N ATOM 314 CA LYS A 22 23.589 -12.977 -20.089 1.00 0.00 C ATOM 315 C LYS A 22 25.048 -12.860 -19.715 1.00 0.00 C ATOM 316 O LYS A 22 25.365 -12.601 -18.555 1.00 0.00 O ATOM 317 CB LYS A 22 23.198 -14.437 -19.998 1.00 0.00 C ATOM 318 CG LYS A 22 21.689 -14.539 -20.199 1.00 0.00 C ATOM 319 CD LYS A 22 21.354 -16.006 -20.224 1.00 0.00 C ATOM 320 CE LYS A 22 19.840 -16.215 -20.267 1.00 0.00 C ATOM 321 NZ LYS A 22 19.493 -17.640 -20.130 1.00 0.00 N ATOM 0 H LYS A 22 23.389 -13.255 -22.136 1.00 0.00 H new ATOM 0 HA LYS A 22 22.979 -12.375 -19.415 1.00 0.00 H new ATOM 0 HB2 LYS A 22 23.723 -15.019 -20.756 1.00 0.00 H new ATOM 0 HB3 LYS A 22 23.481 -14.847 -19.028 1.00 0.00 H new ATOM 0 HG2 LYS A 22 21.156 -14.034 -19.393 1.00 0.00 H new ATOM 0 HG3 LYS A 22 21.389 -14.058 -21.130 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.815 -16.475 -21.093 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.768 -16.494 -19.342 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.369 -15.645 -19.466 1.00 0.00 H new ATOM 0 HE3 LYS A 22 19.444 -15.831 -21.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.459 -17.750 -20.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 19.924 -18.179 -20.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.851 -17.999 -19.222 1.00 0.00 H new ATOM 335 N GLU A 23 25.922 -13.008 -20.703 1.00 0.00 N ATOM 336 CA GLU A 23 27.354 -12.954 -20.503 1.00 0.00 C ATOM 337 C GLU A 23 27.851 -11.516 -20.464 1.00 0.00 C ATOM 338 O GLU A 23 28.609 -11.158 -19.558 1.00 0.00 O ATOM 339 CB GLU A 23 28.055 -13.797 -21.575 1.00 0.00 C ATOM 340 CG GLU A 23 27.635 -15.279 -21.466 1.00 0.00 C ATOM 341 CD GLU A 23 26.662 -15.728 -22.555 1.00 0.00 C ATOM 342 OE1 GLU A 23 27.076 -15.770 -23.735 1.00 0.00 O ATOM 343 OE2 GLU A 23 25.508 -16.027 -22.185 1.00 0.00 O ATOM 0 H GLU A 23 25.648 -13.170 -21.672 1.00 0.00 H new ATOM 0 HA GLU A 23 27.601 -13.382 -19.531 1.00 0.00 H new ATOM 0 HB2 GLU A 23 27.806 -13.415 -22.565 1.00 0.00 H new ATOM 0 HB3 GLU A 23 29.136 -13.711 -21.463 1.00 0.00 H new ATOM 0 HG2 GLU A 23 28.527 -15.904 -21.510 1.00 0.00 H new ATOM 0 HG3 GLU A 23 27.176 -15.446 -20.491 1.00 0.00 H new ATOM 350 N VAL A 24 27.348 -10.663 -21.361 1.00 0.00 N ATOM 351 CA VAL A 24 27.751 -9.259 -21.454 1.00 0.00 C ATOM 352 C VAL A 24 27.491 -8.427 -20.190 1.00 0.00 C ATOM 353 O VAL A 24 28.070 -7.356 -20.011 1.00 0.00 O ATOM 354 CB VAL A 24 27.151 -8.658 -22.747 1.00 0.00 C ATOM 355 CG1 VAL A 24 25.678 -8.261 -22.591 1.00 0.00 C ATOM 356 CG2 VAL A 24 27.960 -7.465 -23.269 1.00 0.00 C ATOM 0 H VAL A 24 26.644 -10.931 -22.048 1.00 0.00 H new ATOM 0 HA VAL A 24 28.838 -9.221 -21.521 1.00 0.00 H new ATOM 0 HB VAL A 24 27.207 -9.459 -23.484 1.00 0.00 H new ATOM 0 HG11 VAL A 24 25.312 -7.846 -23.530 1.00 0.00 H new ATOM 0 HG12 VAL A 24 25.090 -9.141 -22.329 1.00 0.00 H new ATOM 0 HG13 VAL A 24 25.584 -7.514 -21.803 1.00 0.00 H new ATOM 0 HG21 VAL A 24 27.496 -7.081 -24.178 1.00 0.00 H new ATOM 0 HG22 VAL A 24 27.981 -6.681 -22.512 1.00 0.00 H new ATOM 0 HG23 VAL A 24 28.979 -7.784 -23.489 1.00 0.00 H new ATOM 366 N GLN A 25 26.684 -8.941 -19.266 1.00 0.00 N ATOM 367 CA GLN A 25 26.297 -8.309 -18.014 1.00 0.00 C ATOM 368 C GLN A 25 27.464 -7.833 -17.152 1.00 0.00 C ATOM 369 O GLN A 25 27.251 -6.961 -16.310 1.00 0.00 O ATOM 370 CB GLN A 25 25.353 -9.225 -17.229 1.00 0.00 C ATOM 371 CG GLN A 25 24.166 -9.612 -18.116 1.00 0.00 C ATOM 372 CD GLN A 25 23.064 -10.314 -17.327 1.00 0.00 C ATOM 373 OE1 GLN A 25 22.065 -9.704 -16.961 1.00 0.00 O ATOM 374 NE2 GLN A 25 23.234 -11.590 -17.010 1.00 0.00 N ATOM 0 H GLN A 25 26.260 -9.862 -19.380 1.00 0.00 H new ATOM 0 HA GLN A 25 25.772 -7.394 -18.289 1.00 0.00 H new ATOM 0 HB2 GLN A 25 25.884 -10.119 -16.903 1.00 0.00 H new ATOM 0 HB3 GLN A 25 25.000 -8.718 -16.331 1.00 0.00 H new ATOM 0 HG2 GLN A 25 23.760 -8.717 -18.588 1.00 0.00 H new ATOM 0 HG3 GLN A 25 24.511 -10.266 -18.917 1.00 0.00 H new ATOM 0 HE21 GLN A 25 24.069 -12.086 -17.321 1.00 0.00 H new ATOM 0 HE22 GLN A 25 22.529 -12.076 -16.455 1.00 0.00 H new ATOM 383 N LYS A 26 28.685 -8.354 -17.330 1.00 0.00 N ATOM 384 CA LYS A 26 29.819 -7.890 -16.532 1.00 0.00 C ATOM 385 C LYS A 26 30.049 -6.391 -16.744 1.00 0.00 C ATOM 386 O LYS A 26 30.407 -5.726 -15.782 1.00 0.00 O ATOM 387 CB LYS A 26 31.094 -8.686 -16.846 1.00 0.00 C ATOM 388 CG LYS A 26 31.081 -10.161 -16.411 1.00 0.00 C ATOM 389 CD LYS A 26 30.875 -10.376 -14.900 1.00 0.00 C ATOM 390 CE LYS A 26 29.396 -10.593 -14.548 1.00 0.00 C ATOM 391 NZ LYS A 26 29.185 -10.666 -13.088 1.00 0.00 N ATOM 0 H LYS A 26 28.907 -9.083 -18.007 1.00 0.00 H new ATOM 0 HA LYS A 26 29.577 -8.059 -15.483 1.00 0.00 H new ATOM 0 HB2 LYS A 26 31.271 -8.644 -17.921 1.00 0.00 H new ATOM 0 HB3 LYS A 26 31.937 -8.191 -16.364 1.00 0.00 H new ATOM 0 HG2 LYS A 26 30.289 -10.680 -16.951 1.00 0.00 H new ATOM 0 HG3 LYS A 26 32.023 -10.623 -16.706 1.00 0.00 H new ATOM 0 HD2 LYS A 26 31.456 -11.239 -14.574 1.00 0.00 H new ATOM 0 HD3 LYS A 26 31.255 -9.511 -14.355 1.00 0.00 H new ATOM 0 HE2 LYS A 26 28.801 -9.779 -14.961 1.00 0.00 H new ATOM 0 HE3 LYS A 26 29.043 -11.514 -15.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 28.175 -10.813 -12.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 29.733 -11.459 -12.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 29.498 -9.778 -12.647 1.00 0.00 H new ATOM 405 N GLN A 27 29.845 -5.857 -17.956 1.00 0.00 N ATOM 406 CA GLN A 27 30.042 -4.427 -18.204 1.00 0.00 C ATOM 407 C GLN A 27 28.782 -3.605 -17.961 1.00 0.00 C ATOM 408 O GLN A 27 28.865 -2.378 -17.907 1.00 0.00 O ATOM 409 CB GLN A 27 30.623 -4.181 -19.609 1.00 0.00 C ATOM 410 CG GLN A 27 32.080 -4.655 -19.731 1.00 0.00 C ATOM 411 CD GLN A 27 32.927 -4.161 -18.556 1.00 0.00 C ATOM 412 OE1 GLN A 27 32.979 -2.975 -18.255 1.00 0.00 O ATOM 413 NE2 GLN A 27 33.507 -5.068 -17.789 1.00 0.00 N ATOM 0 H GLN A 27 29.546 -6.391 -18.772 1.00 0.00 H new ATOM 0 HA GLN A 27 30.773 -4.080 -17.474 1.00 0.00 H new ATOM 0 HB2 GLN A 27 30.012 -4.699 -20.348 1.00 0.00 H new ATOM 0 HB3 GLN A 27 30.569 -3.117 -19.841 1.00 0.00 H new ATOM 0 HG2 GLN A 27 32.108 -5.744 -19.770 1.00 0.00 H new ATOM 0 HG3 GLN A 27 32.505 -4.292 -20.667 1.00 0.00 H new ATOM 0 HE21 GLN A 27 33.462 -6.055 -18.043 1.00 0.00 H new ATOM 0 HE22 GLN A 27 34.000 -4.781 -16.943 1.00 0.00 H new ATOM 422 N LEU A 28 27.625 -4.255 -17.799 1.00 0.00 N ATOM 423 CA LEU A 28 26.369 -3.546 -17.537 1.00 0.00 C ATOM 424 C LEU A 28 26.439 -2.831 -16.185 1.00 0.00 C ATOM 425 O LEU A 28 25.727 -1.851 -15.980 1.00 0.00 O ATOM 426 CB LEU A 28 25.155 -4.477 -17.606 1.00 0.00 C ATOM 427 CG LEU A 28 24.515 -4.542 -19.003 1.00 0.00 C ATOM 428 CD1 LEU A 28 23.836 -3.230 -19.397 1.00 0.00 C ATOM 429 CD2 LEU A 28 25.465 -4.967 -20.128 1.00 0.00 C ATOM 0 H LEU A 28 27.533 -5.270 -17.845 1.00 0.00 H new ATOM 0 HA LEU A 28 26.238 -2.802 -18.323 1.00 0.00 H new ATOM 0 HB2 LEU A 28 25.458 -5.480 -17.306 1.00 0.00 H new ATOM 0 HB3 LEU A 28 24.408 -4.141 -16.887 1.00 0.00 H new ATOM 0 HG LEU A 28 23.768 -5.329 -18.898 1.00 0.00 H new ATOM 0 HD11 LEU A 28 23.401 -3.330 -20.391 1.00 0.00 H new ATOM 0 HD12 LEU A 28 23.050 -2.997 -18.678 1.00 0.00 H new ATOM 0 HD13 LEU A 28 24.573 -2.426 -19.403 1.00 0.00 H new ATOM 0 HD21 LEU A 28 24.924 -4.984 -21.074 1.00 0.00 H new ATOM 0 HD22 LEU A 28 26.290 -4.258 -20.194 1.00 0.00 H new ATOM 0 HD23 LEU A 28 25.857 -5.962 -19.917 1.00 0.00 H new ATOM 441 N ALA A 29 27.326 -3.289 -15.295 1.00 0.00 N ATOM 442 CA ALA A 29 27.559 -2.747 -13.970 1.00 0.00 C ATOM 443 C ALA A 29 27.732 -1.224 -14.036 1.00 0.00 C ATOM 444 O ALA A 29 28.605 -0.709 -14.742 1.00 0.00 O ATOM 445 CB ALA A 29 28.784 -3.440 -13.370 1.00 0.00 C ATOM 0 H ALA A 29 27.926 -4.088 -15.498 1.00 0.00 H new ATOM 0 HA ALA A 29 26.700 -2.936 -13.326 1.00 0.00 H new ATOM 0 HB1 ALA A 29 28.974 -3.044 -12.372 1.00 0.00 H new ATOM 0 HB2 ALA A 29 28.600 -4.512 -13.306 1.00 0.00 H new ATOM 0 HB3 ALA A 29 29.652 -3.258 -14.004 1.00 0.00 H new ATOM 451 N ARG A 30 26.873 -0.495 -13.323 1.00 0.00 N ATOM 452 CA ARG A 30 26.836 0.952 -13.239 1.00 0.00 C ATOM 453 C ARG A 30 26.274 1.294 -11.873 1.00 0.00 C ATOM 454 O ARG A 30 25.662 0.437 -11.222 1.00 0.00 O ATOM 455 CB ARG A 30 25.927 1.497 -14.353 1.00 0.00 C ATOM 456 CG ARG A 30 26.030 3.016 -14.551 1.00 0.00 C ATOM 457 CD ARG A 30 25.044 3.539 -15.586 1.00 0.00 C ATOM 458 NE ARG A 30 24.888 4.994 -15.445 1.00 0.00 N ATOM 459 CZ ARG A 30 23.809 5.680 -15.833 1.00 0.00 C ATOM 460 NH1 ARG A 30 22.933 5.123 -16.665 1.00 0.00 N ATOM 461 NH2 ARG A 30 23.600 6.897 -15.351 1.00 0.00 N ATOM 0 H ARG A 30 26.145 -0.932 -12.758 1.00 0.00 H new ATOM 0 HA ARG A 30 27.825 1.393 -13.364 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.179 1.000 -15.290 1.00 0.00 H new ATOM 0 HB3 ARG A 30 24.893 1.239 -14.124 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.851 3.516 -13.599 1.00 0.00 H new ATOM 0 HG3 ARG A 30 27.044 3.271 -14.859 1.00 0.00 H new ATOM 0 HD2 ARG A 30 25.396 3.299 -16.589 1.00 0.00 H new ATOM 0 HD3 ARG A 30 24.079 3.048 -15.461 1.00 0.00 H new ATOM 0 HE ARG A 30 25.656 5.515 -15.022 1.00 0.00 H new ATOM 0 HH11 ARG A 30 23.086 4.174 -17.006 1.00 0.00 H new ATOM 0 HH12 ARG A 30 22.109 5.645 -16.962 1.00 0.00 H new ATOM 0 HH21 ARG A 30 24.261 7.304 -14.689 1.00 0.00 H new ATOM 0 HH22 ARG A 30 22.779 7.427 -15.642 1.00 0.00 H new ATOM 724 N GLU A 45 2.190 1.069 -6.549 1.00 0.00 N ATOM 725 CA GLU A 45 1.512 0.298 -7.593 1.00 0.00 C ATOM 726 C GLU A 45 0.625 -0.805 -7.001 1.00 0.00 C ATOM 727 O GLU A 45 -0.149 -1.422 -7.738 1.00 0.00 O ATOM 728 CB GLU A 45 2.549 -0.313 -8.555 1.00 0.00 C ATOM 729 CG GLU A 45 3.068 0.666 -9.616 1.00 0.00 C ATOM 730 CD GLU A 45 2.105 0.952 -10.773 1.00 0.00 C ATOM 731 OE1 GLU A 45 1.065 0.267 -10.944 1.00 0.00 O ATOM 732 OE2 GLU A 45 2.380 1.924 -11.509 1.00 0.00 O ATOM 0 HA GLU A 45 0.865 0.981 -8.143 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.393 -0.685 -7.974 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.103 -1.173 -9.055 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.312 1.609 -9.127 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.997 0.271 -10.028 1.00 0.00 H new ATOM 739 N ARG A 46 0.725 -1.087 -5.695 1.00 0.00 N ATOM 740 CA ARG A 46 -0.097 -2.095 -5.033 1.00 0.00 C ATOM 741 C ARG A 46 -1.519 -1.557 -4.816 1.00 0.00 C ATOM 742 O ARG A 46 -2.415 -2.323 -4.470 1.00 0.00 O ATOM 743 CB ARG A 46 0.570 -2.538 -3.716 1.00 0.00 C ATOM 744 CG ARG A 46 0.198 -3.974 -3.315 1.00 0.00 C ATOM 745 CD ARG A 46 0.862 -5.018 -4.220 1.00 0.00 C ATOM 746 NE ARG A 46 0.458 -6.384 -3.851 1.00 0.00 N ATOM 747 CZ ARG A 46 1.258 -7.371 -3.440 1.00 0.00 C ATOM 748 NH1 ARG A 46 2.580 -7.268 -3.520 1.00 0.00 N ATOM 749 NH2 ARG A 46 0.717 -8.477 -2.946 1.00 0.00 N ATOM 0 H ARG A 46 1.382 -0.618 -5.071 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.179 -2.977 -5.668 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.653 -2.463 -3.819 1.00 0.00 H new ATOM 0 HB3 ARG A 46 0.278 -1.855 -2.918 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.496 -4.150 -2.281 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.885 -4.093 -3.359 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.593 -4.825 -5.258 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.946 -4.926 -4.150 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.537 -6.599 -3.916 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.003 -6.422 -3.901 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.172 -8.035 -3.200 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.297 -8.565 -2.884 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.315 -9.239 -2.628 1.00 0.00 H new ATOM 763 N LEU A 47 -1.741 -0.259 -5.047 1.00 0.00 N ATOM 764 CA LEU A 47 -3.008 0.451 -4.925 1.00 0.00 C ATOM 765 C LEU A 47 -4.137 -0.314 -5.642 1.00 0.00 C ATOM 766 O LEU A 47 -5.041 -0.828 -4.965 1.00 0.00 O ATOM 767 CB LEU A 47 -2.818 1.885 -5.469 1.00 0.00 C ATOM 768 CG LEU A 47 -2.393 2.939 -4.443 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.056 4.250 -5.153 1.00 0.00 C ATOM 770 CD2 LEU A 47 -3.534 3.203 -3.474 1.00 0.00 C ATOM 0 H LEU A 47 -0.987 0.360 -5.344 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.309 0.516 -3.879 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.071 1.856 -6.262 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -3.754 2.207 -5.925 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.520 2.568 -3.906 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.754 4.995 -4.417 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.240 4.084 -5.856 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.933 4.607 -5.693 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.227 3.954 -2.746 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.402 3.565 -4.024 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.792 2.279 -2.956 1.00 0.00 H new ATOM 782 N PRO A 48 -4.123 -0.434 -6.988 1.00 0.00 N ATOM 783 CA PRO A 48 -5.158 -1.159 -7.707 1.00 0.00 C ATOM 784 C PRO A 48 -5.090 -2.662 -7.430 1.00 0.00 C ATOM 785 O PRO A 48 -6.089 -3.339 -7.644 1.00 0.00 O ATOM 786 CB PRO A 48 -4.915 -0.869 -9.190 1.00 0.00 C ATOM 787 CG PRO A 48 -3.410 -0.627 -9.257 1.00 0.00 C ATOM 788 CD PRO A 48 -3.162 0.105 -7.943 1.00 0.00 C ATOM 0 HA PRO A 48 -6.150 -0.840 -7.389 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.216 -1.707 -9.819 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.478 0.001 -9.527 