USER MOD reduce.3.24.130724 H: found=0, std=0, add=863, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 864 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 66 LYS NZ :NH3+ 140:sc= -0.68 (180deg=-2.83!) USER MOD Set 1.2: A 135 CYS SG : rot -24:sc= -0.31 USER MOD Set 2.1: A 79 ASN : amide:sc= 0.243 X(o=0.038,f=0.37) USER MOD Set 2.2: A 93 ASN : amide:sc= -0.205 X(o=0.038,f=0.37) USER MOD Set 3.1: A 50 ASN : amide:sc= -0.0215 K(o=0.14,f=-0.9) USER MOD Set 3.2: A 53 GLN : amide:sc= 0.159 K(o=0.14,f=-1.4) USER MOD Set 4.1: A 42 THR OG1 : rot -72:sc= 0.796 USER MOD Set 4.2: A 43 CYS SG : rot 180:sc= 0 USER MOD Set 5.1: A 39 ASN : amide:sc= -0.372 X(o=-0.4,f=-0.38) USER MOD Set 5.2: A 54 TYR OH : rot 150:sc= -0.0303 USER MOD Set 6.1: A 36 TYR OH : rot 180:sc= -0.301 USER MOD Set 6.2: A 85 MET CE :methyl -140:sc= -0.664 (180deg=-3.37!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= -0.284 USER MOD Single : A 31 LYS NZ :NH3+ -170:sc=-0.00478 (180deg=-0.119) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc=-0.00602 X(o=-0.006,f=-0.006) USER MOD Single : A 60 THR OG1 : rot 83:sc= 1.21 USER MOD Single : A 61 MET CE :methyl -139:sc= -0.0582 (180deg=-0.406) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -38:sc= 0.113 USER MOD Single : A 69 MET CE :methyl 177:sc= -3.46! (180deg=-3.62!) USER MOD Single : A 88 CYS SG : rot 150:sc= -5.44! USER MOD Single : A 98 ASN :FLIP amide:sc= -0.424 F(o=-1.2,f=-0.42) USER MOD Single : A 99 ASN :FLIP amide:sc= -0.462 F(o=-1.6,f=-0.46) USER MOD Single : A 103 GLN :FLIP amide:sc= -0.043 F(o=-1,f=-0.043) USER MOD Single : A 109 SER OG : rot 140:sc= 0.49 USER MOD Single : A 110 LYS NZ :NH3+ 153:sc= 1.8 (180deg=1.19) USER MOD Single : A 113 HIS : no HD1:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 114 SER OG : rot 45:sc= 0.157 USER MOD Single : A 116 THR OG1 : rot 160:sc= -0.193 USER MOD Single : A 123 SER OG : rot -150:sc= -0.0124 USER MOD Single : A 126 LYS NZ :NH3+ 171:sc= 0.0319 (180deg=0.0231) USER MOD Single : A 128 CYS SG : rot 169:sc= -3.43 USER MOD ----------------------------------------------------------------- ATOM 130 N ALA A 27 6.668 -15.354 -13.233 1.00 0.00 N ATOM 131 CA ALA A 27 6.575 -16.611 -12.462 1.00 0.00 C ATOM 132 C ALA A 27 7.399 -17.781 -13.088 1.00 0.00 C ATOM 133 O ALA A 27 7.750 -18.733 -12.389 1.00 0.00 O ATOM 134 CB ALA A 27 5.082 -16.993 -12.337 1.00 0.00 C ATOM 0 HA ALA A 27 7.013 -16.441 -11.479 1.00 0.00 H new ATOM 0 HB1 ALA A 27 4.990 -17.920 -11.770 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.545 -16.197 -11.821 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.657 -17.132 -13.331 1.00 0.00 H new ATOM 140 N THR A 28 7.725 -17.677 -14.392 1.00 0.00 N ATOM 141 CA THR A 28 8.373 -18.753 -15.177 1.00 0.00 C ATOM 142 C THR A 28 9.906 -18.852 -14.896 1.00 0.00 C ATOM 143 O THR A 28 10.515 -17.899 -14.402 1.00 0.00 O ATOM 144 CB THR A 28 8.116 -18.493 -16.702 1.00 0.00 C ATOM 145 OG1 THR A 28 6.749 -18.112 -16.911 1.00 0.00 O ATOM 146 CG2 THR A 28 8.417 -19.704 -17.586 1.00 0.00 C ATOM 0 H THR A 28 7.545 -16.835 -14.938 1.00 0.00 H new ATOM 0 HA THR A 28 7.936 -19.705 -14.875 1.00 0.00 H new ATOM 0 HB THR A 28 8.800 -17.694 -16.989 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.597 -17.950 -17.865 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.217 -19.453 -18.628 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.464 -19.984 -17.475 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.784 -20.539 -17.286 1.00 0.00 H new ATOM 154 N SER A 29 10.508 -20.031 -15.196 1.00 0.00 N ATOM 155 CA SER A 29 11.968 -20.273 -15.058 1.00 0.00 C ATOM 156 C SER A 29 12.707 -19.884 -16.355 1.00 0.00 C ATOM 157 O SER A 29 12.181 -20.134 -17.446 1.00 0.00 O ATOM 158 CB SER A 29 12.239 -21.766 -14.742 1.00 0.00 C ATOM 159 OG SER A 29 13.618 -22.029 -14.505 1.00 0.00 O ATOM 0 H SER A 29 9.994 -20.842 -15.541 1.00 0.00 H new ATOM 0 HA SER A 29 12.337 -19.657 -14.238 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.660 -22.060 -13.866 1.00 0.00 H new ATOM 0 HB3 SER A 29 11.893 -22.379 -15.574 1.00 0.00 H new ATOM 0 HG SER A 29 13.740 -22.981 -14.309 1.00 0.00 H new ATOM 165 N PRO A 30 13.968 -19.335 -16.257 1.00 0.00 N ATOM 166 CA PRO A 30 14.792 -18.943 -17.439 1.00 0.00 C ATOM 167 C PRO A 30 15.143 -20.132 -18.361 1.00 0.00 C ATOM 168 O PRO A 30 15.485 -19.923 -19.521 1.00 0.00 O ATOM 169 CB PRO A 30 16.087 -18.369 -16.795 1.00 0.00 C ATOM 170 CG PRO A 30 16.132 -19.034 -15.463 1.00 0.00 C ATOM 171 CD PRO A 30 14.707 -19.060 -14.994 1.00 0.00 C ATOM 0 HA PRO A 30 14.257 -18.243 -18.081 1.00 0.00 H new ATOM 0 HB2 PRO A 30 16.970 -18.602 -17.391 1.00 0.00 H new ATOM 0 HB3 PRO A 30 16.043 -17.284 -16.701 1.00 0.00 H new ATOM 0 HG2 PRO A 30 16.541 -20.041 -15.538 1.00 0.00 H new ATOM 0 HG3 PRO A 30 16.766 -18.484 -14.768 1.00 0.00 H new ATOM 0 HD2 PRO A 30 14.538 -19.835 -14.246 1.00 0.00 H new ATOM 0 HD3 PRO A 30 14.408 -18.113 -14.545 1.00 0.00 H new ATOM 179 N LYS A 31 15.081 -21.366 -17.814 1.00 0.00 N ATOM 180 CA LYS A 31 15.422 -22.590 -18.561 1.00 0.00 C ATOM 181 C LYS A 31 14.327 -22.889 -19.595 1.00 0.00 C ATOM 182 O LYS A 31 14.627 -23.086 -20.765 1.00 0.00 O ATOM 183 CB LYS A 31 15.629 -23.790 -17.582 1.00 0.00 C ATOM 184 CG LYS A 31 16.541 -24.943 -18.111 1.00 0.00 C ATOM 185 CD LYS A 31 15.917 -25.821 -19.237 1.00 0.00 C ATOM 186 CE LYS A 31 14.682 -26.616 -18.770 1.00 0.00 C ATOM 187 NZ LYS A 31 15.005 -27.528 -17.649 1.00 0.00 N ATOM 0 H LYS A 31 14.795 -21.538 -16.850 1.00 0.00 H new ATOM 0 HA LYS A 31 16.361 -22.437 -19.093 1.00 0.00 H new ATOM 0 HB2 LYS A 31 16.056 -23.409 -16.654 1.00 0.00 H new ATOM 0 HB3 LYS A 31 14.653 -24.207 -17.335 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.469 -24.509 -18.483 1.00 0.00 H new ATOM 0 HG3 LYS A 31 16.805 -25.589 -17.273 1.00 0.00 H new ATOM 0 HD2 LYS A 31 15.635 -25.182 -20.074 1.00 0.00 H new ATOM 0 HD3 LYS A 31 16.671 -26.516 -19.607 1.00 0.00 H new ATOM 0 HE2 LYS A 31 13.900 -25.923 -18.461 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.285 -27.193 -19.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 14.200 -28.163 -17.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 15.845 -28.091 -17.