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.847 -1.558 -9.321 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.129 -0.025 -10.121 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.140 -0.052 -7.597 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.296 1.180 -8.065 1.00 0.00 H new ATOM 796 N GLU A 49 -3.946 -3.191 -6.986 1.00 0.00 N ATOM 797 CA GLU A 49 -3.766 -4.603 -6.680 1.00 0.00 C ATOM 798 C GLU A 49 -4.739 -4.968 -5.560 1.00 0.00 C ATOM 799 O GLU A 49 -5.614 -5.808 -5.779 1.00 0.00 O ATOM 800 CB GLU A 49 -2.291 -4.884 -6.337 1.00 0.00 C ATOM 801 CG GLU A 49 -1.827 -6.282 -6.750 1.00 0.00 C ATOM 802 CD GLU A 49 -2.368 -7.422 -5.897 1.00 0.00 C ATOM 803 OE1 GLU A 49 -1.923 -7.546 -4.735 1.00 0.00 O ATOM 804 OE2 GLU A 49 -3.124 -8.249 -6.457 1.00 0.00 O ATOM 0 H GLU A 49 -3.106 -2.634 -6.828 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.993 -5.235 -7.539 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.663 -4.141 -6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.146 -4.763 -5.263 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.120 -6.454 -7.786 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.738 -6.310 -6.718 1.00 0.00 H new ATOM 811 N LEU A 50 -4.631 -4.293 -4.405 1.00 0.00 N ATOM 812 CA LEU A 50 -5.504 -4.527 -3.255 1.00 0.00 C ATOM 813 C LEU A 50 -6.952 -4.269 -3.655 1.00 0.00 C ATOM 814 O LEU A 50 -7.817 -5.081 -3.333 1.00 0.00 O ATOM 815 CB LEU A 50 -5.152 -3.630 -2.050 1.00 0.00 C ATOM 816 CG LEU A 50 -4.261 -4.229 -0.947 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.816 -5.531 -0.351 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.830 -4.442 -1.438 1.00 0.00 C ATOM 0 H LEU A 50 -3.931 -3.568 -4.247 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.362 -5.564 -2.950 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.659 -2.736 -2.431 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.085 -3.307 -1.589 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.257 -3.491 -0.145 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.137 -5.897 0.420 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.796 -5.342 0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.910 -6.280 -1.137 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.229 -4.866 -0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.835 -5.126 -2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.404 -3.486 -1.744 1.00 0.00 H new ATOM 830 N ALA A 51 -7.229 -3.173 -4.379 1.00 0.00 N ATOM 831 CA ALA A 51 -8.592 -2.864 -4.809 1.00 0.00 C ATOM 832 C ALA A 51 -9.197 -4.040 -5.594 1.00 0.00 C ATOM 833 O ALA A 51 -10.347 -4.431 -5.370 1.00 0.00 O ATOM 834 CB ALA A 51 -8.594 -1.582 -5.644 1.00 0.00 C ATOM 0 H ALA A 51 -6.529 -2.493 -4.675 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.213 -2.704 -3.928 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.612 -1.356 -5.962 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.210 -0.757 -5.045 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -7.962 -1.718 -6.521 1.00 0.00 H new ATOM 840 N ARG A 52 -8.428 -4.616 -6.524 1.00 0.00 N ATOM 841 CA ARG A 52 -8.889 -5.747 -7.316 1.00 0.00 C ATOM 842 C ARG A 52 -9.064 -6.964 -6.416 1.00 0.00 C ATOM 843 O ARG A 52 -10.063 -7.657 -6.581 1.00 0.00 O ATOM 844 CB ARG A 52 -7.922 -6.042 -8.462 1.00 0.00 C ATOM 845 CG ARG A 52 -8.010 -5.008 -9.587 1.00 0.00 C ATOM 846 CD ARG A 52 -6.962 -5.302 -10.668 1.00 0.00 C ATOM 847 NE ARG A 52 -7.460 -6.311 -11.610 1.00 0.00 N ATOM 848 CZ ARG A 52 -7.364 -6.278 -12.940 1.00 0.00 C ATOM 849 NH1 ARG A 52 -6.531 -5.434 -13.547 1.00 0.00 N ATOM 850 NH2 ARG A 52 -8.113 -7.105 -13.654 1.00 0.00 N ATOM 0 H ARG A 52 -7.480 -4.311 -6.743 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.853 -5.499 -7.760 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.903 -6.067 -8.075 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.134 -7.032 -8.866 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.008 -5.023 -10.026 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.854 -4.008 -9.183 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.718 -4.385 -11.204 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.041 -5.654 -10.203 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.928 -7.122 -11.206 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -5.954 -4.800 -12.994 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -6.470 -5.422 -14.565 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.748 -7.751 -13.185 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.055 -7.096 -14.672 1.00 0.00 H new ATOM 864 N VAL A 53 -8.140 -7.238 -5.489 1.00 0.00 N ATOM 865 CA VAL A 53 -8.268 -8.381 -4.590 1.00 0.00 C ATOM 866 C VAL A 53 -9.572 -8.243 -3.805 1.00 0.00 C ATOM 867 O VAL A 53 -10.346 -9.189 -3.792 1.00 0.00 O ATOM 868 CB VAL A 53 -7.037 -8.549 -3.670 1.00 0.00 C ATOM 869 CG1 VAL A 53 -7.268 -9.638 -2.609 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.800 -8.957 -4.482 1.00 0.00 C ATOM 0 H VAL A 53 -7.297 -6.682 -5.345 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.305 -9.297 -5.180 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.880 -7.585 -3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.382 -9.728 -1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.125 -9.368 -1.991 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.462 -10.591 -3.102 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.947 -9.069 -3.813 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.992 -9.904 -4.987 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.582 -8.188 -5.223 1.00 0.00 H new ATOM 880 N LEU A 54 -9.865 -7.085 -3.208 1.00 0.00 N ATOM 881 CA LEU A 54 -11.077 -6.851 -2.429 1.00 0.00 C ATOM 882 C LEU A 54 -12.311 -7.243 -3.237 1.00 0.00 C ATOM 883 O LEU A 54 -13.128 -8.040 -2.768 1.00 0.00 O ATOM 884 CB LEU A 54 -11.093 -5.390 -1.952 1.00 0.00 C ATOM 885 CG LEU A 54 -12.442 -4.878 -1.410 1.00 0.00 C ATOM 886 CD1 LEU A 54 -13.032 -5.748 -0.303 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.228 -3.468 -0.862 1.00 0.00 C ATOM 0 H LEU A 54 -9.253 -6.270 -3.255 1.00 0.00 H new ATOM 0 HA LEU A 54 -11.090 -7.481 -1.540 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.341 -5.274 -1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.791 -4.753 -2.783 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.152 -4.901 -2.237 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.980 -5.324 0.027 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -13.198 -6.756 -0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.340 -5.786 0.538 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.170 -3.082 -0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.488 -3.497 -0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.873 -2.817 -1.661 1.00 0.00 H new ATOM 899 N ARG A 55 -12.467 -6.714 -4.459 1.00 0.00 N ATOM 900 CA ARG A 55 -13.644 -7.099 -5.235 1.00 0.00 C ATOM 901 C ARG A 55 -13.610 -8.590 -5.540 1.00 0.00 C ATOM 902 O ARG A 55 -14.668 -9.207 -5.517 1.00 0.00 O ATOM 903 CB ARG A 55 -13.867 -6.259 -6.498 1.00 0.00 C ATOM 904 CG ARG A 55 -12.766 -6.325 -7.562 1.00 0.00 C ATOM 905 CD ARG A 55 -13.296 -6.179 -8.988 1.00 0.00 C ATOM 906 NE ARG A 55 -12.300 -6.630 -9.977 1.00 0.00 N ATOM 907 CZ ARG A 55 -12.397 -6.458 -11.302 1.00 0.00 C ATOM 908 NH1 ARG A 55 -13.445 -5.816 -11.807 1.00 0.00 N ATOM 909 NH2 ARG A 55 -11.464 -6.954 -12.105 1.00 0.00 N ATOM 0 H ARG A 55 -11.831 -6.056 -4.908 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.510 -6.886 -4.609 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -14.805 -6.573 -6.956 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.991 -5.218 -6.199 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.037 -5.538 -7.370 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.240 -7.275 -7.473 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.212 -6.760 -9.099 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.554 -5.137 -9.178 1.00 0.00 H new ATOM 0 HE ARG A 55 -11.472 -7.111 -9.625 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.171 -5.457 -11.187 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -13.524 -5.682 -12.815 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.674 -7.466 -11.713 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.537 -6.823 -13.114 1.00 0.00 H new ATOM 923 N ASN A 56 -12.440 -9.176 -5.807 1.00 0.00 N ATOM 924 CA ASN A 56 -12.326 -10.591 -6.113 1.00 0.00 C ATOM 925 C ASN A 56 -12.909 -11.395 -4.959 1.00 0.00 C ATOM 926 O ASN A 56 -13.799 -12.206 -5.203 1.00 0.00 O ATOM 927 CB ASN A 56 -10.884 -11.027 -6.415 1.00 0.00 C ATOM 928 CG ASN A 56 -10.308 -10.518 -7.732 1.00 0.00 C ATOM 929 OD1 ASN A 56 -11.029 -10.155 -8.666 1.00 0.00 O ATOM 930 ND2 ASN A 56 -8.987 -10.502 -7.838 1.00 0.00 N ATOM 0 H ASN A 56 -11.550 -8.677 -5.815 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.890 -10.783 -7.026 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.242 -10.687 -5.602 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.845 -12.116 -6.418 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.549 -10.186 -8.703 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -8.409 -10.806 -7.055 1.00 0.00 H new ATOM 937 N VAL A 57 -12.452 -11.156 -3.723 1.00 0.00 N ATOM 938 CA VAL A 57 -12.930 -11.864 -2.540 1.00 0.00 C ATOM 939 C VAL A 57 -14.442 -11.674 -2.400 1.00 0.00 C ATOM 940 O VAL A 57 -15.180 -12.655 -2.392 1.00 0.00 O ATOM 941 CB VAL A 57 -12.189 -11.432 -1.247 1.00 0.00 C ATOM 942 CG1 VAL A 57 -12.418 -12.471 -0.143 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.668 -11.278 -1.404 1.00 0.00 C ATOM 0 H VAL A 57 -11.735 -10.460 -3.520 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.712 -12.923 -2.676 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.603 -10.454 -1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.895 -12.162 0.762 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.485 -12.552 0.064 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.037 -13.439 -0.469 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.233 -10.974 -0.452 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.236 -12.230 -1.713 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.455 -10.521 -2.159 1.00 0.00 H new ATOM 953 N PHE A 58 -14.938 -10.433 -2.376 1.00 0.00 N ATOM 954 CA PHE A 58 -16.364 -10.141 -2.221 1.00 0.00 C ATOM 955 C PHE A 58 -17.240 -10.820 -3.281 1.00 0.00 C ATOM 956 O PHE A 58 -18.366 -11.236 -2.996 1.00 0.00 O ATOM 957 CB PHE A 58 -16.573 -8.623 -2.220 1.00 0.00 C ATOM 958 CG PHE A 58 -16.604 -7.975 -0.852 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.559 -8.137 0.074 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.704 -7.169 -0.519 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.608 -7.457 1.305 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.753 -6.482 0.700 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.694 -6.616 1.614 1.00 0.00 C ATOM 0 H PHE A 58 -14.357 -9.599 -2.464 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.684 -10.559 -1.266 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.776 -8.163 -2.804 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.510 -8.402 -2.730 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.723 -8.780 -0.158 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.525 -7.077 -1.214 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.806 -7.581 2.018 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.599 -5.853 0.936 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.713 -6.076 2.549 1.00 0.00 H new ATOM 973 N VAL A 59 -16.777 -10.897 -4.527 1.00 0.00 N ATOM 974 CA VAL A 59 -17.519 -11.540 -5.609 1.00 0.00 C ATOM 975 C VAL A 59 -17.508 -13.058 -5.367 1.00 0.00 C ATOM 976 O VAL A 59 -18.531 -13.727 -5.533 1.00 0.00 O ATOM 977 CB VAL A 59 -16.889 -11.149 -6.964 1.00 0.00 C ATOM 978 CG1 VAL A 59 -17.530 -11.887 -8.143 1.00 0.00 C ATOM 979 CG2 VAL A 59 -16.995 -9.652 -7.291 1.00 0.00 C ATOM 0 H VAL A 59 -15.876 -10.515 -4.815 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.557 -11.209 -5.632 1.00 0.00 H new ATOM 0 HB VAL A 59 -15.843 -11.429 -6.841 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -17.051 -11.576 -9.071 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.403 -12.962 -8.012 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.593 -11.650 -8.186 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -16.530 -9.457 -8.257 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.045 -9.361 -7.328 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -16.485 -9.074 -6.520 1.00 0.00 H new ATOM 989 N SER A 60 -16.362 -13.612 -4.976 1.00 0.00 N ATOM 990 CA SER A 60 -16.153 -15.026 -4.707 1.00 0.00 C ATOM 991 C SER A 60 -16.983 -15.474 -3.501 1.00 0.00 C ATOM 992 O SER A 60 -17.541 -16.571 -3.512 1.00 0.00 O ATOM 993 CB SER A 60 -14.645 -15.207 -4.493 1.00 0.00 C ATOM 994 OG SER A 60 -14.129 -16.510 -4.693 1.00 0.00 O ATOM 0 H SER A 60 -15.517 -13.058 -4.833 1.00 0.00 H new ATOM 0 HA SER A 60 -16.485 -15.652 -5.535 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.121 -14.526 -5.164 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.406 -14.898 -3.475 1.00 0.00 H new ATOM 0 HG SER A 60 -13.162 -16.507 -4.532 1.00 0.00 H new ATOM 1000 N GLU A 61 -17.177 -14.591 -2.522 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.924 -14.842 -1.296 1.00 0.00 C ATOM 1002 C GLU A 61 -19.422 -15.071 -1.530 1.00 0.00 C ATOM 1003 O GLU A 61 -20.120 -15.489 -0.614 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.752 -13.628 -0.374 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.904 -13.981 1.112 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.615 -14.491 1.758 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.586 -13.784 1.697 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -16.644 -15.581 2.374 1.00 0.00 O ATOM 0 H GLU A 61 -16.802 -13.644 -2.566 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.528 -15.757 -0.855 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.768 -13.189 -0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.488 -12.869 -0.639 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -18.246 -13.099 1.653 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.678 -14.741 1.218 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.953 -14.771 -2.723 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.368 -14.947 -3.060 1.00 0.00 C ATOM 1017 C ARG A 62 -22.315 -14.080 -2.205 1.00 0.00 C ATOM 1018 O ARG A 62 -23.531 -14.268 -2.270 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.693 -16.453 -2.967 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.859 -16.938 -3.833 1.00 0.00 C ATOM 1021 CD ARG A 62 -22.395 -17.570 -5.149 1.00 0.00 C ATOM 1022 NE ARG A 62 -21.894 -16.580 -6.112 1.00 0.00 N ATOM 1023 CZ ARG A 62 -22.658 -15.920 -6.987 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -23.980 -15.935 -6.873 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -22.104 -15.267 -8.000 1.00 0.00 N ATOM 0 H ARG A 62 -19.400 -14.393 -3.492 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.538 -14.594 -4.077 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.801 -17.016 -3.243 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -21.913 -16.694 -1.927 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.445 -17.666 -3.272 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.518 -16.098 -4.051 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.610 -18.297 -4.940 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -23.225 -18.117 -5.596 1.00 0.00 H new ATOM 0 HE ARG A 62 -20.893 -16.383 -6.113 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -24.420 -16.453 -6.113 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -24.556 -15.428 -7.546 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -21.090 -15.267 -8.114 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -22.692 -14.765 -8.665 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.804 -13.128 -1.410 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.580 -12.241 -0.543 1.00 0.00 C ATOM 1041 C LYS A 63 -22.159 -10.808 -0.791 1.00 0.00 C ATOM 1042 O LYS A 63 -20.967 -10.548 -0.971 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.547 -12.689 0.926 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.139 -12.879 1.495 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.107 -13.430 2.924 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.760 -14.809 3.008 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.407 -15.493 4.266 1.00 0.00 N ATOM 0 H LYS A 63 -20.801 -12.952 -1.354 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.638 -12.303 -0.798 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.074 -11.951 1.531 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -23.094 -13.627 1.020 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.585 -13.556 0.844 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.619 -11.921 1.475 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.074 -13.494 3.267 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -21.623 -12.741 3.592 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -22.843 -14.706 2.939 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -21.443 -15.416 2.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -21.865 -16.426 4.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.375 -15.612 4.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -21.732 -14.924 5.074 1.00 0.00 H new ATOM 1061 N PRO A 64 -23.105 -9.857 -0.860 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.760 -8.469 -1.092 1.00 0.00 C ATOM 1063 C PRO A 64 -22.315 -7.763 0.186 1.00 0.00 C ATOM 1064 O PRO A 64 -21.794 -6.646 0.107 1.00 0.00 O ATOM 1065 CB PRO A 64 -24.044 -7.816 -1.602 1.00 0.00 C ATOM 1066 CG PRO A 64 -25.108 -8.562 -0.801 1.00 0.00 C ATOM 1067 CD PRO A 64 -24.550 -9.986 -0.696 1.00 0.00 C ATOM 0 HA PRO A 64 -21.929 -8.397 -1.793 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -24.063 -6.743 -1.409 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -24.172 -7.949 -2.676 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -25.255 -8.116 0.183 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -26.074 -8.546 -1.306 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.796 -10.433 0.267 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.975 -10.631 -1.465 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.561 -8.385 1.342 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.227 -7.858 2.650 1.00 0.00 C ATOM 1077 C ALA A 65 -21.346 -8.863 3.365 1.00 0.00 C ATOM 1078 O ALA A 65 -21.585 -10.068 3.261 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.506 -7.590 3.442 1.00 0.00 C ATOM 0 H ALA A 65 -23.013 -9.298 1.385 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.689 -6.915 2.553 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.249 -7.194 4.425 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -24.120 -6.865 2.908 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.063 -8.520 3.560 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.344 -8.364 4.083 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.375 -9.152 4.824 1.00 0.00 C ATOM 1087 C LEU A 66 -19.241 -8.624 6.238 1.00 0.00 C ATOM 1088 O LEU A 66 -19.271 -7.408 6.446 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.990 -9.027 4.151 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.661 -10.064 3.068 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -17.780 -11.456 3.680 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.483 -9.981 1.769 1.00 0.00 C ATOM 0 H LEU A 66 -20.182 -7.360 4.165 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.714 -10.188 4.838 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.914 -8.034 3.708 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.227 -9.089 4.926 1.00 0.00 H new ATOM 0 HG LEU A 66 -16.645 -9.839 2.745 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.549 -12.207 2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -17.080 -11.550 4.510 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -18.796 -11.608 4.044 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.159 -10.764 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.540 -10.114 1.998 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.332 -9.006 1.305 1.00 0.00 H new ATOM 1104 N THR A 67 -19.027 -9.521 7.196 1.00 0.00 N ATOM 1105 CA THR A 67 -18.850 -9.161 8.590 1.00 0.00 C ATOM 1106 C THR A 67 -17.449 -8.566 8.778 1.00 0.00 C ATOM 1107 O THR A 67 -16.534 -8.898 8.015 1.00 0.00 O ATOM 1108 CB THR A 67 -19.041 -10.409 9.475 1.00 0.00 C ATOM 1109 OG1 THR A 67 -20.070 -11.244 8.981 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.375 -9.989 10.904 1.00 0.00 C ATOM 0 H THR A 67 -18.972 -10.524 7.020 1.00 0.00 H new ATOM 0 HA THR A 67 -19.591 -8.418 8.884 1.00 0.00 H new ATOM 0 HB THR A 67 -18.107 -10.970 9.460 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.901 -10.730 8.906 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.508 -10.877 11.522 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.561 -9.386 11.306 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.295 -9.404 10.906 1.00 0.00 H new ATOM 1118 N MET A 68 -17.256 -7.724 9.804 1.00 0.00 N ATOM 1119 CA MET A 68 -15.964 -7.106 10.107 1.00 0.00 C ATOM 1120 C MET A 68 -14.918 -8.204 10.306 1.00 0.00 C ATOM 1121 O MET A 68 -13.801 -8.065 9.834 1.00 0.00 O ATOM 1122 CB MET A 68 -16.057 -6.212 11.352 1.00 0.00 C ATOM 1123 CG MET A 68 -14.932 -5.172 11.444 1.00 0.00 C ATOM 1124 SD MET A 68 -15.412 -3.465 11.035 1.00 0.00 S ATOM 1125 CE MET A 68 -15.832 -3.632 9.282 1.00 0.00 C ATOM 0 H MET A 68 -17.999 -7.453 10.449 1.00 0.00 H new ATOM 0 HA MET A 68 -15.669 -6.471 9.272 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.018 -5.697 11.349 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.035 -6.840 12.243 1.00 0.00 H new ATOM 0 HG2 MET A 68 -14.530 -5.186 12.457 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.125 -5.474 10.776 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.146 -2.665 8.889 1.00 0.00 H new ATOM 0 HE2 MET A 68 -14.959 -3.982 8.730 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.644 -4.350 9.169 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.303 -9.305 10.955 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.473 -10.470 11.229 1.00 0.00 C ATOM 1137 C GLU A 69 -13.914 -11.033 9.922 1.00 0.00 C ATOM 1138 O GLU A 69 -12.701 -11.110 9.739 1.00 0.00 O ATOM 1139 CB GLU A 69 -15.366 -11.512 11.920 1.00 0.00 C ATOM 1140 CG GLU A 69 -14.690 -12.870 12.172 1.00 0.00 C ATOM 1141 CD GLU A 69 -15.670 -14.009 11.891 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -16.504 -14.300 12.776 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -15.654 -14.582 10.778 1.00 0.00 O ATOM 0 H GLU A 69 -16.250 -9.409 11.320 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.629 -10.205 11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.703 -11.107 12.874 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -16.255 -11.671 11.309 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.812 -12.971 11.534 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -14.343 -12.926 13.204 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.814 -11.397 9.009 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.490 -11.977 7.721 1.00 0.00 C ATOM 1152 C VAL A 70 -13.519 -11.091 6.947 1.00 0.00 C ATOM 1153 O VAL A 70 -12.442 -11.555 6.566 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.784 -12.271 6.933 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.428 -12.926 5.587 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.713 -13.231 7.686 1.00 0.00 C ATOM 0 H VAL A 70 -15.818 -11.290 9.157 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.979 -12.927 7.876 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.297 -11.319 6.793 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.342 -13.134 5.030 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.797 -12.251 5.009 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.893 -13.858 5.766 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.610 -13.409 7.093 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.198 -14.176 7.857 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.992 -12.791 8.644 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.886 -9.830 6.701 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.022 -8.923 5.952 1.00 0.00 C ATOM 1168 C VAL A 71 -11.701 -8.635 6.683 1.00 0.00 C ATOM 1169 O VAL A 71 -10.702 -8.349 6.041 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.817 -7.659 5.573 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.101 -6.725 6.753 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.118 -6.863 4.476 1.00 0.00 C ATOM 0 H VAL A 71 -14.768 -9.420 7.008 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.712 -9.405 5.025 1.00 0.00 H new ATOM 0 HB VAL A 71 -14.774 -8.037 5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.664 -5.859 6.404 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.682 -7.257 7.506 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.159 -6.393 7.189 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -13.708 -5.979 4.235 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.131 -6.557 4.821 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.015 -7.483 3.586 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.674 -8.719 8.009 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.501 -8.465 8.839 1.00 0.00 C ATOM 1184 C CYS A 72 -9.521 -9.601 8.623 1.00 0.00 C ATOM 1185 O CYS A 72 -8.362 -9.348 8.301 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.881 -8.338 10.321 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.416 -8.114 11.365 1.00 0.00 S ATOM 0 H CYS A 72 -12.497 -8.975 8.555 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.045 -7.517 8.553 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.556 -7.493 10.453 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.421 -9.230 10.637 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.781 -8.009 12.608 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.973 -10.843 8.814 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.146 -12.023 8.625 1.00 0.00 C ATOM 1195 C ALA A 73 -8.599 -12.000 7.195 1.00 0.00 C ATOM 1196 O ALA A 73 -7.413 -12.223 6.972 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.977 -13.277 8.903 1.00 0.00 C ATOM 0 H ALA A 73 -10.928 -11.052 9.105 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.305 -12.031 9.318 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.358 -14.163 8.761 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.343 -13.251 9.929 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.823 -13.312 8.217 