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.197 -26.971 -16.792 1.00 0.00 H new ATOM 201 N THR A 32 13.062 -22.932 -19.144 1.00 0.00 N ATOM 202 CA THR A 32 11.906 -23.196 -20.029 1.00 0.00 C ATOM 203 C THR A 32 11.579 -21.966 -20.914 1.00 0.00 C ATOM 204 O THR A 32 10.944 -22.115 -21.971 1.00 0.00 O ATOM 205 CB THR A 32 10.645 -23.670 -19.231 1.00 0.00 C ATOM 206 OG1 THR A 32 9.573 -24.023 -20.129 1.00 0.00 O ATOM 207 CG2 THR A 32 10.158 -22.609 -18.243 1.00 0.00 C ATOM 0 H THR A 32 12.809 -22.787 -18.167 1.00 0.00 H new ATOM 0 HA THR A 32 12.194 -24.016 -20.687 1.00 0.00 H new ATOM 0 HB THR A 32 10.945 -24.550 -18.662 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.795 -24.318 -19.610 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.282 -22.981 -17.712 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.950 -22.388 -17.527 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.895 -21.701 -18.785 1.00 0.00 H new ATOM 215 N ILE A 33 12.023 -20.760 -20.477 1.00 0.00 N ATOM 216 CA ILE A 33 12.040 -19.561 -21.337 1.00 0.00 C ATOM 217 C ILE A 33 13.008 -19.801 -22.500 1.00 0.00 C ATOM 218 O ILE A 33 12.652 -19.616 -23.666 1.00 0.00 O ATOM 219 CB ILE A 33 12.440 -18.254 -20.539 1.00 0.00 C ATOM 220 CG1 ILE A 33 11.329 -17.887 -19.504 1.00 0.00 C ATOM 221 CG2 ILE A 33 12.749 -17.048 -21.478 1.00 0.00 C ATOM 222 CD1 ILE A 33 9.967 -17.545 -20.103 1.00 0.00 C ATOM 0 H ILE A 33 12.373 -20.598 -19.533 1.00 0.00 H new ATOM 0 HA ILE A 33 11.031 -19.395 -21.716 1.00 0.00 H new ATOM 0 HB ILE A 33 13.364 -18.474 -20.004 1.00 0.00 H new ATOM 0 HG12 ILE A 33 11.205 -18.724 -18.816 1.00 0.00 H new ATOM 0 HG13 ILE A 33 11.672 -17.037 -18.914 1.00 0.00 H new ATOM 0 HG21 ILE A 33 13.017 -16.179 -20.878 1.00 0.00 H new ATOM 0 HG22 ILE A 33 13.578 -17.304 -22.138 1.00 0.00 H new ATOM 0 HG23 ILE A 33 11.867 -16.817 -22.076 1.00 0.00 H new ATOM 0 HD11 ILE A 33 9.267 -17.305 -19.302 1.00 0.00 H new ATOM 0 HD12 ILE A 33 10.067 -16.686 -20.767 1.00 0.00 H new ATOM 0 HD13 ILE A 33 9.593 -18.399 -20.668 1.00 0.00 H new ATOM 234 N LEU A 34 14.212 -20.275 -22.151 1.00 0.00 N ATOM 235 CA LEU A 34 15.246 -20.664 -23.115 1.00 0.00 C ATOM 236 C LEU A 34 14.706 -21.753 -24.060 1.00 0.00 C ATOM 237 O LEU A 34 14.949 -21.684 -25.252 1.00 0.00 O ATOM 238 CB LEU A 34 16.532 -21.105 -22.348 1.00 0.00 C ATOM 239 CG LEU A 34 17.746 -21.631 -23.200 1.00 0.00 C ATOM 240 CD1 LEU A 34 19.101 -21.284 -22.535 1.00 0.00 C ATOM 241 CD2 LEU A 34 17.647 -23.157 -23.439 1.00 0.00 C ATOM 0 H LEU A 34 14.497 -20.400 -21.180 1.00 0.00 H new ATOM 0 HA LEU A 34 15.518 -19.815 -23.742 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.879 -20.256 -21.758 1.00 0.00 H new ATOM 0 HB3 LEU A 34 16.251 -21.889 -21.644 1.00 0.00 H new ATOM 0 HG LEU A 34 17.699 -21.126 -24.165 1.00 0.00 H new ATOM 0 HD11 LEU A 34 19.916 -21.663 -23.151 1.00 0.00 H new ATOM 0 HD12 LEU A 34 19.192 -20.202 -22.438 1.00 0.00 H new ATOM 0 HD13 LEU A 34 19.150 -21.743 -21.547 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.500 -23.489 -24.030 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.646 -23.676 -22.481 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.725 -23.382 -23.975 1.00 0.00 H new ATOM 253 N GLU A 35 13.930 -22.720 -23.510 1.00 0.00 N ATOM 254 CA GLU A 35 13.349 -23.828 -24.293 1.00 0.00 C ATOM 255 C GLU A 35 12.416 -23.308 -25.392 1.00 0.00 C ATOM 256 O GLU A 35 12.592 -23.677 -26.548 1.00 0.00 O ATOM 257 CB GLU A 35 12.595 -24.849 -23.397 1.00 0.00 C ATOM 258 CG GLU A 35 13.487 -25.624 -22.404 1.00 0.00 C ATOM 259 CD GLU A 35 14.617 -26.411 -23.088 1.00 0.00 C ATOM 260 OE1 GLU A 35 14.356 -27.525 -23.595 1.00 0.00 O ATOM 261 OE2 GLU A 35 15.762 -25.919 -23.138 1.00 0.00 O ATOM 0 H GLU A 35 13.693 -22.750 -22.518 1.00 0.00 H new ATOM 0 HA GLU A 35 14.187 -24.346 -24.760 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.826 -24.319 -22.835 1.00 0.00 H new ATOM 0 HB3 GLU A 35 12.083 -25.566 -24.039 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.922 -24.922 -21.693 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.867 -26.315 -21.832 1.00 0.00 H new ATOM 268 N TYR A 36 11.442 -22.423 -25.029 1.00 0.00 N ATOM 269 CA TYR A 36 10.451 -21.903 -26.014 1.00 0.00 C ATOM 270 C TYR A 36 11.150 -21.004 -27.064 1.00 0.00 C ATOM 271 O TYR A 36 10.697 -20.914 -28.212 1.00 0.00 O ATOM 272 CB TYR A 36 9.224 -21.193 -25.323 1.00 0.00 C ATOM 273 CG TYR A 36 9.288 -19.654 -25.120 1.00 0.00 C ATOM 274 CD1 TYR A 36 8.987 -18.769 -26.167 1.00 0.00 C ATOM 275 CD2 TYR A 36 9.629 -19.093 -23.897 1.00 0.00 C ATOM 276 CE1 TYR A 36 9.035 -17.407 -25.993 1.00 0.00 C ATOM 277 CE2 TYR A 36 9.676 -17.720 -23.720 1.00 0.00 C ATOM 278 CZ TYR A 36 9.382 -16.885 -24.769 1.00 0.00 C ATOM 279 OH TYR A 36 9.426 -15.519 -24.595 1.00 0.00 O ATOM 0 H TYR A 36 11.324 -22.062 -24.082 1.00 0.00 H new ATOM 0 HA TYR A 36 10.027 -22.758 -26.542 1.00 0.00 H new ATOM 0 HB2 TYR A 36 8.335 -21.415 -25.913 1.00 0.00 H new ATOM 0 HB3 TYR A 36 9.080 -21.653 -24.345 1.00 0.00 H new ATOM 0 HD1 TYR A 36 8.711 -19.168 -27.132 1.00 0.00 H new ATOM 0 HD2 TYR A 36 9.863 -19.741 -23.065 1.00 0.00 H new ATOM 0 HE1 TYR A 36 8.801 -16.748 -26.816 1.00 0.00 H new ATOM 0 HE2 TYR A 36 9.943 -17.307 -22.758 1.00 0.00 H new ATOM 0 HH TYR A 36 9.687 -15.315 -23.673 1.00 0.00 H new ATOM 289 N ILE A 37 12.248 -20.344 -26.636 1.00 0.00 N ATOM 290 CA ILE A 37 13.148 -19.590 -27.527 1.00 0.00 C ATOM 291 C ILE A 37 13.726 -20.530 -28.620 1.00 0.00 C ATOM 292 O ILE A 37 13.573 -20.261 -29.818 1.00 0.00 O ATOM 293 CB ILE A 37 14.302 -18.888 -26.687 1.00 0.00 C ATOM 294 CG1 ILE A 37 13.739 -17.677 -25.863 1.00 0.00 C ATOM 295 CG2 ILE A 37 15.504 -18.449 -27.553 1.00 0.00 C ATOM 296 CD1 ILE A 37 14.757 -16.986 -24.959 1.00 0.00 C ATOM 0 H ILE A 37 12.534 -20.321 -25.657 1.00 0.00 H new ATOM 0 HA ILE A 37 12.581 -18.804 -28.026 1.00 0.00 H new ATOM 0 HB ILE A 37 14.678 -19.642 -25.996 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.333 -16.941 -26.557 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.909 -18.028 -25.249 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.256 -17.977 -26.920 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.937 -19.321 -28.043 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.168 -17.738 -28.308 1.00 0.00 H new ATOM 0 HD11 ILE A 37 14.275 -16.163 -24.431 1.00 0.00 H new ATOM 0 HD12 ILE A 37 15.147 -17.702 -24.236 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.577 -16.599 -25.564 1.00 0.00 H new ATOM 308 N ILE A 38 14.326 -21.661 -28.182 1.00 0.00 N ATOM 309 CA ILE A 38 14.935 -22.666 -29.091 1.00 0.00 C ATOM 310 C ILE A 38 13.856 -23.255 -30.025 1.00 0.00 C ATOM 311 O ILE A 38 14.089 -23.417 -31.226 1.00 0.00 O ATOM 312 CB ILE A 38 15.643 -23.845 -28.296 1.00 0.00 C ATOM 313 CG1 ILE A 38 16.679 -23.301 -27.254 1.00 0.00 C ATOM 314 CG2 ILE A 38 16.318 -24.861 -29.259 1.00 0.00 C ATOM 315 CD1 ILE A 38 17.842 -22.508 -27.819 1.00 0.00 C ATOM 0 H ILE A 38 14.403 -21.904 -27.194 1.00 0.00 H new ATOM 0 HA ILE A 38 15.698 -22.151 -29.675 1.00 0.00 H new ATOM 0 HB ILE A 38 14.860 -24.370 -27.748 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.149 -22.670 -26.540 1.00 0.00 H new ATOM 0 HG13 ILE A 38 17.080 -24.147 -26.696 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.792 -25.653 -28.679 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.565 -25.294 -29.917 1.00 0.00 H new ATOM 0 HG23 ILE A 38 17.072 -24.349 -29.858 1.00 0.00 H new ATOM 0 HD11 ILE A 38 18.491 -22.184 -27.005 1.00 0.00 H new ATOM 0 HD12 ILE A 38 18.409 -23.134 -28.508 1.00 0.00 H new ATOM 0 HD13 ILE A 38 17.463 -21.635 -28.350 1.00 0.00 H new ATOM 327 N ASN A 39 12.666 -23.524 -29.442 1.00 0.00 N ATOM 328 CA ASN A 39 11.507 -24.099 -30.156 1.00 0.00 C ATOM 329 C ASN A 39 11.029 -23.158 -31.269 1.00 0.00 C ATOM 330 O ASN A 39 10.598 -23.619 -32.310 1.00 0.00 O ATOM 331 CB ASN A 39 10.317 -24.384 -29.193 1.00 0.00 C ATOM 332 CG ASN A 39 10.603 -25.411 -28.092 1.00 0.00 C ATOM 333 OD1 ASN A 39 11.434 -26.304 -28.248 1.00 0.00 O ATOM 334 ND2 ASN