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.459 -11.687 6.225 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.111 -11.604 4.820 1.00 0.00 C ATOM 1205 C ARG A 74 -8.106 -10.493 4.533 1.00 0.00 C ATOM 1206 O ARG A 74 -7.233 -10.688 3.686 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.420 -11.419 4.038 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.165 -12.750 3.776 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.469 -13.704 2.783 1.00 0.00 C ATOM 1210 NE ARG A 74 -9.397 -14.502 3.408 1.00 0.00 N ATOM 1211 CZ ARG A 74 -8.393 -15.133 2.790 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -8.272 -15.100 1.470 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -7.475 -15.774 3.500 1.00 0.00 N ATOM 0 H ARG A 74 -10.441 -11.480 6.408 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.610 -12.519 4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.075 -10.746 4.592 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.202 -10.938 3.084 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.294 -13.269 4.726 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.162 -12.522 3.399 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.211 -14.376 2.352 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.050 -13.123 1.961 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.425 -14.581 4.425 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.952 -14.587 0.908 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.499 -15.587 1.016 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.534 -15.786 4.518 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -6.709 -16.255 3.028 1.00 0.00 H new ATOM 1227 N MET A 75 -8.210 -9.339 5.186 1.00 0.00 N ATOM 1228 CA MET A 75 -7.302 -8.224 4.981 1.00 0.00 C ATOM 1229 C MET A 75 -5.959 -8.541 5.607 1.00 0.00 C ATOM 1230 O MET A 75 -4.942 -8.366 4.939 1.00 0.00 O ATOM 1231 CB MET A 75 -7.896 -6.926 5.534 1.00 0.00 C ATOM 1232 CG MET A 75 -8.661 -6.124 4.473 1.00 0.00 C ATOM 1233 SD MET A 75 -9.832 -6.940 3.341 1.00 0.00 S ATOM 1234 CE MET A 75 -8.792 -7.325 1.907 1.00 0.00 C ATOM 0 H MET A 75 -8.936 -9.154 5.878 1.00 0.00 H new ATOM 0 HA MET A 75 -7.154 -8.073 3.912 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.568 -7.162 6.359 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.095 -6.309 5.941 1.00 0.00 H new ATOM 0 HG2 MET A 75 -9.215 -5.347 4.999 1.00 0.00 H new ATOM 0 HG3 MET A 75 -7.917 -5.622 3.855 1.00 0.00 H new ATOM 0 HE1 MET A 75 -9.320 -7.057 0.992 1.00 0.00 H new ATOM 0 HE2 MET A 75 -7.863 -6.758 1.969 1.00 0.00 H new ATOM 0 HE3 MET A 75 -8.566 -8.391 1.897 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.913 -9.005 6.856 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.630 -9.323 7.455 1.00 0.00 C ATOM 1246 C VAL A 76 -3.984 -10.461 6.656 1.00 0.00 C ATOM 1247 O VAL A 76 -2.780 -10.411 6.433 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.759 -9.537 8.971 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.369 -10.889 9.347 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.389 -9.319 9.621 1.00 0.00 C ATOM 0 H VAL A 76 -6.725 -9.163 7.452 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.937 -8.484 7.388 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.466 -8.803 9.357 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.430 -10.972 10.432 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.369 -10.968 8.920 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.743 -11.692 8.957 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.469 -9.468 10.698 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.673 -10.030 9.208 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.048 -8.303 9.420 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.755 -11.408 6.104 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.215 -12.510 5.300 1.00 0.00 C ATOM 1262 C ASP A 77 -3.522 -11.971 4.038 1.00 0.00 C ATOM 1263 O ASP A 77 -2.677 -12.653 3.453 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.292 -13.551 4.935 1.00 0.00 C ATOM 1265 CG ASP A 77 -5.442 -14.697 5.947 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -4.423 -15.173 6.503 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -6.583 -15.202 6.124 1.00 0.00 O ATOM 0 H ASP A 77 -5.770 -11.431 6.203 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.474 -13.023 5.913 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.251 -13.043 4.836 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.054 -13.974 3.959 1.00 0.00 H new ATOM 1272 N SER A 78 -3.850 -10.755 3.581 1.00 0.00 N ATOM 1273 CA SER A 78 -3.211 -10.146 2.422 1.00 0.00 C ATOM 1274 C SER A 78 -1.776 -9.707 2.777 1.00 0.00 C ATOM 1275 O SER A 78 -1.003 -9.406 1.864 1.00 0.00 O ATOM 1276 CB SER A 78 -4.031 -8.945 1.908 1.00 0.00 C ATOM 1277 OG SER A 78 -4.664 -9.249 0.683 1.00 0.00 O ATOM 0 H SER A 78 -4.568 -10.171 4.010 1.00 0.00 H new ATOM 0 HA SER A 78 -3.165 -10.888 1.625 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.781 -8.668 2.649 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.377 -8.083 1.779 1.00 0.00 H new ATOM 0 HG SER A 78 -5.179 -8.472 0.379 1.00 0.00 H new ATOM 1283 N CYS A 79 -1.375 -9.693 4.060 1.00 0.00 N ATOM 1284 CA CYS A 79 -0.041 -9.278 4.496 1.00 0.00 C ATOM 1285 C CYS A 79 1.078 -10.241 4.104 1.00 0.00 C ATOM 1286 O CYS A 79 2.241 -9.963 4.404 1.00 0.00 O ATOM 1287 CB CYS A 79 0.001 -8.982 6.009 1.00 0.00 C ATOM 1288 SG CYS A 79 0.150 -10.485 7.026 1.00 0.00 S ATOM 0 H CYS A 79 -1.981 -9.975 4.830 1.00 0.00 H new ATOM 0 HA CYS A 79 0.153 -8.354 3.951 1.00 0.00 H new ATOM 0 HB2 CYS A 79 0.842 -8.322 6.221 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.904 -8.446 6.294 1.00 0.00 H new ATOM 0 HG CYS A 79 -1.014 -11.053 7.134 1.00 0.00 H new ATOM 1294 N GLN A 80 0.768 -11.347 3.424 1.00 0.00 N ATOM 1295 CA GLN A 80 1.699 -12.380 2.969 1.00 0.00 C ATOM 1296 C GLN A 80 2.727 -11.912 1.920 1.00 0.00 C ATOM 1297 O GLN A 80 3.414 -12.721 1.297 1.00 0.00 O ATOM 1298 CB GLN A 80 0.879 -13.579 2.451 1.00 0.00 C ATOM 1299 CG GLN A 80 0.086 -14.378 3.500 1.00 0.00 C ATOM 1300 CD GLN A 80 0.968 -15.312 4.323 1.00 0.00 C ATOM 1301 OE1 GLN A 80 1.752 -16.097 3.781 1.00 0.00 O ATOM 1302 NE2 GLN A 80 0.871 -15.249 5.636 1.00 0.00 N ATOM 0 H GLN A 80 -0.195 -11.557 3.162 1.00 0.00 H new ATOM 0 HA GLN A 80 2.309 -12.662 3.827 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.178 -13.213 1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.560 -14.264 1.945 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.424 -13.685 4.169 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.685 -14.962 2.998 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.218 -14.595 6.068 1.00 0.00 H new ATOM 0 HE22 GLN A 80 1.449 -15.854 6.220 1.00 0.00 H new ATOM 1311 N THR A 81 2.838 -10.606 1.757 1.00 0.00 N ATOM 1312 CA THR A 81 3.699 -9.865 0.843 1.00 0.00 C ATOM 1313 C THR A 81 4.830 -9.113 1.543 1.00 0.00 C ATOM 1314 O THR A 81 5.757 -8.641 0.887 1.00 0.00 O ATOM 1315 CB THR A 81 2.788 -8.920 0.071 1.00 0.00 C ATOM 1316 OG1 THR A 81 3.363 -8.592 -1.171 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.340 -7.662 0.808 1.00 0.00 C ATOM 0 H THR A 81 2.270 -9.970 2.317 1.00 0.00 H new ATOM 0 HA THR A 81 4.214 -10.559 0.179 1.00 0.00 H new ATOM 0 HB THR A 81 1.866 -9.485 -0.068 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.329 -8.469 -1.062 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.697 -7.069 0.158 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.789 -7.943 1.706 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.214 -7.074 1.088 1.00 0.00 H new ATOM 1325 N ALA A 82 4.743 -9.052 2.868 1.00 0.00 N ATOM 1326 CA ALA A 82 5.660 -8.416 3.814 1.00 0.00 C ATOM 1327 C ALA A 82 5.561 -6.888 3.781 1.00 0.00 C ATOM 1328 O ALA A 82 6.306 -6.210 3.073 1.00 0.00 O ATOM 1329 CB ALA A 82 7.106 -8.916 3.654 1.00 0.00 C ATOM 0 H ALA A 82 3.958 -9.486 3.353 1.00 0.00 H new ATOM 0 HA ALA A 82 5.340 -8.723 4.810 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.747 -8.414 4.379 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.140 -9.992 3.824 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.457 -8.697 2.646 1.00 0.00 H new ATOM 1335 N LEU A 83 4.601 -6.362 4.540 1.00 0.00 N ATOM 1336 CA LEU A 83 4.293 -4.943 4.722 1.00 0.00 C ATOM 1337 C LEU A 83 3.950 -4.724 6.196 1.00 0.00 C ATOM 1338 O LEU A 83 3.759 -5.706 6.924 1.00 0.00 O ATOM 1339 CB LEU A 83 3.162 -4.479 3.776 1.00 0.00 C ATOM 1340 CG LEU A 83 1.979 -5.440 3.579 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.182 -5.715 4.849 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.028 -4.889 2.517 1.00 0.00 C ATOM 0 H LEU A 83 3.974 -6.957 5.082 1.00 0.00 H new ATOM 0 HA LEU A 83 5.157 -4.333 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.771 -3.534 4.153 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.600 -4.276 2.799 1.00 0.00 H new ATOM 0 HG LEU A 83 2.420 -6.386 3.266 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.366 -6.402 4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.835 -6.161 5.599 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.774 -4.780 5.232 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.193 -5.577 2.384 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.651 -3.917 2.835 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.561 -4.779 1.573 1.00 0.00 H new ATOM 1354 N SER A 84 3.907 -3.481 6.677 1.00 0.00 N ATOM 1355 CA SER A 84 3.570 -3.219 8.064 1.00 0.00 C ATOM 1356 C SER A 84 2.060 -3.434 8.243 1.00 0.00 C ATOM 1357 O SER A 84 1.294 -3.266 7.288 1.00 0.00 O ATOM 1358 CB SER A 84 4.070 -1.826 8.468 1.00 0.00 C ATOM 1359 OG SER A 84 3.340 -0.751 7.916 1.00 0.00 O ATOM 0 H SER A 84 4.102 -2.647 6.123 1.00 0.00 H new ATOM 0 HA SER A 84 4.070 -3.910 8.742 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.041 -1.746 9.555 1.00 0.00 H new ATOM 0 HB3 SER A 84 5.114 -1.729 8.169 1.00 0.00 H new ATOM 0 HG SER A 84 3.723 0.097 8.225 1.00 0.00 H new ATOM 1365 N PRO A 85 1.584 -3.758 9.454 1.00 0.00 N ATOM 1366 CA PRO A 85 0.163 -3.992 9.688 1.00 0.00 C ATOM 1367 C PRO A 85 -0.709 -2.776 9.364 1.00 0.00 C ATOM 1368 O PRO A 85 -1.859 -2.927 8.944 1.00 0.00 O ATOM 1369 CB PRO A 85 0.061 -4.392 11.157 1.00 0.00 C ATOM 1370 CG PRO A 85 1.342 -3.875 11.801 1.00 0.00 C ATOM 1371 CD PRO A 85 2.353 -3.981 10.668 1.00 0.00 C ATOM 0 HA PRO A 85 -0.216 -4.770 9.025 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -0.820 -3.953 11.625 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -0.026 -5.473 11.266 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.233 -2.849 12.152 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.634 -4.477 12.662 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.145 -3.240 10.775 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.832 -4.960 10.657 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.161 -1.571 9.518 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.866 -0.335 9.249 1.00 0.00 C ATOM 1381 C GLY A 86 -0.941 -0.018 7.766 1.00 0.00 C ATOM 1382 O GLY A 86 -1.695 0.879 7.402 1.00 0.00 O ATOM 0 H GLY A 86 0.798 -1.433 9.838 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.876 -0.401 9.654 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.367 0.484 9.767 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.123 -0.625 6.897 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.233 -0.334 5.463 1.00 0.00 C ATOM 1388 C GLU A 87 -1.591 -0.878 5.025 1.00 0.00 C ATOM 1389 O GLU A 87 -2.321 -0.211 4.305 1.00 0.00 O ATOM 1390 CB GLU A 87 0.911 -0.970 4.659 1.00 0.00 C ATOM 1391 CG GLU A 87 2.272 -0.337 5.001 1.00 0.00 C ATOM 1392 CD GLU A 87 3.049 0.273 3.828 1.00 0.00 C ATOM 1393 OE1 GLU A 87 2.459 0.739 2.832 1.00 0.00 O ATOM 1394 OE2 GLU A 87 4.297 0.338 3.926 1.00 0.00 O ATOM 0 H GLU A 87 0.600 -1.299 7.150 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.156 0.737 5.278 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.947 -2.040 4.862 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.714 -0.854 3.593 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.110 0.442 5.746 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.897 -1.099 5.467 1.00 0.00 H new ATOM 1401 N MET A 88 -1.982 -2.045 5.552 1.00 0.00 N ATOM 1402 CA MET A 88 -3.258 -2.670 5.246 1.00 0.00 C ATOM 1403 C MET A 88 -4.386 -1.675 5.524 1.00 0.00 C ATOM 1404 O MET A 88 -5.273 -1.487 4.695 1.00 0.00 O ATOM 1405 CB MET A 88 -3.435 -3.935 6.103 1.00 0.00 C ATOM 1406 CG MET A 88 -4.445 -4.896 5.462 1.00 0.00 C ATOM 1407 SD MET A 88 -3.934 -5.564 3.851 1.00 0.00 S ATOM 1408 CE MET A 88 -2.443 -6.455 4.361 1.00 0.00 C ATOM 0 H MET A 88 -1.411 -2.580 6.207 1.00 0.00 H new ATOM 0 HA MET A 88 -3.286 -2.956 4.195 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.474 -4.436 6.220 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.774 -3.658 7.101 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.621 -5.726 6.146 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.395 -4.376 5.340 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.080 -7.062 3.531 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.673 -5.740 4.652 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.677 -7.101 5.207 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.329 -1.032 6.692 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.294 -0.043 7.146 1.00 0.00 C ATOM 1420 C GLU A 89 -5.307 1.164 6.235 1.00 0.00 C ATOM 1421 O GLU A 89 -6.386 1.647 5.895 1.00 0.00 O ATOM 1422 CB GLU A 89 -4.939 0.451 8.543 1.00 0.00 C ATOM 1423 CG GLU A 89 -4.884 -0.694 9.535 1.00 0.00 C ATOM 1424 CD GLU A 89 -4.814 -0.181 10.969 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -4.184 0.873 11.212 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -5.345 -0.870 11.875 1.00 0.00 O ATOM 0 H GLU A 89 -3.582 -1.195 7.367 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.270 -0.529 7.143 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.975 0.959 8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -5.677 1.183 8.870 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.765 -1.325 9.415 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -4.014 -1.317 9.327 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.121 1.653 5.872 1.00 0.00 N ATOM 1434 CA LYS A 90 -3.955 2.800 5.001 1.00 0.00 C ATOM 1435 C LYS A 90 -4.599 2.524 3.654 1.00 0.00 C ATOM 1436 O LYS A 90 -5.200 3.430 3.087 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.463 3.154 4.861 1.00 0.00 C ATOM 1438 CG LYS A 90 -1.943 3.840 6.136 1.00 0.00 C ATOM 1439 CD LYS A 90 -2.317 5.321 6.119 1.00 0.00 C ATOM 1440 CE LYS A 90 -2.419 5.932 7.516 1.00 0.00 C ATOM 1441 NZ LYS A 90 -2.849 7.343 7.450 1.00 0.00 N ATOM 0 H LYS A 90 -3.237 1.251 6.185 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.455 3.664 5.439 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.886 2.249 4.668 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.319 3.812 4.004 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.367 3.359 7.017 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.861 3.730 6.203 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.573 5.870 5.543 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.271 5.442 5.606 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.128 5.360 8.115 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.453 5.866 8.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.910 7.733 8.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.159 7.891 6.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.782 7.401 6.994 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.559 1.284 3.164 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.155 0.995 1.872 1.00 0.00 C ATOM 1457 C HIS A 91 -6.679 0.904 2.010 1.00 0.00 C ATOM 1458 O HIS A 91 -7.422 1.281 1.105 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.536 -0.257 1.239 1.00 0.00 C ATOM 1460 CG HIS A 91 -3.026 -0.374 1.276 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -2.103 0.651 1.349 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -2.329 -1.555 1.296 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -0.890 0.084 1.458 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -0.967 -1.260 1.406 1.00 0.00 N ATOM 0 H HIS A 91 -4.130 0.486 3.633 1.00 0.00 H new ATOM 0 HA HIS A 91 -4.937 1.814 1.186 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.955 -1.131 1.738 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -4.853 -0.302 0.197 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -2.305 1.651 1.325 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.759 -2.544 1.237 1.00 0.00 H new ATOM 0 HE1 HIS A 91 0.031 0.636 1.573 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.168 0.421 3.153 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.600 0.284 3.414 1.00 0.00 C ATOM 1474 C LEU A 92 -9.248 1.646 3.609 1.00 0.00 C ATOM 1475 O LEU A 92 -10.324 1.894 3.069 1.00 0.00 O ATOM 1476 CB LEU A 92 -8.828 -0.576 4.668 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.417 -2.031 4.432 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -8.169 -2.755 5.760 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.487 -2.772 3.627 1.00 0.00 C ATOM 0 H LEU A 92 -6.579 0.113 3.926 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.057 -0.201 2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.257 -0.166 5.501 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.879 -0.535 4.952 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.488 -2.024 3.862 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.878 -3.787 5.563 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.371 -2.251 6.306 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.081 -2.742 6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.175 -3.805 3.471 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.430 -2.757 4.174 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.620 -2.283 2.662 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.599 2.521 4.377 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.130 3.846 4.643 1.00 0.00 C ATOM 1493 C VAL A 93 -9.097 4.668 3.362 1.00 0.00 C ATOM 1494 O VAL A 93 -10.096 5.318 3.073 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.451 4.497 5.865 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.003 4.916 5.610 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.260 5.692 6.380 1.00 0.00 C ATOM 0 H VAL A 93 -7.703 2.330 4.824 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.178 3.783 4.937 1.00 0.00 H new ATOM 0 HB VAL A 93 -8.425 3.721 6.630 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.590 5.366 6.513 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -6.413 4.040 5.339 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -6.972 5.641 4.796 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -8.755 6.129 7.242 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.346 6.440 5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.255 5.358 6.673 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.021 4.605 2.556 1.00 0.00 N ATOM 1508 CA LEU A 94 -7.963 5.369 1.309 1.00 0.00 C ATOM 1509 C LEU A 94 -9.152 4.970 0.436 1.00 0.00 C ATOM 1510 O LEU A 94 -9.800 5.824 -0.157 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.629 5.213 0.573 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.533 4.148 -0.532 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -7.004 4.626 -1.916 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -5.079 3.739 -0.669 1.00 0.00 C ATOM 0 H LEU A 94 -7.194 4.040 2.747 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.027 6.430 1.549 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.378 6.177 0.130 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.862 4.993 1.316 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.189 3.332 -0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.903 3.813 -2.635 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.049 4.932 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.395 5.472 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.986 2.983 -1.448 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.480 4.610 -0.935 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.725 3.330 0.277 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.464 3.670 0.368 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.570 3.203 -0.443 1.00 0.00 C ATOM 1528 C LEU A 95 -11.888 3.776 0.056 1.00 0.00 C ATOM 1529 O LEU A 95 -12.620 4.342 -0.745 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.660 1.676 -0.415 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.647 0.906 -1.265 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.804 -0.575 -0.906 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.868 1.142 -2.758 1.00 0.00 C ATOM 0 H LEU A 95 -8.963 2.934 0.866 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.388 3.540 -1.463 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.553 1.349 0.619 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.661 1.389 -0.738 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.634 1.250 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -9.099 -1.167 -1.489 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.604 -0.715 0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.821 -0.898 -1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.130 0.579 -3.329 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.869 0.812 -3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.763 2.204 -2.978 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.200 3.613 1.343 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.446 4.116 1.916 1.00 0.00 C ATOM 1547 C ALA A 96 -13.562 5.643 1.816 1.00 0.00 C ATOM 1548 O ALA A 96 -14.672 6.171 1.735 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.531 3.671 3.380 1.00 0.00 C ATOM 0 H ALA A 96 -11.599 3.132 2.012 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.276 3.702 1.344 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.458 4.041 3.819 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.514 2.582 3.431 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.682 4.073 3.932 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.424 6.337 1.814 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.296 7.779 1.739 1.00 0.00 C ATOM 1557 C GLU A 97 -12.558 8.289 0.326 1.00 0.00 C ATOM 1558 O GLU A 97 -13.460 9.100 0.115 1.00 0.00 O ATOM 1559 CB GLU A 97 -10.878 8.142 2.223 1.00 0.00 C ATOM 1560 CG GLU A 97 -10.489 9.622 2.152 1.00 0.00 C ATOM 1561 CD GLU A 97 -11.512 10.542 2.814 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -12.067 10.158 3.868 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -11.771 11.624 2.242 1.00 0.00 O ATOM 0 H GLU A 97 -11.517 5.873 1.868 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.041 8.259 2.373 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -10.775 7.812 3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.160 7.572 1.633 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -9.520 9.760 2.632 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.371 9.911 1.108 1.00 0.00 H new ATOM 1570 N LEU A 98 -11.754 7.859 -0.648 1.00 0.00 N ATOM 1571 CA LEU A 98 -11.892 8.295 -2.029 1.00 0.00 C ATOM 1572 C LEU A 98 -13.108 7.667 -2.703 1.00 0.00 C ATOM 1573 O LEU A 98 -13.641 8.273 -3.635 1.00 0.00 O ATOM 1574 CB LEU A 98 -10.655 7.900 -2.867 1.00 0.00 C ATOM 1575 CG LEU A 98 -9.374 8.739 -2.674 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.595 8.363 -1.410 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -8.446 8.501 -3.875 1.00 0.00 C ATOM 0 H LEU A 98 -10.991 7.199 -0.497 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.002 9.379 -1.990 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.414 6.860 -2.645 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.932 7.945 -3.920 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.686 9.780 -2.584 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.706 8.988 -1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.226 8.517 -0.535 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.299 7.315 -1.463 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.535 9.088 -3.753 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.191 7.443 -3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.952 8.803 -4.792 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.552 6.482 -2.274 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.666 5.744 -2.871 1.00 0.00 C ATOM 1591 C LEU A 99 -15.790 5.461 -1.852 1.00 0.00 C ATOM 1592 O LEU A 99 -16.028 4.299 -1.495 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.132 4.438 -3.522 1.00 0.00 C ATOM 1594 CG LEU A 99 -12.736 4.454 -4.185 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.427 3.055 -4.727 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -12.621 5.454 -5.337 1.00 0.00 C ATOM 0 H LEU A 99 -13.134 5.997 -1.480 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.116 6.364 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.123 3.665 -2.753 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -14.853 4.127 -4.278 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.026 4.760 -3.417 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -11.444 3.056 -5.197 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.437 2.337 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.181 2.775 -5.463 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.616 5.412 -5.756 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -13.347 5.203 -6.110 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -12.818 6.460 -4.967 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.536 6.480 -1.388 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.614 6.274 -0.425 1.00 0.00 C ATOM 1610 C PRO A 100 -18.763 5.474 -1.042 1.00 0.00 C ATOM 1611 O PRO A 100 -19.423 4.715 -0.334 1.00 0.00 O ATOM 1612 CB PRO A 100 -18.055 7.670 0.021 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.711 8.526 -1.193 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.415 7.893 -1.701 1.00 0.00 C ATOM 0 HA PRO A 100 -17.281 5.686 0.430 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -19.119 7.705 0.254 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.522 7.998 0.914 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.498 8.494 -1.946 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.571 9.573 -0.923 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.293 8.050 -2.773 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.544 8.332 -1.213 1.00 0.00 H new ATOM 1622 N ASP A 101 -18.995 5.599 -2.353 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.056 4.857 -3.037 1.00 0.00 C ATOM 1624 C ASP A 101 -19.642 3.404 -3.287 1.00 0.00 C ATOM 1625 O ASP A 101 -20.432 2.625 -3.826 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.407 5.500 -4.386 1.00 0.00 C ATOM 1627 CG ASP A 101 -21.323 6.708 -4.270 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -22.422 6.560 -3.681 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -20.946 7.768 -4.815 1.00 0.00 O ATOM 0 H ASP A 101 -18.457 6.213 -2.965 1.00 0.00 H new ATOM 0 HA ASP A 101 -20.928 4.883 -2.383 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -19.486 5.801 -4.885 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -20.884 4.753 -5.021 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.403 3.023 -2.957 1.00 0.00 N ATOM 1635 CA TRP A 102 -17.927 1.671 -3.165 1.00 0.00 C ATOM 1636 C TRP A 102 -17.957 0.867 -1.875 1.00 0.00 C ATOM 1637 O TRP A 102 -18.390 -0.277 -1.929 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.541 1.686 -3.801 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.113 0.367 -4.358 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -16.857 -0.420 -5.164 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -14.868 -0.354 -4.151 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.124 -1.520 -5.553 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -14.879 -1.515 -4.978 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -13.736 -0.161 -3.338 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -13.800 -2.401 -5.042 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.672 -1.079 -3.368 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -12.697 -2.199 -4.208 1.00 0.00 C ATOM 0 H TRP A 102 -17.713 3.648 -2.541 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.603 1.171 -3.859 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.527 2.428 -4.600 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -15.814 2.007 -3.055 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -17.876 -0.217 -5.460 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.463 -2.244 -6.186 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.684 0.699 -2.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -13.818 -3.234 -5.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -11.816 -0.917 -2.729 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -11.874 -2.898 -4.211 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.483 1.417 -0.751 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.472 0.740 0.546 1.00 0.00 C ATOM 1660 C LEU A 103 -18.502 1.410 1.434 1.00 0.00 C ATOM 1661 O LEU A 103 -18.432 2.625 1.620 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.106 0.858 1.241 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.056 -0.132 0.722 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -13.645 0.393 0.986 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -15.211 -1.478 1.432 1.00 0.00 C ATOM 0 H LEU A 103 -17.091 2.358 -0.719 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.689 -0.316 0.383 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.730 1.873 1.111 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.240 0.703 2.312 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.207 -0.252 -0.351 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.914 -0.323 0.611 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -13.511 1.348 0.478 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -13.502 0.529 2.058 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.462 -2.175 1.058 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -15.075 -1.341 2.505 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -16.207 -1.878 1.240 1.00 0.00 H new ATOM 1677 N SER A 104 -19.403 0.626 2.016 1.00 0.00 N ATOM 1678 CA SER A 104 -20.441 1.145 2.901 1.00 0.00 C ATOM 1679 C SER A 104 -20.531 0.310 4.174 1.00 0.00 C ATOM 1680 O SER A 104 -20.645 -0.911 4.118 1.00 0.00 O ATOM 1681 CB SER A 104 -21.773 1.180 2.167 1.00 0.00 C ATOM 1682 OG SER A 104 -21.697 1.996 1.004 1.00 0.00 O ATOM 0 H SER A 104 -19.435 -0.385 1.888 1.00 0.00 H new ATOM 0 HA SER A 104 -20.183 2.162 3.195 1.00 0.00 H new ATOM 0 HB2 SER A 104 -22.063 0.168 1.886 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.548 1.561 2.832 1.00 0.00 H new ATOM 0 HG SER A 104 -22.565 2.000 0.550 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.443 0.955 5.330 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.495 0.340 6.649 1.00 0.00 C ATOM 1690 C LEU A 105 -21.934 0.144 7.109 1.00 0.00 C ATOM 1691 O LEU A 105 -22.808 0.963 6.831 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.776 1.253 7.655 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.248 1.070 7.658 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -17.562 2.335 8.176 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.844 -0.111 8.555 1.00 0.00 C ATOM 0 H LEU A 105 -20.328 1.968 5.375 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.011 -0.635 6.593 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -20.010 2.292 7.424 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -20.161 1.054 8.655 1.00 0.00 H new ATOM 0 HG LEU A 105 -17.934 0.872 6.633 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -16.482 2.191 8.172 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -17.818 3.177 7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -17.897 2.540 9.193 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.760 -0.223 8.543 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -18.178 0.076 9.575 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -18.307 -1.025 8.184 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.150 -0.906 7.900 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.428 -1.302 8.479 1.00 0.00 C ATOM 1709 C HIS A 106 -23.214 -1.863 9.888 1.00 0.00 C ATOM 1710 O HIS A 106 -22.796 -3.008 10.070 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.108 -2.347 7.584 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.664 -1.757 6.319 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.936 -1.259 6.157 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.986 -1.566 5.146 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -26.023 -0.777 4.909 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.856 -0.930 4.257 1.00 0.00 N ATOM 0 H HIS A 106 -21.394 -1.537 8.167 1.00 0.00 H new ATOM 0 HA HIS A 106 -24.075 -0.427 8.547 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -23.388 -3.125 7.331 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -24.913 -2.826 8.140 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -22.965 -1.854 4.944 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -26.909 -0.327 4.485 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -24.648 -0.639 3.302 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.497 -1.068 10.918 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.359 -1.489 12.308 1.00 0.00 C ATOM 1726 C ARG A 107 -24.650 -2.206 12.697 1.00 0.00 C ATOM 1727 O ARG A 107 -25.717 -1.594 12.644 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.121 -0.269 13.214 1.00 0.00 C ATOM 1729 CG ARG A 107 -22.705 -0.710 14.621 1.00 0.00 C ATOM 1730 CD ARG A 107 -21.191 -0.881 14.754 1.00 0.00 C ATOM 1731 NE ARG A 107 -20.891 -1.654 15.964 1.00 0.00 N ATOM 1732 CZ ARG A 107 -19.783 -1.630 16.708 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -18.754 -0.837 16.421 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -19.747 -2.428 17.764 1.00 0.00 N ATOM 0 H ARG A 107 -23.830 -0.110 10.810 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.505 -2.155 12.427 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.346 0.365 12.782 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.029 0.331 13.270 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -23.050 0.027 15.347 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -23.197 -1.652 14.864 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -20.793 -1.390 13.876 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -20.707 0.094 14.803 1.00 0.00 H new ATOM 0 HE ARG A 107 -21.623 -2.292 16.277 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -18.796 -0.221 15.609 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -17.923 -0.845 17.013 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -20.545 -3.026 17.979 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -18.921 -2.445 18.363 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.585 -3.477 13.090 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.753 -4.254 13.493 1.00 0.00 C ATOM 1750 C ILE A 108 -25.624 -4.480 14.997 1.00 0.00 C ATOM 1751 O ILE A 108 -24.523 -4.627 15.527 1.00 0.00 O ATOM 1752 CB ILE A 108 -25.833 -5.587 12.702 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.442 -5.475 11.211 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.228 -6.230 12.835 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.272 -4.488 10.377 1.00 0.00 C ATOM 0 H ILE A 108 -23.711 -4.000 13.138 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.680 -3.726 13.271 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.083 -6.230 13.163 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.394 -5.182 11.150 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.523 -6.463 10.758 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.254 -7.162 12.271 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.435 -6.436 13.885 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -27.982 -5.547 12.443 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -25.913 -4.489 9.348 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.320 -4.787 10.396 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.173 -3.486 10.794 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.762 -4.602 15.690 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.878 -4.827 17.138 1.00 0.00 C ATOM 1769 C ARG A 109 -26.195 -6.109 17.641 1.00 0.00 C ATOM 1770 O ARG A 109 -26.339 -6.458 18.809 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.379 -4.854 17.491 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.056 -6.172 17.045 1.00 0.00 C ATOM 1773 CD ARG A 109 -29.488 -7.031 18.252 1.00 0.00 C ATOM 1774 NE ARG A 109 -29.510 -8.476 17.944 1.00 0.00 N ATOM 1775 CZ ARG A 109 -28.553 -9.372 18.248 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -27.478 -9.037 18.957 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -28.650 -10.620 17.799 1.00 0.00 N ATOM 0 H ARG A 109 -27.673 -4.544 15.235 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.353 -4.013 17.638 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.501 -4.730 18.567 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.879 -4.011 17.015 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.927 -5.944 16.431 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.367 -6.742 16.421 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -28.806 -6.851 19.083 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.480 -6.718 18.579 1.00 0.00 H new ATOM 0 HE ARG A 109 -30.331 -8.829 17.453 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -27.362 -8.078 19.286 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -26.770 -9.739 19.172 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -29.448 -10.895 17.226 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -27.927 -11.302 18.027 1.00 0.00 H new ATOM 1791 N THR A 110 -25.587 -6.875 16.745 1.00 0.00 N ATOM 1792 CA THR A 110 -24.899 -8.119 17.006 1.00 0.00 C ATOM 1793 C THR A 110 -23.440 -8.050 16.557 1.00 0.00 C ATOM 1794 O THR A 110 -22.602 -8.691 17.183 1.00 0.00 O ATOM 1795 CB THR A 110 -25.704 -9.238 16.307 1.00 0.00 C ATOM 1796 OG1 THR A 110 -25.530 -10.494 16.928 1.00 0.00 O ATOM 1797 CG2 THR A 110 -25.534 -9.333 14.787 1.00 0.00 C ATOM 0 H THR A 110 -25.563 -6.623 15.757 1.00 0.00 H new ATOM 0 HA THR A 110 -24.850 -8.329 18.075 1.00 0.00 H new ATOM 0 HB THR A 110 -26.739 -8.926 16.444 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.058 -11.169 16.454 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.143 -10.151 14.403 1.00 0.00 H new ATOM 0 HG22 THR A 110 -25.851 -8.397 14.326 1.00 0.00 H new ATOM 0 HG23 THR A 110 -24.487 -9.518 14.549 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.101 -7.262 15.526 1.00 0.00 N ATOM 1806 CA ASP A 111 -21.734 -7.189 15.008 1.00 0.00 C ATOM 1807 C ASP A 111 -21.664 -6.109 13.931 1.00 0.00 C ATOM 1808 O ASP A 111 -22.699 -5.603 13.492 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.374 -8.553 14.377 1.00 0.00 C ATOM 1810 CG ASP A 111 -20.050 -9.149 14.849 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.629 -8.994 16.018 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.434 -9.842 14.008 1.00 0.00 O ATOM 0 H ASP A 111 -23.764 -6.663 15.034 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.039 -6.950 15.813 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.173 -9.261 14.596 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.338 -8.438 13.294 1.00 0.00 H new ATOM 1817 N THR A 112 -20.467 -5.749 13.485 1.00 0.00 N ATOM 1818 CA THR A 112 -20.262 -4.750 12.448 1.00 0.00 C ATOM 1819 C THR A 112 -20.117 -5.467 11.105 1.00 0.00 C ATOM 1820 O THR A 112 -19.588 -6.583 11.048 1.00 0.00 O ATOM 1821 CB THR A 112 -19.035 -3.893 12.789 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.143 -3.395 14.104 1.00 0.00 O ATOM 1823 CG2 THR A 112 -18.939 -2.701 11.835 1.00 0.00 C ATOM 0 H THR A 112 -19.599 -6.150 13.840 1.00 0.00 H new ATOM 0 HA THR A 112 -21.115 -4.074 12.384 1.00 0.00 H