A 39 9.893 -25.301 -26.974 1.00 0.00 N ATOM 0 H ASN A 39 12.483 -23.346 -28.454 1.00 0.00 H new ATOM 0 HA ASN A 39 11.842 -25.042 -30.588 1.00 0.00 H new ATOM 0 HB2 ASN A 39 10.016 -23.447 -28.725 1.00 0.00 H new ATOM 0 HB3 ASN A 39 9.469 -24.733 -29.782 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.030 -25.969 -26.215 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.211 -24.549 -26.875 1.00 0.00 H new ATOM 341 N PHE A 40 11.101 -21.841 -31.011 1.00 0.00 N ATOM 342 CA PHE A 40 10.712 -20.810 -31.990 1.00 0.00 C ATOM 343 C PHE A 40 11.727 -20.721 -33.152 1.00 0.00 C ATOM 344 O PHE A 40 11.336 -20.560 -34.318 1.00 0.00 O ATOM 345 CB PHE A 40 10.552 -19.431 -31.289 1.00 0.00 C ATOM 346 CG PHE A 40 10.301 -18.267 -32.255 1.00 0.00 C ATOM 347 CD1 PHE A 40 9.247 -18.317 -33.174 1.00 0.00 C ATOM 348 CD2 PHE A 40 11.137 -17.156 -32.270 1.00 0.00 C ATOM 349 CE1 PHE A 40 9.048 -17.293 -34.076 1.00 0.00 C ATOM 350 CE2 PHE A 40 10.928 -16.132 -33.161 1.00 0.00 C ATOM 351 CZ PHE A 40 9.890 -16.199 -34.070 1.00 0.00 C ATOM 0 H PHE A 40 11.429 -21.462 -30.123 1.00 0.00 H new ATOM 0 HA PHE A 40 9.751 -21.098 -32.417 1.00 0.00 H new ATOM 0 HB2 PHE A 40 9.724 -19.488 -30.582 1.00 0.00 H new ATOM 0 HB3 PHE A 40 11.452 -19.222 -30.710 1.00 0.00 H new ATOM 0 HD1 PHE A 40 8.581 -19.168 -33.177 1.00 0.00 H new ATOM 0 HD2 PHE A 40 11.960 -17.098 -31.573 1.00 0.00 H new ATOM 0 HE1 PHE A 40 8.235 -17.347 -34.785 1.00 0.00 H new ATOM 0 HE2 PHE A 40 11.579 -15.270 -33.151 1.00 0.00 H new ATOM 0 HZ PHE A 40 9.737 -15.396 -34.776 1.00 0.00 H new ATOM 361 N PHE A 41 13.024 -20.795 -32.823 1.00 0.00 N ATOM 362 CA PHE A 41 14.094 -20.706 -33.833 1.00 0.00 C ATOM 363 C PHE A 41 14.164 -21.974 -34.716 1.00 0.00 C ATOM 364 O PHE A 41 14.560 -21.888 -35.884 1.00 0.00 O ATOM 365 CB PHE A 41 15.459 -20.390 -33.167 1.00 0.00 C ATOM 366 CG PHE A 41 15.573 -18.941 -32.666 1.00 0.00 C ATOM 367 CD1 PHE A 41 15.627 -17.883 -33.570 1.00 0.00 C ATOM 368 CD2 PHE A 41 15.634 -18.636 -31.312 1.00 0.00 C ATOM 369 CE1 PHE A 41 15.739 -16.575 -33.137 1.00 0.00 C ATOM 370 CE2 PHE A 41 15.745 -17.326 -30.883 1.00 0.00 C ATOM 371 CZ PHE A 41 15.795 -16.297 -31.793 1.00 0.00 C ATOM 0 H PHE A 41 13.360 -20.916 -31.868 1.00 0.00 H new ATOM 0 HA PHE A 41 13.850 -19.878 -34.498 1.00 0.00 H new ATOM 0 HB2 PHE A 41 15.612 -21.070 -32.329 1.00 0.00 H new ATOM 0 HB3 PHE A 41 16.258 -20.583 -33.883 1.00 0.00 H new ATOM 0 HD1 PHE A 41 15.580 -18.088 -34.629 1.00 0.00 H new ATOM 0 HD2 PHE A 41 15.594 -19.433 -30.584 1.00 0.00 H new ATOM 0 HE1 PHE A 41 15.783 -15.771 -33.856 1.00 0.00 H new ATOM 0 HE2 PHE A 41 15.793 -17.110 -29.826 1.00 0.00 H new ATOM 0 HZ PHE A 41 15.878 -15.275 -31.453 1.00 0.00 H new ATOM 381 N THR A 42 13.765 -23.139 -34.171 1.00 0.00 N ATOM 382 CA THR A 42 13.755 -24.410 -34.928 1.00 0.00 C ATOM 383 C THR A 42 12.361 -24.650 -35.563 1.00 0.00 C ATOM 384 O THR A 42 12.215 -24.596 -36.789 1.00 0.00 O ATOM 385 CB THR A 42 14.182 -25.616 -34.015 1.00 0.00 C ATOM 386 OG1 THR A 42 13.324 -25.695 -32.859 1.00 0.00 O ATOM 387 CG2 THR A 42 15.653 -25.496 -33.554 1.00 0.00 C ATOM 0 H THR A 42 13.444 -23.228 -33.207 1.00 0.00 H new ATOM 0 HA THR A 42 14.486 -24.336 -35.733 1.00 0.00 H new ATOM 0 HB THR A 42 14.085 -26.523 -34.611 1.00 0.00 H new ATOM 0 HG1 THR A 42 13.535 -24.962 -32.244 1.00 0.00 H new ATOM 0 HG21 THR A 42 15.908 -26.349 -32.925 1.00 0.00 H new ATOM 0 HG22 THR A 42 16.307 -25.479 -34.426 1.00 0.00 H new ATOM 0 HG23 THR A 42 15.782 -24.575 -32.986 1.00 0.00 H new ATOM 395 N CYS A 43 11.344 -24.882 -34.715 1.00 0.00 N ATOM 396 CA CYS A 43 9.940 -25.126 -35.131 1.00 0.00 C ATOM 397 C CYS A 43 9.126 -23.810 -35.028 1.00 0.00 C ATOM 398 O CYS A 43 9.712 -22.733 -34.910 1.00 0.00 O ATOM 399 CB CYS A 43 9.342 -26.234 -34.229 1.00 0.00 C ATOM 400 SG CYS A 43 10.288 -27.774 -34.240 1.00 0.00 S ATOM 0 H CYS A 43 11.470 -24.907 -33.703 1.00 0.00 H new ATOM 0 HA CYS A 43 9.901 -25.458 -36.168 1.00 0.00 H new ATOM 0 HB2 CYS A 43 9.281 -25.863 -33.206 1.00 0.00 H new ATOM 0 HB3 CYS A 43 8.322 -26.443 -34.553 1.00 0.00 H new ATOM 0 HG CYS A 43 9.716 -28.640 -33.457 1.00 0.00 H new ATOM 406 N GLY A 44 7.782 -23.890 -35.109 1.00 0.00 N ATOM 407 CA GLY A 44 6.933 -22.710 -34.892 1.00 0.00 C ATOM 408 C GLY A 44 5.506 -22.893 -35.389 1.00 0.00 C ATOM 409 O GLY A 44 5.168 -23.931 -35.977 1.00 0.00 O ATOM 0 H GLY A 44 7.271 -24.747 -35.320 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.912 -22.477 -33.827 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.379 -21.853 -35.397 1.00 0.00 H new ATOM 413 N GLY A 45 4.675 -21.861 -35.147 1.00 0.00 N ATOM 414 CA GLY A 45 3.282 -21.839 -35.610 1.00 0.00 C ATOM 415 C GLY A 45 2.331 -22.639 -34.735 1.00 0.00 C ATOM 416 O GLY A 45 1.376 -23.247 -35.244 1.00 0.00 O ATOM 0 H GLY A 45 4.951 -21.027 -34.629 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.939 -20.805 -35.652 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.241 -22.230 -36.627 1.00 0.00 H new ATOM 420 N ILE A 46 2.592 -22.648 -33.409 1.00 0.00 N ATOM 421 CA ILE A 46 1.701 -23.296 -32.433 1.00 0.00 C ATOM 422 C ILE A 46 0.516 -22.348 -32.164 1.00 0.00 C ATOM 423 O ILE A 46 0.608 -21.431 -31.329 1.00 0.00 O ATOM 424 CB ILE A 46 2.403 -23.689 -31.065 1.00 0.00 C ATOM 425 CG1 ILE A 46 3.736 -24.511 -31.274 1.00 0.00 C ATOM 426 CG2 ILE A 46 1.403 -24.475 -30.165 1.00 0.00 C ATOM 427 CD1 ILE A 46 4.986 -23.670 -31.525 1.00 0.00 C ATOM 0 H ILE A 46 3.415 -22.212 -32.994 1.00 0.00 H new ATOM 0 HA ILE A 46 1.375 -24.240 -32.869 1.00 0.00 H new ATOM 0 HB ILE A 46 2.690 -22.762 -30.568 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.905 -25.129 -30.392 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.598 -25.188 -32.117 1.00 0.00 H new ATOM 0 HG21 ILE A 46 1.890 -24.742 -29.227 1.00 0.00 H new ATOM 0 HG22 ILE A 46 0.533 -23.852 -29.957 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.085 -25.382 -30.680 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.846 -24.327 -31.656 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.847 -23.071 -32.425 1.00 0.00 H new ATOM 0 HD13 ILE A 46 5.158 -23.011 -30.674 1.00 0.00 H new ATOM 439 N ARG A 47 -0.582 -22.572 -32.905 1.00 0.00 N ATOM 440 CA ARG A 47 -1.779 -21.702 -32.885 1.00 0.00 C ATOM 441 C ARG A 47 -2.723 -22.026 -31.700 1.00 0.00 C ATOM 442 O ARG A 47 -3.819 -21.464 -31.614 1.00 0.00 O ATOM 443 CB ARG A 47 -2.554 -21.790 -34.245 1.00 0.00 C ATOM 444 CG ARG A 47 -3.386 -23.089 -34.492 1.00 0.00 C ATOM 445 CD ARG A 47 -2.554 -24.319 -34.904 1.00 0.00 C ATOM 446 NE ARG A 47 -1.964 -24.182 -36.249 1.00 0.00 N ATOM 447 CZ ARG A 47 -1.098 -25.048 -36.798 1.00 0.00 C ATOM 448 NH1 ARG A 47 -0.611 -26.071 -36.108 1.00 0.00 N ATOM 449 NH2 ARG A 47 -0.708 -24.882 -38.038 1.00 0.00 N ATOM 0 H ARG A 47 -0.669 -23.366 -33.540 1.00 0.00 H new ATOM 0 HA ARG A 47 -1.426 -20.680 -32.746 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.228 -20.936 -34.309 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.833 -21.688 -35.056 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -3.938 -23.329 -33.583 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.123 -22.889 -35.269 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -1.757 -24.474 -34.176 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.187 -25.206 -34.878 1.00 0.00 H new ATOM 0 HE ARG A 47 -2.234 -23.369 -36.803 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -0.894 -26.213 -35.138 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.046 -26.716 -36.547 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.062 -24.096 -38.583 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.050 -25.539 -38.458 1.00 0.00 H new ATOM 463 N ARG A 48 -2.288 -22.911 -30.778 1.00 0.00 N ATOM 464 CA ARG A 48 -3.133 -23.389 -29.670 1.00 0.00 C ATOM 465 C ARG A 48 -3.105 -22.410 -28.473 1.00 0.00 C ATOM 466 O ARG A 48 -3.986 -21.558 -28.361 1.00 0.00 O ATOM 467 CB ARG A 48 -2.699 -24.823 -29.254 1.00 0.00 C ATOM 468 CG ARG A 48 -2.867 -25.897 -30.351 1.00 0.00 C ATOM 469 CD ARG A 48 -4.313 -25.975 -30.869 1.00 0.00 C ATOM 470 NE ARG A 48 -4.509 -27.103 -31.790 1.00 0.00 N ATOM 471 CZ ARG A 48 -5.692 -27.525 -32.257 1.00 0.00 C ATOM 472 NH1 ARG A 48 -6.821 -26.907 -31.929 1.00 0.00 N ATOM 473 NH2 ARG A 48 -5.735 -28.580 -33.047 1.00 0.00 N ATOM 0 H ARG A 48 -1.349 -23.310 -30.782 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.167 -23.431 -30.013 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -1.653 -24.796 -28.949 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.278 -25.123 -28.380 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.197 -25.674 -31.181 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -2.572 -26.868 -29.955 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.995 -26.074 -30.025 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.567 -25.044 -31.377 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.677 -27.606 -32.099 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.797 -26.096 -31.311 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.712 -27.244 -32.295 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -4.873 -29.066 -33.297 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.630 -28.910 -33.408 1.00 0.00 H new ATOM 487 N ARG A 49 -2.080 -22.515 -27.597 1.00 0.00 N ATOM 488 CA ARG A 49 -1.956 -21.667 -26.377 1.00 0.00 C ATOM 489 C ARG A 49 -0.662 -20.846 -26.434 1.00 0.00 C ATOM 490 O ARG A 49 -0.632 -19.701 -25.983 1.00 0.00 O ATOM 491 CB ARG A 49 -1.967 -22.508 -25.054 1.00 0.00 C ATOM 492 CG ARG A 49 -3.231 -23.376 -24.780 1.00 0.00 C ATOM 493 CD ARG A 49 -3.233 -24.713 -25.541 1.00 0.00 C ATOM 494 NE ARG A 49 -4.366 -25.576 -25.158 1.00 0.00 N ATOM 495 CZ ARG A 49 -4.298 -26.898 -24.906 1.00 0.00 C ATOM 496 NH1 ARG A 49 -3.153 -27.559 -25.033 1.00 0.00 N ATOM 497 NH2 ARG A 49 -5.389 -27.557 -24.532 1.00 0.00 N ATOM 0 H ARG A 49 -1.318 -23.183 -27.709 1.00 0.00 H new ATOM 0 HA ARG A 49 -2.825 -21.010 -26.364 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.099 -23.167 -25.064 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -1.838 -21.823 -24.216 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.300 -23.575 -23.711 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -4.119 -22.808 -25.057 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.274 -24.518 -26.613 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -2.298 -25.239 -25.349 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.281 -25.133 -25.077 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.309 -27.066 -25.325 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.118 -28.560 -24.839 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -6.276 -27.062 -24.436 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -5.340 -28.558 -24.341 1.00 0.00 H new ATOM 511 N ASN A 50 0.401 -21.437 -27.041 1.00 0.00 N ATOM 512 CA ASN A 50 1.767 -20.849 -27.088 1.00 0.00 C ATOM 513 C ASN A 50 1.854 -19.526 -27.880 1.00 0.00 C ATOM 514 O ASN A 50 2.932 -18.932 -27.933 1.00 0.00 O ATOM 515 CB ASN A 50 2.780 -21.864 -27.691 1.00 0.00 C ATOM 516 CG ASN A 50 3.163 -23.010 -26.748 1.00 0.00 C ATOM 517 OD1 ASN A 50 2.597 -24.098 -26.790 1.00 0.00 O ATOM 518 ND2 ASN A 50 4.129 -22.766 -25.889 1.00 0.00 N ATOM 0 H ASN A 50 0.334 -22.338 -27.514 1.00 0.00 H new ATOM 0 HA ASN A 50 2.018 -20.621 -26.052 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.355 -22.286 -28.602 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.685 -21.329 -27.979 1.00 0.00 H new ATOM 0 HD21 ASN A 50 4.425 -23.491 -25.235 1.00 0.00 H new ATOM 0 HD22 ASN A 50 4.582 -21.852 -25.877 1.00 0.00 H new ATOM 525 N GLU A 51 0.735 -19.082 -28.488 1.00 0.00 N ATOM 526 CA GLU A 51 0.683 -17.844 -29.287 1.00 0.00 C ATOM 527 C GLU A 51 1.227 -16.632 -28.506 1.00 0.00 C ATOM 528 O GLU A 51 2.145 -15.977 -28.975 1.00 0.00 O ATOM 529 CB GLU A 51 -0.759 -17.557 -29.766 1.00 0.00 C ATOM 530 CG GLU A 51 -1.371 -18.665 -30.644 1.00 0.00 C ATOM 531 CD GLU A 51 -2.671 -18.223 -31.326 1.00 0.00 C ATOM 532 OE1 GLU A 51 -2.591 -17.515 -32.353 1.00 0.00 O ATOM 533 OE2 GLU A 51 -3.770 -18.548 -30.833 1.00 0.00 O ATOM 0 H GLU A 51 -0.158 -19.573 -28.438 1.00 0.00 H new ATOM 0 HA GLU A 51 1.323 -18.000 -30.156 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.396 -17.408 -28.894 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.763 -16.622 -30.327 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -0.649 -18.962 -31.404 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.567 -19.544 -30.030 1.00 0.00 H new ATOM 540 N THR A 52 0.671 -16.390 -27.301 1.00 0.00 N ATOM 541 CA THR A 52 1.020 -15.219 -26.463 1.00 0.00 C ATOM 542 C THR A 52 2.433 -15.362 -25.838 1.00 0.00 C ATOM 543 O THR A 52 3.203 -14.377 -25.785 1.00 0.00 O ATOM 544 CB THR A 52 -0.054 -15.007 -25.339 1.00 0.00 C ATOM 545 OG1 THR A 52 -1.372 -15.079 -25.914 1.00 0.00 O ATOM 546 CG2 THR A 52 0.118 -13.645 -24.625 1.00 0.00 C ATOM 0 H THR A 52 -0.031 -16.998 -26.880 1.00 0.00 H new ATOM 0 HA THR A 52 1.031 -14.343 -27.112 1.00 0.00 H new ATOM 0 HB THR A 52 0.082 -15.794 -24.598 1.00 0.00 H new ATOM 0 HG1 THR A 52 -2.043 -14.948 -25.212 1.00 0.00 H new ATOM 0 HG21 THR A 52 -0.646 -13.539 -23.855 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.106 -13.597 -24.166 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.015 -12.838 -25.351 1.00 0.00 H new ATOM 554 N GLN A 53 2.766 -16.606 -25.404 1.00 0.00 N ATOM 555 CA GLN A 53 4.082 -16.945 -24.795 1.00 0.00 C ATOM 556 C GLN A 53 5.225 -16.590 -25.748 1.00 0.00 C ATOM 557 O GLN A 53 6.207 -15.946 -25.361 1.00 0.00 O ATOM 558 CB GLN A 53 4.149 -18.469 -24.462 1.00 0.00 C ATOM 559 CG GLN A 53 5.481 -18.941 -23.826 1.00 0.00 C ATOM 560 CD GLN A 53 5.529 -20.453 -23.560 1.00 0.00 C ATOM 561 OE1 GLN A 53 5.973 -21.232 -24.401 1.00 0.00 O ATOM 562 NE2 GLN A 53 5.055 -20.877 -22.396 1.00 0.00 N ATOM 0 H GLN A 53 2.131 -17.402 -25.466 1.00 0.00 H new ATOM 0 HA GLN A 53 4.187 -16.366 -23.877 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.332 -18.714 -23.783 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.981 -19.034 -25.379 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.306 -18.669 -24.485 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.635 -18.409 -22.887 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.693 -20.206 -21.718 1.00 0.00 H new ATOM 0 HE22 GLN A 53 5.052 -21.874 -22.179 1.00 0.00 H new ATOM 571 N TYR A 54 5.041 -16.991 -27.011 1.00 0.00 N ATOM 572 CA TYR A 54 5.994 -16.717 -28.080 1.00 0.00 C ATOM 573 C TYR A 54 5.886 -15.251 -28.505 1.00 0.00 C ATOM 574 O TYR A 54 6.904 -14.624 -28.721 1.00 0.00 O ATOM 575 CB TYR A 54 5.769 -17.676 -29.289 1.00 0.00 C ATOM 576 CG TYR A 54 6.263 -19.124 -29.066 1.00 0.00 C ATOM 577 CD1 TYR A 54 5.954 -19.827 -27.898 1.00 0.00 C ATOM 578 CD2 TYR A 54 7.031 -19.791 -30.029 1.00 0.00 C ATOM 579 CE1 TYR A 54 6.386 -21.118 -27.704 1.00 0.00 C ATOM 580 CE2 TYR A 54 7.466 -21.088 -29.830 1.00 0.00 C ATOM 581 CZ TYR A 54 7.138 -21.743 -28.669 1.00 0.00 C ATOM 582 OH TYR A 54 7.555 -23.035 -28.471 1.00 0.00 O ATOM 0 H TYR A 54 4.222 -17.517 -27.316 1.00 0.00 H new ATOM 0 HA TYR A 54 7.003 -16.897 -27.708 1.00 0.00 H new ATOM 0 HB2 TYR A 54 4.704 -17.702 -29.522 1.00 0.00 H new ATOM 0 HB3 TYR A 54 6.276 -17.264 -30.161 1.00 0.00 H new ATOM 0 HD1 TYR A 54 5.364 -19.346 -27.132 1.00 0.00 H new ATOM 0 HD2 TYR A 54 7.289 -19.282 -30.946 1.00 0.00 H new ATOM 0 HE1 TYR A 54 6.134 -21.641 -26.793 1.00 0.00 H new ATOM 0 HE2 TYR A 54 8.060 -21.583 -30.584 1.00 0.00 H new ATOM 0 HH TYR A 54 7.633 -23.490 -29.336 1.00 0.00 H new ATOM 592 N GLN A 55 4.647 -14.705 -28.560 1.00 0.00 N ATOM 593 CA GLN A 55 4.376 -13.343 -29.084 1.00 0.00 C ATOM 594 C GLN A 55 5.203 -12.281 -28.350 1.00 0.00 C ATOM 595 O GLN A 55 5.637 -11.317 -28.975 1.00 0.00 O ATOM 596 CB GLN A 55 2.865 -12.986 -28.992 1.00 0.00 C ATOM 597 CG GLN A 55 2.462 -11.653 -29.658 1.00 0.00 C ATOM 598 CD GLN A 55 2.637 -11.653 -31.178 1.00 0.00 C ATOM 599 OE1 GLN A 55 3.694 -11.291 -31.697 1.00 0.00 O ATOM 600 NE2 GLN A 55 1.601 -12.067 -31.902 1.00 0.00 N ATOM 0 H GLN A 55 3.810 -15.194 -28.244 1.00 0.00 H new ATOM 0 HA GLN A 55 4.670 -13.348 -30.134 1.00 0.00 H new ATOM 0 HB2 GLN A 55 2.290 -13.791 -29.450 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.580 -12.949 -27.940 1.00 0.00 H new ATOM 0 HG2 GLN A 55 1.420 -11.437 -29.420 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.060 -10.847 -29.231 1.00 0.00 H new ATOM 0 HE21 GLN A 55 0.740 -12.360 -31.440 1.00 0.00 H new ATOM 0 HE22 GLN A 55 1.667 -12.092 -32.920 1.00 0.00 H new ATOM 609 N GLU A 56 5.422 -12.486 -27.028 1.00 0.00 N ATOM 610 CA GLU A 56 6.284 -11.588 -26.231 1.00 0.00 C ATOM 611 C GLU A 56 7.735 -11.597 -26.769 1.00 0.00 C ATOM 612 O GLU A 56 8.339 -10.535 -26.946 1.00 0.00 O ATOM 613 CB GLU A 56 6.227 -11.928 -24.714 1.00 0.00 C ATOM 614 CG GLU A 56 7.058 -10.959 -23.818 1.00 0.00 C ATOM 615 CD GLU A 56 6.568 -10.886 -22.359 1.00 0.00 C ATOM 616 OE1 GLU A 56 5.642 -10.086 -22.081 1.00 0.00 O ATOM 617 OE2 GLU A 56 7.081 -11.627 -21.492 1.00 0.00 O ATOM 0 H GLU A 56 5.017 -13.258 -26.498 1.00 0.00 H new ATOM 0 HA GLU A 56 5.897 -10.575 -26.339 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.188 -11.909 -24.386 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.589 -12.945 -24.566 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.101 -11.277 -23.826 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.026 -9.960 -24.253 1.00 0.00 H new ATOM 624 N LEU A 57 8.262 -12.799 -27.069 1.00 0.00 N ATOM 625 CA LEU A 57 9.589 -12.958 -27.705 1.00 0.00 C ATOM 626 C LEU A 57 9.615 -12.268 -29.091 1.00 0.00 C ATOM 627 O LEU A 57 10.492 -11.455 -29.342 1.00 0.00 O ATOM 628 CB LEU A 57 9.963 -14.461 -27.845 1.00 0.00 C ATOM 629 CG LEU A 57 11.371 -14.780 -28.454 1.00 0.00 C ATOM 630 CD1 LEU A 57 12.517 -14.255 -27.552 1.00 0.00 C ATOM 631 CD2 LEU A 57 11.523 -16.295 -28.734 1.00 0.00 C ATOM 0 H LEU A 57 7.787 -13.682 -26.880 1.00 0.00 H new ATOM 0 HA LEU A 57 10.328 -12.480 -27.063 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.907 -14.919 -26.858 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.207 -14.944 -28.464 1.00 0.00 H new ATOM 0 HG LEU A 57 11.445 -14.254 -29.406 1.00 0.00 H new ATOM 0 HD11 LEU A 57 13.478 -14.495 -28.008 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.428 -13.174 -27.442 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.453 -14.726 -26.571 1.00 0.00 H new ATOM 0 HD21 LEU A 57 12.509 -16.490 -29.156 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.411 -16.850 -27.803 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.756 -16.613 -29.440 1.00 0.00 H new ATOM 643 N ILE A 58 8.608 -12.570 -29.945 1.00 0.00 N ATOM 644 CA ILE A 58 8.511 -12.042 -31.335 1.00 0.00 C ATOM 645 C ILE A 58 8.530 -10.502 -31.341 1.00 0.00 C ATOM 646 O ILE A 58 9.326 -9.898 -32.064 1.00 0.00 O ATOM 647 CB ILE A 58 7.208 -12.576 -32.106 1.00 0.00 C ATOM 648 CG1 ILE A 58 7.400 -14.034 -32.649 1.00 0.00 C ATOM 649 CG2 ILE A 58 6.767 -11.641 -33.280 1.00 0.00 C ATOM 650 CD1 ILE A 58 7.576 -15.114 -31.604 1.00 0.00 C ATOM 0 H ILE A 58 7.836 -13.188 -29.693 1.00 0.00 H new ATOM 0 HA ILE A 58 9.385 -12.415 -31.869 1.00 0.00 H new ATOM 0 HB ILE A 58 6.416 -12.576 -31.357 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.536 -14.288 -33.263 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.271 -14.045 -33.304 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.881 -12.055 -33.762 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.537 -10.650 -32.889 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.575 -11.566 -34.008 1.00 0.00 H new ATOM 0 HD11 ILE A 58 7.700 -16.079 -32.095 1.00 0.00 H new ATOM 0 HD12 ILE A 58 8.458 -14.897 -31.002 1.00 0.00 H new ATOM 0 HD13 ILE A 58 6.697 -15.145 -30.961 1.00 0.00 H new ATOM 662 N GLU A 59 7.672 -9.893 -30.505 1.00 0.00 N ATOM 663 CA GLU A 59 7.460 -8.439 -30.503 1.00 0.00 C ATOM 664 C GLU A 59 8.707 -7.707 -29.971 1.00 0.00 C ATOM 665 O GLU A 59 9.173 -6.756 -30.598 1.00 0.00 O ATOM 666 CB GLU A 59 6.179 -8.054 -29.702 1.00 0.00 C ATOM 667 CG GLU A 59 6.244 -8.304 -28.183 1.00 0.00 C ATOM 668 CD GLU A 59 4.928 -8.011 -27.451 1.00 0.00 C ATOM 669 OE1 GLU A 59 4.075 -8.925 -27.339 1.00 0.00 O ATOM 670 OE2 GLU A 59 4.740 -6.865 -26.989 1.00 0.00 O ATOM 0 H GLU A 59 7.110 -10.393 -29.816 1.00 0.00 H new ATOM 0 HA GLU A 59 7.302 -8.118 -31.533 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.971 -6.997 -29.870 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.336 -8.613 -30.108 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.524 -9.343 -28.007 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.033 -7.685 -27.756 1.00 0.00 H new ATOM 677 N THR A 60 9.285 -8.213 -28.857 1.00 0.00 N ATOM 678 CA THR A 60 10.431 -7.567 -28.190 1.00 0.00 C ATOM 679 C THR A 60 11.720 -7.714 -29.038 1.00 0.00 C ATOM 680 O THR A 60 12.534 -6.778 -29.101 1.00 0.00 O ATOM 681 CB THR A 60 10.647 -8.149 -26.748 1.00 0.00 C ATOM 682 OG1 THR A 60 9.397 -8.162 -26.039 1.00 0.00 O ATOM 683 CG2 THR A 60 11.657 -7.323 -25.932 1.00 0.00 C ATOM 0 H THR A 60 8.972 -9.071 -28.402 1.00 0.00 H new ATOM 0 HA THR A 60 10.205 -6.505 -28.095 1.00 0.00 H new ATOM 0 HB THR A 60 11.041 -9.158 -26.866 1.00 0.00 H new ATOM 0 HG1 THR A 60 8.890 -8.964 -26.284 1.00 0.00 H new ATOM 0 HG21 THR A 60 11.773 -7.765 -24.942 1.00 0.00 H new ATOM 0 HG22 THR A 60 12.620 -7.319 -26.442 1.00 0.00 H new ATOM 0 HG23 THR A 60 11.294 -6.300 -25.833 1.00 0.00 H new ATOM 691 N MET A 61 11.881 -8.888 -29.699 1.00 0.00 N ATOM 692 CA MET A 61 12.995 -9.138 -30.639 1.00 0.00 C ATOM 693 C MET A 61 12.892 -8.187 -31.832 1.00 0.00 C ATOM 694 O MET A 61 13.797 -7.396 -32.049 1.00 0.00 O ATOM 695 CB MET A 61 13.029 -10.611 -31.144 1.00 0.00 C ATOM 696 CG MET A 61 13.502 -11.643 -30.109 1.00 0.00 C ATOM 697 SD MET A 61 15.252 -11.463 -29.693 1.00 0.00 S ATOM 698 CE MET A 61 16.063 -11.858 -31.251 1.00 0.00 C ATOM 0 H MET A 61 11.246 -9.680 -29.595 1.00 0.00 H new ATOM 0 HA MET A 61 13.922 -8.958 -30.095 1.00 0.00 H new ATOM 0 HB2 MET A 61 12.029 -10.887 -31.479 1.00 0.00 H new ATOM 0 HB3 MET A 61 13.683 -10.666 -32.014 1.00 0.00 H new ATOM 0 HG2 MET A 61 12.905 -11.542 -29.203 1.00 0.00 H new ATOM 0 HG3 MET A 61 13.326 -12.647 -30.496 1.00 0.00 H new ATOM 0 HE1 MET A 61 16.943 -12.471 -31.058 1.00 0.00 H new ATOM 0 HE2 MET A 61 15.372 -12.406 -31.892 1.00 0.00 H new ATOM 0 HE3 MET A 61 16.365 -10.936 -31.748 1.00 0.00 H new ATOM 708 N ALA A 62 11.751 -8.245 -32.558 1.00 0.00 N ATOM 709 CA ALA A 62 11.490 -7.408 -33.755 1.00 0.00 C ATOM 710 C ALA A 62 11.771 -5.919 -33.483 1.00 0.00 C ATOM 711 O ALA A 62 12.415 -5.252 -34.297 1.00 0.00 O ATOM 712 CB ALA A 62 10.045 -7.611 -34.249 1.00 0.00 C ATOM 0 H ALA A 62 10.982 -8.876 -32.330 1.00 0.00 H new ATOM 0 HA ALA A 62 12.176 -7.729 -34.539 1.00 0.00 H new ATOM 0 HB1 ALA A 62 9.870 -6.990 -35.127 1.00 0.00 H new ATOM 0 HB2 ALA A 62 9.893 -8.659 -34.509 1.00 0.00 H new ATOM 0 HB3 ALA A 62 9.348 -7.328 -33.460 1.00 0.00 H new ATOM 718 N GLU A 63 11.329 -5.447 -32.294 1.00 0.00 N ATOM 719 CA GLU A 63 11.558 -4.066 -31.831 1.00 0.00 C ATOM 720 C GLU A 63 13.057 -3.755 -31.684 1.00 0.00 C ATOM 721 O GLU A 63 13.542 -2.847 -32.337 1.00 0.00 O ATOM 722 CB GLU A 63 10.819 -3.786 -30.493 1.00 0.00 C ATOM 723 CG GLU A 63 9.289 -3.641 -30.629 1.00 0.00 C ATOM 724 CD GLU A 63 8.595 -3.269 -29.312 1.00 0.00 C ATOM 725 OE1 GLU A 63 8.576 -2.064 -28.967 1.00 0.00 O ATOM 726 OE2 GLU A 63 8.080 -4.172 -28.610 1.00 0.00 O ATOM 0 H GLU A 63 10.803 -6.017 -31.631 1.00 0.00 H new ATOM 0 HA GLU A 63 11.149 -3.406 -32.596 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.035 -4.596 -29.796 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.221 -2.873 -30.054 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.068 -2.878 -31.376 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.874 -4.579 -30.998 1.00 0.00 H new ATOM 733 N THR A 64 13.779 -4.526 -30.848 1.00 0.00 N ATOM 734 CA THR A 64 15.205 -4.244 -30.521 1.00 0.00 C ATOM 735 C THR A 64 16.126 -4.409 -31.759 1.00 0.00 C ATOM 736 O THR A 64 17.174 -3.758 -31.853 1.00 0.00 O ATOM 737 CB THR A 64 15.708 -5.129 -29.325 1.00 0.00 C ATOM 738 OG1 THR A 64 17.010 -4.699 -28.886 1.00 0.00 O ATOM 739 CG2 THR A 64 15.763 -6.620 -29.678 1.00 0.00 C ATOM 0 H THR A 64 13.404 -5.352 -30.382 1.00 0.00 H new ATOM 0 HA THR A 64 15.258 -3.201 -30.210 1.00 0.00 H new ATOM 0 HB THR A 64 14.983 -5.000 -28.522 1.00 0.00 H new ATOM 0 HG1 THR A 64 17.306 -5.261 -28.140 1.00 0.00 H new ATOM 0 HG21 THR A 64 16.117 -7.185 -28.816 1.00 0.00 H new ATOM 0 HG22 THR A 64 14.767 -6.966 -29.954 1.00 0.00 H new ATOM 0 HG23 THR A 64 16.444 -6.771 -30.515 1.00 0.00 H new ATOM 747 N LEU A 65 15.694 -5.264 -32.707 1.00 0.00 N ATOM 748 CA LEU A 65 16.378 -5.470 -33.997 1.00 0.00 C ATOM 749 C LEU A 65 16.276 -4.180 -34.844 1.00 0.00 C ATOM 750 O LEU A 65 17.284 -3.515 -35.123 1.00 0.00 O ATOM 751 CB LEU A 65 15.743 -6.678 -34.754 1.00 0.00 C ATOM 752 CG LEU A 65 15.952 -8.094 -34.126 1.00 0.00 C ATOM 753 CD1 LEU A 65 15.088 -9.155 -34.850 1.00 0.00 C ATOM 754 CD2 LEU A 65 17.442 -8.500 -34.102 1.00 0.00 C ATOM 0 H LEU A 65 14.855 -5.834 -32.597 1.00 0.00 H new ATOM 0 HA LEU A 65 17.430 -5.694 -33.820 1.00 0.00 H new ATOM 0 HB2 LEU A 65 14.671 -6.499 -34.839 1.00 0.00 H new ATOM 0 HB3 LEU A 65 16.145 -6.693 -35.767 1.00 0.00 H new ATOM 0 HG LEU A 65 15.621 -8.043 -33.089 1.00 0.00 H new ATOM 0 HD11 LEU A 65 15.252 -10.131 -34.394 1.00 0.00 H new ATOM 0 HD12 LEU A 65 14.035 -8.887 -34.764 1.00 0.00 H new ATOM 0 HD13 LEU A 65 15.368 -9.195 -35.903 1.00 0.00 H new ATOM 0 HD21 LEU A 65 17.542 -9.490 -33.658 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.831 -8.518 -35.120 1.00 0.00 H new ATOM 0 HD23 LEU A 65 18.006 -7.779 -33.511 1.00 0.00 H new ATOM 766 N LYS A 66 15.023 -3.800 -35.166 1.00 0.00 N ATOM 767 CA LYS A 66 14.715 -2.634 -36.024 1.00 0.00 C ATOM 768 C LYS A 66 15.089 -1.300 -35.327 1.00 0.00 C ATOM 769 O LYS A 66 15.214 -0.272 -35.985 1.00 0.00 O ATOM 770 CB LYS A 66 13.211 -2.635 -36.427 1.00 0.00 C ATOM 771 CG LYS A 66 12.235 -2.274 -35.287 1.00 0.00 C ATOM 772 CD LYS A 66 10.733 -2.447 -35.647 1.00 0.00 C ATOM 773 CE LYS A 66 10.197 -1.402 -36.652 1.00 0.00 C ATOM 774 NZ LYS A 66 10.749 -1.565 -38.020 1.00 0.00 N ATOM 0 H LYS A 66 14.193 -4.293 -34.838 1.00 0.00 H new ATOM 0 HA LYS A 66 15.320 -2.718 -36.927 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.068 -1.930 -37.246 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.952 -3.623 -36.809 1.00 0.00 H new ATOM 0 HG2 LYS A 66 12.462 -2.895 -34.421 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.408 -1.239 -34.991 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.583 -3.444 -36.062 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.143 -2.391 -34.732 1.00 0.00 H new ATOM 0 HE2 LYS A 66 9.110 -1.474 -36.695 1.00 0.00 H new ATOM 0 HE3 LYS A 66 10.436 -0.403 -36.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.997 -1.400 -38.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 11.517 -0.879 -38.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 11.120 -2.530 -38.132 1.00 0.00 H new ATOM 788 N SER A 67 15.252 -1.335 -33.985 1.00 0.00 N ATOM 789 CA SER A 67 15.600 -0.146 -33.176 1.00 0.00 C ATOM 790 C SER A 67 17.073 0.261 -33.368 1.00 0.00 C ATOM 791 O SER A 67 17.439 1.411 -33.102 1.00 0.00 O ATOM 792 CB SER A 67 15.304 -0.402 -31.679 1.00 0.00 C ATOM 793 OG SER A 67 15.548 0.746 -30.886 1.00 0.00 O ATOM 0 H SER A 67 15.146 -2.187 -33.434 1.00 0.00 H new ATOM 0 HA SER A 67 14.979 0.680 -33.523 1.00 0.00 H new ATOM 0 HB2 SER A 67 14.265 -0.709 -31.562 1.00 0.00 H new ATOM 0 HB3 SER A 67 15.922 -1.226 -31.323 1.00 0.00 H new ATOM 0 HG SER A 67 15.348 0.544 -29.948 1.00 0.00 H new ATOM 799 N THR A 68 17.924 -0.686 -33.803 1.00 0.00 N ATOM 800 CA THR A 68 19.352 -0.398 -34.085 1.00 0.00 C ATOM 801 C THR A 68 19.604 -0.366 -35.609 1.00 0.00 C ATOM 802 O THR A 68 20.715 -0.066 -36.062 1.00 0.00 O ATOM 803 CB THR A 68 20.279 -1.434 -33.367 1.00 0.00 C ATOM 804 OG1 THR A 68 21.658 -1.011 -33.402 1.00 0.00 O ATOM 805 CG2 THR A 68 20.162 -2.833 -33.976 1.00 0.00 C ATOM 0 H THR A 68 17.654 -1.656 -33.968 1.00 0.00 H new ATOM 0 HA THR A 68 19.596 0.587 -33.687 1.00 0.00 H new ATOM 0 HB THR A 68 19.942 -1.482 -32.332 1.00 0.00 H new ATOM 0 HG1 THR A 68 21.851 -0.594 -34.268 1.00 0.00 H new ATOM 0 HG21 THR A 68 20.824 -3.517 -33.445 1.00 0.00 H new ATOM 0 HG22 THR A 68 