new ATOM 0 HB THR A 112 -18.148 -4.519 12.694 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.355 -2.851 14.313 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.064 -2.102 12.088 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.848 -3.061 10.810 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.837 -2.089 11.926 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.579 -4.831 10.029 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.530 -5.358 8.673 1.00 0.00 C ATOM 1833 C TYR A 113 -20.257 -4.219 7.687 1.00 0.00 C ATOM 1834 O TYR A 113 -20.351 -3.040 8.045 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.899 -5.968 8.309 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.272 -7.282 8.969 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.641 -7.336 10.325 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.348 -8.451 8.192 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.036 -8.545 10.920 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.764 -9.663 8.764 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.084 -9.721 10.137 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.455 -10.905 10.692 1.00 0.00 O ATOM 0 H TYR A 113 -21.010 -3.908 10.082 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.743 -6.110 8.618 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.670 -5.237 8.553 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.928 -6.113 7.229 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.620 -6.434 10.918 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -22.084 -8.416 7.145 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.301 -8.576 11.967 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.839 -10.551 8.154 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.433 -11.607 10.009 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.907 -4.575 6.455 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.651 -3.694 5.324 1.00 0.00 C ATOM 1854 C VAL A 114 -20.398 -4.300 4.130 1.00 0.00 C ATOM 1855 O VAL A 114 -20.666 -5.503 4.100 1.00 0.00 O ATOM 1856 CB VAL A 114 -18.131 -3.498 5.075 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.768 -2.909 3.705 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.539 -2.531 6.108 1.00 0.00 C ATOM 0 H VAL A 114 -19.787 -5.556 6.205 1.00 0.00 H new ATOM 0 HA VAL A 114 -20.016 -2.684 5.512 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.726 -4.508 5.142 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.685 -2.810 3.627 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -18.130 -3.570 2.917 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -18.230 -1.928 3.597 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.473 -2.405 5.919 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -18.038 -1.565 6.030 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.685 -2.935 7.110 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.735 -3.470 3.152 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.398 -3.738 1.890 1.00 0.00 C ATOM 1870 C LYS A 115 -20.480 -3.148 0.827 1.00 0.00 C ATOM 1871 O LYS A 115 -19.714 -2.224 1.126 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.766 -3.056 1.817 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.895 -4.092 1.847 1.00 0.00 C ATOM 1874 CD LYS A 115 -25.108 -3.558 1.087 1.00 0.00 C ATOM 1875 CE LYS A 115 -24.902 -3.645 -0.436 1.00 0.00 C ATOM 1876 NZ LYS A 115 -25.594 -2.567 -1.168 1.00 0.00 N ATOM 0 H LYS A 115 -20.523 -2.476 3.239 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.572 -4.806 1.759 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.878 -2.366 2.653 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.834 -2.464 0.904 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.556 -5.026 1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.169 -4.314 2.878 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.994 -4.127 1.368 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.290 -2.522 1.372 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -23.836 -3.602 -0.657 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -25.263 -4.610 -0.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -25.422 -2.674 -2.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.616 -2.621 -0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.233 -1.645 -0.851 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.547 -3.671 -0.396 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.712 -3.167 -1.475 1.00 0.00 C ATOM 1892 C LEU A 116 -20.429 -3.250 -2.812 1.00 0.00 C ATOM 1893 O LEU A 116 -21.171 -4.203 -3.059 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.406 -3.967 -1.518 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.336 -3.371 -2.452 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.155 -2.883 -1.621 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.928 -4.377 -3.536 1.00 0.00 C ATOM 0 H LEU A 116 -21.167 -4.437 -0.659 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.492 -2.116 -1.286 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.998 -4.031 -0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.626 -4.985 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.748 -2.512 -2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.396 -2.461 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.494 -2.119 -0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -15.729 -3.720 -1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.172 -3.930 -4.181 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.521 -5.273 -3.067 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.801 -4.644 -4.132 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.165 -2.302 -3.705 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.769 -2.272 -5.023 1.00 0.00 C ATOM 1911 C ASP A 117 -19.817 -2.998 -5.969 1.00 0.00 C ATOM 1912 O ASP A 117 -18.861 -2.427 -6.493 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.033 -0.818 -5.454 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.411 -0.283 -5.043 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.058 -0.834 -4.121 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -22.869 0.686 -5.696 1.00 0.00 O ATOM 0 H ASP A 117 -19.522 -1.530 -3.529 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.738 -2.772 -5.033 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.263 -0.177 -5.024 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -20.936 -0.748 -6.537 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.043 -4.293 -6.191 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.209 -5.097 -7.096 1.00 0.00 C ATOM 1923 C LYS A 118 -19.564 -4.804 -8.561 1.00 0.00 C ATOM 1924 O LYS A 118 -18.810 -5.193 -9.462 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.421 -6.597 -6.816 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.978 -7.035 -5.418 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.359 -8.495 -5.133 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.795 -8.709 -4.670 1.00 0.00 C ATOM 1929 NZ LYS A 118 -20.948 -9.948 -3.876 1.00 0.00 N ATOM 0 H LYS A 118 -20.803 -4.815 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.166 -4.834 -6.921 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.477 -6.835 -6.943 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.872 -7.176 -7.559 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.899 -6.916 -5.324 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.436 -6.387 -4.671 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.194 -9.081 -6.037 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.686 -8.888 -4.371 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -21.113 -7.855 -4.072 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -21.452 -8.753 -5.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.927 -10.291 -3.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -20.297 -10.674 -4.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -20.728 -9.751 -2.879 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.705 -4.145 -8.790 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.239 -3.794 -10.101 1.00 0.00 C ATOM 1945 C ALA A 119 -20.746 -2.452 -10.651 1.00 0.00 C ATOM 1946 O ALA A 119 -21.154 -2.072 -11.753 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.766 -3.810 -10.022 1.00 0.00 C ATOM 0 H ALA A 119 -21.305 -3.829 -8.028 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.869 -4.539 -10.806 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -23.183 -3.549 -10.995 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -23.105 -4.806 -9.736 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -23.099 -3.086 -9.278 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.928 -1.725 -9.894 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.367 -0.439 -10.290 1.00 0.00 C ATOM 1955 C VAL A 120 -18.311 -0.662 -11.383 1.00 0.00 C ATOM 1956 O VAL A 120 -17.807 -1.782 -11.531 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.739 0.170 -9.020 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -17.453 -0.584 -8.648 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -18.443 1.671 -9.107 1.00 0.00 C ATOM 0 H VAL A 120 -19.630 -2.023 -8.965 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.122 0.233 -10.698 1.00 0.00 H new ATOM 0 HB VAL A 120 -19.496 0.056 -8.244 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.020 -0.144 -7.750 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.687 -1.632 -8.462 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -16.739 -0.512 -9.468 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -18.003 2.010 -8.169 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -17.745 1.857 -9.923 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -19.370 2.215 -9.291 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.931 0.375 -12.132 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.901 0.230 -13.154 1.00 0.00 C ATOM 1971 C ASP A 121 -15.554 0.395 -12.457 1.00 0.00 C ATOM 1972 O ASP A 121 -15.168 1.505 -12.065 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.028 1.230 -14.300 1.00 0.00 C ATOM 1974 CG ASP A 121 -16.089 0.846 -15.454 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -15.087 0.119 -15.250 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -16.391 1.240 -16.601 1.00 0.00 O ATOM 0 H ASP A 121 -18.319 1.315 -12.049 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.007 -0.751 -13.617 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -18.058 1.257 -14.655 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.787 2.232 -13.945 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.845 -0.718 -12.262 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.543 -0.722 -11.610 1.00 0.00 C ATOM 1983 C LEU A 122 -12.529 0.114 -12.399 1.00 0.00 C ATOM 1984 O LEU A 122 -11.598 0.647 -11.811 1.00 0.00 O ATOM 1985 CB LEU A 122 -13.053 -2.167 -11.409 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.315 -2.443 -10.085 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -11.071 -1.595 -9.882 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -13.221 -2.315 -8.854 1.00 0.00 C ATOM 0 H LEU A 122 -15.162 -1.642 -12.554 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.644 -0.261 -10.628 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.912 -2.835 -11.471 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -12.389 -2.424 -12.234 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.998 -3.481 -10.182 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.609 -1.849 -8.928 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.364 -1.786 -10.690 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.346 -0.540 -9.883 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.643 -2.521 -7.953 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.624 -1.304 -8.803 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.041 -3.029 -8.930 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.668 0.249 -13.720 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.746 1.057 -14.516 1.00 0.00 C ATOM 2002 C ALA A 123 -11.874 2.524 -14.093 1.00 0.00 C ATOM 2003 O ALA A 123 -10.879 3.251 -14.057 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.020 0.908 -16.016 1.00 0.00 C ATOM 0 H ALA A 123 -13.412 -0.192 -14.260 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.730 0.707 -14.336 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.316 1.522 -16.577 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.901 -0.136 -16.306 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.038 1.231 -16.234 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.094 2.969 -13.774 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.357 4.330 -13.334 1.00 0.00 C ATOM 2012 C GLY A 124 -12.754 4.521 -11.945 1.00 0.00 C ATOM 2013 O GLY A 124 -12.045 5.501 -11.711 1.00 0.00 O ATOM 0 H GLY A 124 -13.929 2.385 -13.817 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.924 5.044 -14.035 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.430 4.518 -13.309 1.00 0.00 H new ATOM 2017 N LEU A 125 -12.988 3.550 -11.050 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.502 3.553 -9.674 1.00 0.00 C ATOM 2019 C LEU A 125 -10.980 3.556 -9.653 1.00 0.00 C ATOM 2020 O LEU A 125 -10.392 4.406 -8.995 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.058 2.386 -8.847 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.579 2.428 -8.595 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.924 1.348 -7.569 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.100 3.771 -8.073 1.00 0.00 C ATOM 0 H LEU A 125 -13.537 2.720 -11.276 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.868 4.467 -9.205 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.815 1.453 -9.355 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.546 2.367 -7.885 1.00 0.00 H new ATOM 0 HG LEU A 125 -15.058 2.265 -9.561 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.997 1.360 -7.375 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.636 0.371 -7.958 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.386 1.542 -6.641 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.178 3.710 -7.924 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.616 4.006 -7.125 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.878 4.554 -8.798 1.00 0.00 H new ATOM 2036 N THR A 126 -10.326 2.636 -10.364 1.00 0.00 N ATOM 2037 CA THR A 126 -8.875 2.586 -10.421 1.00 0.00 C ATOM 2038 C THR A 126 -8.325 3.915 -10.929 1.00 0.00 C ATOM 2039 O THR A 126 -7.335 4.371 -10.376 1.00 0.00 O ATOM 2040 CB THR A 126 -8.435 1.394 -11.275 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.642 0.219 -10.515 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.960 1.418 -11.688 1.00 0.00 C ATOM 0 H THR A 126 -10.790 1.911 -10.912 1.00 0.00 H new ATOM 0 HA THR A 126 -8.464 2.437 -9.423 1.00 0.00 H new ATOM 0 HB THR A 126 -9.023 1.434 -12.192 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.369 -0.562 -11.040 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.736 0.537 -12.290 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.760 2.317 -12.272 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.333 1.417 -10.797 1.00 0.00 H new ATOM 2050 N ALA A 127 -8.946 4.568 -11.917 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.422 5.841 -12.398 1.00 0.00 C ATOM 2052 C ALA A 127 -8.461 6.899 -11.292 1.00 0.00 C ATOM 2053 O ALA A 127 -7.423 7.487 -10.993 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.165 6.280 -13.652 1.00 0.00 C ATOM 0 H ALA A 127 -9.791 4.243 -12.387 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.375 5.713 -12.672 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.763 7.232 -13.999 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.040 5.528 -14.431 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.225 6.395 -13.425 1.00 0.00 H new ATOM 2060 N ARG A 128 -9.622 7.139 -10.663 1.00 0.00 N ATOM 2061 CA ARG A 128 -9.708 8.135 -9.584 1.00 0.00 C ATOM 2062 C ARG A 128 -8.758 7.786 -8.433 1.00 0.00 C ATOM 2063 O ARG A 128 -8.209 8.681 -7.806 1.00 0.00 O ATOM 2064 CB ARG A 128 -11.158 8.354 -9.100 1.00 0.00 C ATOM 2065 CG ARG A 128 -11.861 7.097 -8.580 1.00 0.00 C ATOM 2066 CD ARG A 128 -13.324 7.308 -8.179 1.00 0.00 C ATOM 2067 NE ARG A 128 -13.465 8.158 -6.987 1.00 0.00 N ATOM 2068 CZ ARG A 128 -14.040 9.362 -6.916 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -14.597 9.935 -7.972 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -14.046 9.997 -5.761 1.00 0.00 N ATOM 0 H ARG A 128 -10.500 6.666 -10.878 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.382 9.089 -9.998 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -11.152 9.103 -8.308 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.742 8.765 -9.923 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -11.816 6.326 -9.349 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -11.312 6.719 -7.718 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -13.863 7.762 -9.010 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -13.788 6.340 -7.988 1.00 0.00 H new ATOM 0 HE ARG A 128 -13.081 7.787 -6.118 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -14.595 9.456 -8.873 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -15.028 10.855 -7.885 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -13.616 9.568 -4.941 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -14.480 10.917 -5.687 1.00 0.00 H new ATOM 2084 N LEU A 129 -8.528 6.499 -8.178 1.00 0.00 N ATOM 2085 CA LEU A 129 -7.651 5.995 -7.127 1.00 0.00 C ATOM 2086 C LEU A 129 -6.162 6.117 -7.484 1.00 0.00 C ATOM 2087 O LEU A 129 -5.341 6.271 -6.580 1.00 0.00 O ATOM 2088 CB LEU A 129 -8.082 4.545 -6.884 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.231 3.738 -5.891 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.159 2.937 -4.980 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -6.323 2.744 -6.622 1.00 0.00 C ATOM 0 H LEU A 129 -8.964 5.752 -8.719 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.750 6.591 -6.220 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.112 4.550 -6.527 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.079 4.022 -7.841 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.618 4.437 -5.323 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.564 2.361 -4.271 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.812 3.619 -4.436 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -8.764 2.259 -5.582 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.733 2.187 -5.894 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.934 2.051 -7.201 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.656 3.286 -7.292 1.00 0.00 H new ATOM 2103 N ALA A 130 -5.804 6.041 -8.764 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.452 6.139 -9.311 1.00 0.00 C ATOM 2105 C ALA A 130 -4.072 7.558 -9.747 1.00 0.00 C ATOM 2106 O ALA A 130 -2.925 7.797 -10.124 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.314 5.182 -10.499 1.00 0.00 C ATOM 0 H ALA A 130 -6.499 5.900 -9.497 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.766 5.865 -8.509 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.306 5.253 -10.909 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.499 4.161 -10.167 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.038 5.450 -11.268 1.00 0.00 H new ATOM 2113 N HIS A 131 -5.015 8.504 -9.765 1.00 0.00 N ATOM 2114 CA HIS A 131 -4.763 9.874 -10.199 1.00 0.00 C ATOM 2115 C HIS A 131 -3.621 10.595 -9.471 1.00 0.00 C ATOM 2116 O HIS A 131 -2.946 11.423 -10.081 1.00 0.00 O ATOM 2117 CB HIS A 131 -6.069 10.673 -10.254 1.00 0.00 C ATOM 2118 CG HIS A 131 -6.451 11.481 -9.039 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -6.493 11.068 -7.734 1.00 0.00 N flip ATOM 2120 CD2 HIS A 131 -6.884 12.787 -9.077 1.00 0.00 C flip ATOM 2121 CE1 HIS A 131 -6.962 12.139 -6.970 1.00 0.00 C flip ATOM 2122 NE2 HIS A 131 -7.179 13.155 -7.821 1.00 0.00 N flip ATOM 0 H HIS A 131 -5.979 8.336 -9.477 1.00 0.00 H new ATOM 0 HA HIS A 131 -4.375 9.802 -11.215 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.010 11.353 -11.104 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -6.880 9.975 -10.461 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -6.971 13.404 -9.959 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -7.120 12.148 -5.902 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -7.520 14.077 -7.550 1.00 0.00 H new ATOM 2130 N HIS A 132 -3.392 10.277 -8.199 1.00 0.00 N ATOM 2131 CA HIS A 132 -2.369 10.794 -7.295 1.00 0.00 C ATOM 2132 C HIS A 132 -2.272 12.314 -7.102 1.00 0.00 C ATOM 2133 O HIS A 132 -1.472 12.736 -6.259 1.00 0.00 O ATOM 2134 CB HIS A 132 -1.002 10.215 -7.679 1.00 0.00 C ATOM 2135 CG HIS A 132 -0.926 8.712 -7.718 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -0.271 7.974 -8.677 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -1.468 7.838 -6.813 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -0.454 6.677 -8.390 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -1.133 6.549 -7.239 1.00 0.00 N ATOM 0 H HIS A 132 -3.975 9.583 -7.731 1.00 0.00 H new ATOM 0 HA HIS A 132 -2.703 10.454 -6.315 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -0.725 10.602 -8.660 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -0.259 10.581 -6.971 1.00 0.00 H new ATOM 0 HD1 HIS A 132 0.259 8.347 -9.465 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -2.045 8.096 -5.937 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -0.106 5.854 -8.997 1.00 0.00 H new ATOM 2147 N VAL A 133 -3.093 13.128 -7.772 1.00 0.00 N ATOM 2148 CA VAL A 133 -3.076 14.587 -7.692 1.00 0.00 C ATOM 2149 C VAL A 133 -3.036 15.062 -6.237 1.00 0.00 C ATOM 2150 O VAL A 133 -2.138 15.819 -5.876 1.00 0.00 O ATOM 2151 CB VAL A 133 -4.234 15.189 -8.516 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -4.208 16.721 -8.531 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -4.198 14.707 -9.977 1.00 0.00 C ATOM 0 H VAL A 133 -3.811 12.775 -8.405 1.00 0.00 H new ATOM 0 HA VAL A 133 -2.157 14.960 -8.144 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.145 14.847 -8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.043 17.093 -9.124 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.291 17.096 -7.511 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.271 17.065 -8.969 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -5.028 15.151 -10.527 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.256 15.007 -10.436 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -4.285 13.621 -10.004 1.00 0.00 H new ATOM 2163 N HIS A 134 -3.948 14.575 -5.391 1.00 0.00 N ATOM 2164 CA HIS A 134 -4.023 14.933 -3.975 1.00 0.00 C ATOM 2165 C HIS A 134 -3.695 13.747 -3.053 1.00 0.00 C ATOM 2166 O HIS A 134 -4.154 13.692 -1.912 1.00 0.00 O ATOM 2167 CB HIS A 134 -5.340 15.661 -3.668 1.00 0.00 C ATOM 2168 CG HIS A 134 -6.597 14.955 -4.107 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -7.472 15.406 -5.057 1.00 0.00 N flip ATOM 2170 CD2 HIS A 134 -7.113 13.795 -3.575 1.00 0.00 C flip ATOM 2171 CE1 HIS A 134 -8.552 14.516 -5.094 1.00 0.00 C flip ATOM 2172 NE2 HIS A 134 -8.281 13.551 -4.192 1.00 0.00 N flip ATOM 0 H HIS A 134 -4.666 13.910 -5.677 1.00 0.00 H new ATOM 0 HA HIS A 134 -3.236 15.653 -3.751 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -5.398 15.830 -2.593 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -5.311 16.641 -4.144 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -6.661 13.191 -2.802 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -9.429 14.588 -5.721 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -8.880 12.747 -4.004 1.00 0.00 H new ATOM 2180 N ALA A 135 -3.006 12.728 -3.579 1.00 0.00 N ATOM 2181 CA ALA A 135 -2.609 11.566 -2.790 1.00 0.00 C ATOM 2182 C ALA A 135 -1.277 11.883 -2.107 1.00 0.00 C ATOM 2183 O ALA A 135 -0.563 12.809 -2.502 1.00 0.00 O ATOM 2184 CB ALA A 135 -2.463 10.336 -3.687 1.00 0.00 C ATOM 0 H ALA A 135 -2.712 12.689 -4.555 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.371 11.347 -2.042 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -2.167 9.478 -3.083 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -3.415 10.125 -4.174 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -1.703 10.526 -4.445 1.00 0.00 H new ATOM 2190 N GLU A 136 -0.893 11.075 -1.126 1.00 0.00 N ATOM 2191 CA GLU A 136 0.347 11.227 -0.367 1.00 0.00 C ATOM 2192 C GLU A 136 1.134 9.924 -0.331 1.00 0.00 C ATOM 2193 O GLU A 136 2.368 9.941 -0.263 1.00 0.00 O ATOM 2194 CB GLU A 136 0.099 11.617 1.100 1.00 0.00 C ATOM 2195 CG GLU A 136 -1.093 12.527 1.381 1.00 0.00 C ATOM 2196 CD GLU A 136 -1.026 12.965 2.840 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -1.534 12.216 3.709 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -0.346 13.972 3.147 1.00 0.00 O ATOM 0 H GLU A 136 -1.449 10.274 -0.827 1.00 0.00 H new ATOM 0 HA GLU A 136 0.898 12.016 -0.879 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -0.030 10.701 1.677 1.00 0.00 H new ATOM 0 HB3 GLU A 136 0.996 12.108 1.477 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -1.072 13.395 0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -2.027 12.001 1.185 1.00 0.00 H new ATOM 2205 N GLY A 137 0.429 8.794 -0.334 1.00 0.00 N ATOM 2206 CA GLY A 137 1.027 7.476 -0.280 1.00 0.00 C ATOM 2207 C GLY A 137 0.177 6.457 0.467 1.00 0.00 C ATOM 2208 O GLY A 137 0.745 5.423 0.817 1.00 0.00 O ATOM 0 H GLY A 137 -0.590 8.776 -0.375 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.198 7.121 -1.296 1.00 0.00 H new ATOM 0 HA3 GLY A 137 2.003 7.547 0.201 1.00 0.00 H new ATOM 2212 N LEU A 138 -1.102 6.744 0.772 1.00 0.00 N ATOM 2213 CA LEU A 138 -1.980 5.786 1.458 1.00 0.00 C ATOM 2214 C LEU A 138 -1.992 4.529 0.600 1.00 0.00 C ATOM 2215 O LEU A 138 -1.815 3.409 1.122 1.00 0.00 O ATOM 2216 CB LEU A 138 -3.423 6.319 1.610 1.00 0.00 C ATOM 2217 CG LEU A 138 -3.566 7.686 2.289 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -4.993 8.181 2.075 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -3.273 7.626 3.779 1.00 0.00 C ATOM 0 H LEU A 138 -1.548 7.634 0.552 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.608 5.601 2.466 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.873 6.379 0.619 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.000 5.590 2.179 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.839 8.365 1.844 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.116 9.154 2.551 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.190 8.272 1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.694 7.471 2.514 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.388 8.619 4.213 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.968 6.938 4.259 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.252 7.278 3.935 1.00 0.00 H new