19.133 -3.183 -33.890 1.00 0.00 H new ATOM 0 HG23 THR A 68 20.446 -2.797 -35.028 1.00 0.00 H new ATOM 813 N MET A 69 18.547 -0.674 -36.383 1.00 0.00 N ATOM 814 CA MET A 69 18.536 -0.606 -37.859 1.00 0.00 C ATOM 815 C MET A 69 17.711 0.615 -38.337 1.00 0.00 C ATOM 816 O MET A 69 16.914 1.150 -37.564 1.00 0.00 O ATOM 817 CB MET A 69 17.930 -1.923 -38.419 1.00 0.00 C ATOM 818 CG MET A 69 18.788 -3.177 -38.185 1.00 0.00 C ATOM 819 SD MET A 69 17.968 -4.690 -38.733 1.00 0.00 S ATOM 820 CE MET A 69 17.473 -4.259 -40.402 1.00 0.00 C ATOM 0 H MET A 69 17.657 -0.984 -35.993 1.00 0.00 H new ATOM 0 HA MET A 69 19.555 -0.489 -38.227 1.00 0.00 H new ATOM 0 HB2 MET A 69 16.952 -2.079 -37.964 1.00 0.00 H new ATOM 0 HB3 MET A 69 17.768 -1.805 -39.490 1.00 0.00 H new ATOM 0 HG2 MET A 69 19.735 -3.069 -38.714 1.00 0.00 H new ATOM 0 HG3 MET A 69 19.023 -3.259 -37.124 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.003 -5.121 -40.876 1.00 0.00 H new ATOM 0 HE2 MET A 69 16.764 -3.432 -40.369 1.00 0.00 H new ATOM 0 HE3 MET A 69 18.350 -3.962 -40.977 1.00 0.00 H new ATOM 830 N PRO A 70 17.903 1.098 -39.615 1.00 0.00 N ATOM 831 CA PRO A 70 17.025 2.128 -40.207 1.00 0.00 C ATOM 832 C PRO A 70 15.563 1.627 -40.305 1.00 0.00 C ATOM 833 O PRO A 70 14.669 2.178 -39.653 1.00 0.00 O ATOM 834 CB PRO A 70 17.632 2.403 -41.622 1.00 0.00 C ATOM 835 CG PRO A 70 18.990 1.750 -41.633 1.00 0.00 C ATOM 836 CD PRO A 70 18.988 0.702 -40.539 1.00 0.00 C ATOM 0 HA PRO A 70 16.984 3.032 -39.600 1.00 0.00 H new ATOM 0 HB2 PRO A 70 16.996 1.991 -42.405 1.00 0.00 H new ATOM 0 HB3 PRO A 70 17.714 3.474 -41.809 1.00 0.00 H new ATOM 0 HG2 PRO A 70 19.191 1.294 -42.603 1.00 0.00 H new ATOM 0 HG3 PRO A 70 19.774 2.487 -41.459 1.00 0.00 H new ATOM 0 HD2 PRO A 70 18.811 -0.293 -40.949 1.00 0.00 H new ATOM 0 HD3 PRO A 70 19.949 0.669 -40.025 1.00 0.00 H new ATOM 844 N ASP A 71 15.347 0.543 -41.092 1.00 0.00 N ATOM 845 CA ASP A 71 14.013 -0.072 -41.286 1.00 0.00 C ATOM 846 C ASP A 71 14.149 -1.602 -41.392 1.00 0.00 C ATOM 847 O ASP A 71 13.855 -2.322 -40.431 1.00 0.00 O ATOM 848 CB ASP A 71 13.307 0.498 -42.558 1.00 0.00 C ATOM 849 CG ASP A 71 12.916 1.983 -42.448 1.00 0.00 C ATOM 850 OD1 ASP A 71 11.856 2.290 -41.856 1.00 0.00 O ATOM 851 OD2 ASP A 71 13.681 2.851 -42.929 1.00 0.00 O ATOM 0 H ASP A 71 16.091 0.073 -41.608 1.00 0.00 H new ATOM 0 HA ASP A 71 13.396 0.174 -40.422 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.968 0.370 -43.415 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.410 -0.089 -42.756 1.00 0.00 H new ATOM 856 N ARG A 72 14.656 -2.080 -42.545 1.00 0.00 N ATOM 857 CA ARG A 72 14.791 -3.521 -42.858 1.00 0.00 C ATOM 858 C ARG A 72 15.771 -3.703 -44.033 1.00 0.00 C ATOM 859 O ARG A 72 15.912 -2.812 -44.877 1.00 0.00 O ATOM 860 CB ARG A 72 13.410 -4.190 -43.190 1.00 0.00 C ATOM 861 CG ARG A 72 12.569 -3.488 -44.310 1.00 0.00 C ATOM 862 CD ARG A 72 11.475 -2.544 -43.762 1.00 0.00 C ATOM 863 NE ARG A 72 10.847 -1.746 -44.833 1.00 0.00 N ATOM 864 CZ ARG A 72 10.133 -0.619 -44.652 1.00 0.00 C ATOM 865 NH1 ARG A 72 9.924 -0.126 -43.438 1.00 0.00 N ATOM 866 NH2 ARG A 72 9.636 0.018 -45.700 1.00 0.00 N ATOM 0 H ARG A 72 14.987 -1.473 -43.294 1.00 0.00 H new ATOM 0 HA ARG A 72 15.180 -4.020 -41.971 1.00 0.00 H new ATOM 0 HB2 ARG A 72 13.590 -5.223 -43.489 1.00 0.00 H new ATOM 0 HB3 ARG A 72 12.813 -4.221 -42.278 1.00 0.00 H new ATOM 0 HG2 ARG A 72 13.240 -2.918 -44.953 1.00 0.00 H new ATOM 0 HG3 ARG A 72 12.101 -4.250 -44.933 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.711 -3.131 -43.252 1.00 0.00 H new ATOM 0 HD3 ARG A 72 11.911 -1.875 -43.020 1.00 0.00 H new ATOM 0 HE ARG A 72 10.964 -2.076 -45.791 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.307 -0.602 -42.621 1.00 0.00 H new ATOM 0 HH12 ARG A 72 9.380 0.729 -43.321 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.794 -0.345 -46.640 1.00 0.00 H new ATOM 0 HH22 ARG A 72 9.094 0.872 -45.568 1.00 0.00 H new ATOM 880 N GLY A 73 16.469 -4.853 -44.063 1.00 0.00 N ATOM 881 CA GLY A 73 17.462 -5.151 -45.115 1.00 0.00 C ATOM 882 C GLY A 73 18.882 -4.735 -44.731 1.00 0.00 C ATOM 883 O GLY A 73 19.862 -5.281 -45.257 1.00 0.00 O ATOM 0 H GLY A 73 16.364 -5.594 -43.370 1.00 0.00 H new ATOM 0 HA2 GLY A 73 17.448 -6.220 -45.328 1.00 0.00 H new ATOM 0 HA3 GLY A 73 17.175 -4.639 -46.033 1.00 0.00 H new ATOM 887 N ALA A 74 18.980 -3.734 -43.833 1.00 0.00 N ATOM 888 CA ALA A 74 20.248 -3.294 -43.217 1.00 0.00 C ATOM 889 C ALA A 74 20.848 -4.424 -42.340 1.00 0.00 C ATOM 890 O ALA A 74 20.094 -5.304 -41.911 1.00 0.00 O ATOM 891 CB ALA A 74 19.981 -2.039 -42.378 1.00 0.00 C ATOM 0 H ALA A 74 18.171 -3.202 -43.511 1.00 0.00 H new ATOM 0 HA ALA A 74 20.973 -3.061 -43.997 1.00 0.00 H new ATOM 0 HB1 ALA A 74 20.911 -1.704 -41.918 1.00 0.00 H new ATOM 0 HB2 ALA A 74 19.589 -1.249 -43.019 1.00 0.00 H new ATOM 0 HB3 ALA A 74 19.253 -2.270 -41.600 1.00 0.00 H new ATOM 897 N PRO A 75 22.197 -4.438 -42.061 1.00 0.00 N ATOM 898 CA PRO A 75 22.818 -5.470 -41.188 1.00 0.00 C ATOM 899 C PRO A 75 22.181 -5.504 -39.766 1.00 0.00 C ATOM 900 O PRO A 75 22.089 -4.472 -39.088 1.00 0.00 O ATOM 901 CB PRO A 75 24.327 -5.075 -41.151 1.00 0.00 C ATOM 902 CG PRO A 75 24.372 -3.649 -41.622 1.00 0.00 C ATOM 903 CD PRO A 75 23.222 -3.494 -42.589 1.00 0.00 C ATOM 0 HA PRO A 75 22.664 -6.480 -41.569 1.00 0.00 H new ATOM 0 HB2 PRO A 75 24.735 -5.170 -40.145 1.00 0.00 H new ATOM 0 HB3 PRO A 75 24.920 -5.722 -41.798 1.00 0.00 H new ATOM 0 HG2 PRO A 75 24.274 -2.958 -40.785 1.00 0.00 H new ATOM 0 HG3 PRO A 75 25.323 -3.428 -42.107 1.00 0.00 H new ATOM 0 HD2 PRO A 75 22.851 -2.469 -42.611 1.00 0.00 H new ATOM 0 HD3 PRO A 75 23.516 -3.749 -43.607 1.00 0.00 H new ATOM 911 N LEU A 76 21.711 -6.698 -39.369 1.00 0.00 N ATOM 912 CA LEU A 76 21.123 -6.960 -38.031 1.00 0.00 C ATOM 913 C LEU A 76 22.202 -6.869 -36.901 1.00 0.00 C ATOM 914 O LEU A 76 23.404 -7.006 -37.189 1.00 0.00 O ATOM 915 CB LEU A 76 20.372 -8.352 -38.050 1.00 0.00 C ATOM 916 CG LEU A 76 21.066 -9.559 -38.800 1.00 0.00 C ATOM 917 CD1 LEU A 76 22.363 -10.034 -38.113 1.00 0.00 C ATOM 918 CD2 LEU A 76 20.083 -10.741 -39.006 1.00 0.00 C ATOM 0 H LEU A 76 21.726 -7.522 -39.970 1.00 0.00 H new ATOM 0 HA LEU A 76 20.391 -6.186 -37.802 1.00 0.00 H new ATOM 0 HB2 LEU A 76 20.202 -8.654 -37.017 1.00 0.00 H new ATOM 0 HB3 LEU A 76 19.392 -8.197 -38.502 1.00 0.00 H new ATOM 0 HG LEU A 76 21.355 -9.177 -39.779 1.00 0.00 H new ATOM 0 HD11 LEU A 76 22.790 -10.864 -38.676 1.00 0.00 H new ATOM 0 HD12 LEU A 76 23.078 -9.212 -38.078 1.00 0.00 H new ATOM 0 HD13 LEU A 76 22.138 -10.362 -37.098 1.00 0.00 H new ATOM 0 HD21 LEU A 76 20.594 -11.553 -39.524 1.00 0.00 H new ATOM 0 HD22 LEU A 76 19.731 -11.094 -38.037 1.00 0.00 H new ATOM 0 HD23 LEU A 76 19.233 -10.408 -39.602 1.00 0.00 H new ATOM 930 N PRO A 77 21.798 -6.608 -35.601 1.00 0.00 N ATOM 931 CA PRO A 77 22.749 -6.578 -34.454 1.00 0.00 C ATOM 932 C PRO A 77 23.305 -7.982 -34.139 1.00 0.00 C ATOM 933 O PRO A 77 22.583 -8.975 -34.257 1.00 0.00 O ATOM 934 CB PRO A 77 21.880 -6.051 -33.277 1.00 0.00 C ATOM 935 CG PRO A 77 20.484 -6.459 -33.639 1.00 0.00 C ATOM 936 CD PRO A 77 20.402 -6.313 -35.148 1.00 0.00 C ATOM 0 HA PRO A 77 23.624 -5.959 -34.654 1.00 0.00 H new ATOM 0 HB2 PRO A 77 22.189 -6.488 -32.327 1.00 0.00 H new ATOM 0 HB3 PRO A 77 21.964 -4.969 -33.173 1.00 0.00 H new ATOM 0 HG2 PRO A 77 20.282 -7.485 -33.332 1.00 0.00 H new ATOM 0 HG3 PRO A 77 19.748 -5.827 -33.142 1.00 0.00 H new ATOM 0 HD2 PRO A 77 19.684 -7.009 -35.581 1.00 0.00 H new ATOM 0 HD3 PRO A 77 20.089 -5.310 -35.438 1.00 0.00 H new ATOM 944 N GLU A 78 24.580 -8.046 -33.719 1.00 0.00 N ATOM 945 CA GLU A 78 25.254 -9.310 -33.384 1.00 0.00 C ATOM 946 C GLU A 78 24.945 -9.724 -31.939 1.00 0.00 C ATOM 947 O GLU A 78 25.141 -10.877 -31.566 1.00 0.00 O ATOM 948 CB GLU A 78 26.786 -9.194 -33.596 1.00 0.00 C ATOM 949 CG GLU A 78 27.191 -8.668 -34.990 1.00 0.00 C ATOM 950 CD GLU A 78 28.715 -8.588 -35.190 1.00 0.00 C ATOM 951 OE1 GLU A 78 29.335 -7.617 -34.709 1.00 0.00 O ATOM 952 OE2 GLU A 78 29.301 -9.486 -35.832 1.00 0.00 O ATOM 0 H GLU A 78 25.171 -7.223 -33.603 1.00 0.00 H new ATOM 0 HA GLU A 78 24.873 -10.081 -34.054 1.00 0.00 H new ATOM 0 HB2 GLU A 78 27.198 -8.531 -32.835 1.00 0.00 H new ATOM 0 HB3 GLU A 78 27.238 -10.174 -33.444 1.00 0.00 H new ATOM 0 HG2 GLU A 78 26.765 -9.318 -35.754 1.00 0.00 H new ATOM 0 HG3 GLU A 78 26.760 -7.678 -35.137 1.00 0.00 H new ATOM 959 N ASN A 79 24.487 -8.769 -31.111 1.00 0.00 N ATOM 960 CA ASN A 79 24.168 -9.020 -29.696 1.00 0.00 C ATOM 961 C ASN A 79 22.830 -8.365 -29.366 1.00 0.00 C ATOM 962 O ASN A 79 22.675 -7.146 -29.512 1.00 0.00 O ATOM 963 CB ASN A 79 25.298 -8.479 -28.781 1.00 0.00 C ATOM 964 CG ASN A 79 26.645 -9.168 -29.042 1.00 0.00 C ATOM 965 OD1 ASN A 79 26.987 -10.160 -28.398 1.00 0.00 O ATOM 966 ND2 ASN A 79 27.395 -8.675 -30.021 1.00 0.00 N ATOM 0 H ASN A 79 24.328 -7.805 -31.403 1.00 0.00 H new ATOM 0 HA ASN A 79 24.091 -10.093 -29.520 1.00 0.00 H new ATOM 0 HB2 ASN A 79 25.406 -7.406 -28.938 1.00 0.00 H new ATOM 0 HB3 ASN A 79 25.016 -8.622 -27.738 1.00 0.00 H new ATOM 0 HD21 ASN A 79 28.282 -9.120 -30.258 1.00 0.00 H new ATOM 0 HD22 ASN A 79 27.084 -7.851 -30.536 1.00 0.00 H new ATOM 973 N ILE A 80 21.859 -9.195 -28.954 1.00 0.00 N ATOM 974 CA ILE A 80 20.498 -8.754 -28.609 1.00 0.00 C ATOM 975 C ILE A 80 20.314 -8.885 -27.088 1.00 0.00 C ATOM 976 O ILE A 80 20.308 -9.998 -26.550 1.00 0.00 O ATOM 977 CB ILE A 80 19.381 -9.591 -29.375 1.00 0.00 C ATOM 978 CG1 ILE A 80 19.417 -9.358 -30.937 1.00 0.00 C ATOM 979 CG2 ILE A 80 17.962 -9.290 -28.812 1.00 0.00 C ATOM 980 CD1 ILE A 80 20.581 -10.005 -31.690 1.00 0.00 C ATOM 0 H ILE A 80 21.998 -10.200 -28.850 1.00 0.00 H new ATOM 0 HA ILE A 80 20.380 -7.716 -28.921 1.00 0.00 H new ATOM 0 HB ILE A 80 19.609 -10.642 -29.198 1.00 0.00 H new ATOM 0 HG12 ILE A 80 18.485 -9.732 -31.361 1.00 0.00 H new ATOM 0 HG13 ILE A 80 19.443 -8.284 -31.123 1.00 0.00 H new ATOM 0 HG21 ILE A 80 17.222 -9.877 -29.356 1.00 0.00 H new ATOM 0 HG22 ILE A 80 17.927 -9.552 -27.755 1.00 0.00 H new ATOM 0 HG23 ILE A 80 17.741 -8.229 -28.930 1.00 0.00 H new ATOM 0 HD11 ILE A 80 20.499 -9.776 -32.753 1.00 0.00 H new ATOM 0 HD12 ILE A 80 21.524 -9.615 -31.306 1.00 0.00 H new ATOM 0 HD13 ILE A 80 20.550 -11.085 -31.548 1.00 0.00 H new ATOM 992 N ILE A 81 20.197 -7.739 -26.404 1.00 0.00 N ATOM 993 CA ILE A 81 19.979 -7.687 -24.948 1.00 0.00 C ATOM 994 C ILE A 81 18.482 -7.555 -24.659 1.00 0.00 C ATOM 995 O ILE A 81 17.847 -6.594 -25.099 1.00 0.00 O ATOM 996 CB ILE A 81 20.759 -6.485 -24.286 1.00 0.00 C ATOM 997 CG1 ILE A 81 22.285 -6.613 -24.582 1.00 0.00 C ATOM 998 CG2 ILE A 81 20.494 -6.386 -22.752 1.00 0.00 C ATOM 999 CD1 ILE A 81 22.936 -7.866 -24.010 1.00 0.00 C ATOM 0 H ILE A 81 20.251 -6.820 -26.843 1.00 0.00 H new ATOM 0 HA ILE A 81 20.361 -8.612 -24.515 1.00 0.00 H new ATOM 0 HB ILE A 81 20.387 -5.561 -24.729 1.00 0.00 H new ATOM 0 HG12 ILE A 81 22.435 -6.601 -25.662 1.00 0.00 H new ATOM 0 HG13 ILE A 81 22.795 -5.738 -24.180 1.00 0.00 H new ATOM 0 HG21 ILE A 81 21.051 -5.545 -22.340 1.00 0.00 H new ATOM 0 HG22 ILE A 81 19.429 -6.237 -22.576 1.00 0.00 H new ATOM 0 HG23 ILE A 81 20.816 -7.307 -22.267 1.00 0.00 H new ATOM 0 HD11 ILE A 81 23.996 -7.873 -24.263 1.00 0.00 H new ATOM 0 HD12 ILE A 81 22.822 -7.873 -22.926 1.00 0.00 H new ATOM 0 HD13 ILE A 81 22.456 -8.750 -24.431 1.00 0.00 H new ATOM 1011 N LEU A 82 17.941 -8.540 -23.933 1.00 0.00 N ATOM 1012 CA LEU A 82 16.561 -8.527 -23.412 1.00 0.00 C ATOM 1013 C LEU A 82 16.672 -8.792 -21.902 1.00 0.00 C ATOM 1014 O LEU A 82 16.442 -9.908 -21.421 1.00 0.00 O ATOM 1015 CB LEU A 82 15.662 -9.598 -24.107 1.00 0.00 C ATOM 1016 CG LEU A 82 15.577 -9.574 -25.666 1.00 0.00 C ATOM 1017 CD1 LEU A 82 14.607 -10.666 -26.180 1.00 0.00 C ATOM 1018 CD2 LEU A 82 15.179 -8.176 -26.196 1.00 0.00 C ATOM 0 H LEU A 82 18.455 -9.385 -23.684 1.00 0.00 H new ATOM 0 HA LEU A 82 16.083 -7.569 -23.616 1.00 0.00 H new ATOM 0 HB2 LEU A 82 16.020 -10.583 -23.806 1.00 0.00 H new ATOM 0 HB3 LEU A 82 14.651 -9.493 -23.714 1.00 0.00 H new ATOM 0 HG LEU A 82 16.572 -9.793 -26.054 1.00 0.00 H new ATOM 0 HD11 LEU A 82 14.563 -10.631 -27.269 1.00 0.00 H new ATOM 0 HD12 LEU A 82 14.962 -11.647 -25.863 1.00 0.00 H new ATOM 0 HD13 LEU A 82 13.612 -10.490 -25.771 1.00 0.00 H new ATOM 0 HD21 LEU A 82 15.130 -8.200 -27.285 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.204 -7.899 -25.795 1.00 0.00 H new ATOM 0 HD23 LEU A 82 15.922 -7.443 -25.882 1.00 0.00 H new ATOM 1030 N ASP A 83 17.094 -7.752 -21.172 1.00 0.00 N ATOM 1031 CA ASP A 83 17.541 -7.876 -19.767 1.00 0.00 C ATOM 1032 C ASP A 83 16.380 -7.918 -18.756 1.00 0.00 C ATOM 1033 O ASP A 83 16.601 -8.172 -17.568 1.00 0.00 O ATOM 1034 CB ASP A 83 18.555 -6.753 -19.414 1.00 0.00 C ATOM 1035 CG ASP A 83 17.992 -5.332 -19.538 1.00 0.00 C ATOM 1036 OD1 ASP A 83 17.663 -4.909 -20.670 1.00 0.00 O ATOM 1037 OD2 ASP A 83 17.898 -4.624 -18.513 1.00 0.00 O ATOM 0 H ASP A 83 17.138 -6.799 -21.533 1.00 0.00 H new ATOM 0 HA ASP A 83 18.041 -8.841 -19.685 1.00 0.00 H new ATOM 0 HB2 ASP A 83 18.906 -6.904 -18.393 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.423 -6.845 -20.067 1.00 0.00 H new ATOM 1042 N ASP A 84 15.147 -7.691 -19.235 1.00 0.00 N ATOM 1043 CA ASP A 84 13.929 -7.706 -18.386 1.00 0.00 C ATOM 1044 C ASP A 84 12.908 -8.747 -18.876 1.00 0.00 C ATOM 1045 O ASP A 84 11.761 -8.743 -18.401 1.00 0.00 O ATOM 1046 CB ASP A 84 13.265 -6.296 -18.357 1.00 0.00 C ATOM 1047 CG ASP A 84 14.172 -5.217 -17.747 1.00 0.00 C ATOM 1048 OD1 ASP A 84 14.238 -5.109 -16.512 1.00 0.00 O ATOM 1049 OD2 ASP A 84 14.819 -4.475 -18.492 1.00 0.00 O ATOM 0 H ASP A 84 14.959 -7.492 -20.217 1.00 0.00 H new ATOM 0 HA ASP A 84 14.240 -7.981 -17.378 1.00 0.00 H new ATOM 0 HB2 ASP A 84 12.997 -6.006 -19.373 1.00 0.00 H new ATOM 0 HB3 ASP A 84 12.338 -6.349 -17.786 1.00 0.00 H new ATOM 1054 N MET A 85 13.315 -9.674 -19.776 1.00 0.00 N ATOM 1055 CA MET A 85 12.340 -10.575 -20.439 1.00 0.00 C ATOM 1056 C MET A 85 12.076 -11.782 -19.519 1.00 0.00 C ATOM 1057 O MET A 85 12.950 -12.633 -19.371 1.00 0.00 O ATOM 1058 CB MET A 85 12.828 -11.044 -21.844 1.00 0.00 C ATOM 1059 CG MET A 85 11.688 -11.609 -22.717 1.00 0.00 C ATOM 1060 SD MET A 85 12.242 -12.316 -24.286 1.00 0.00 S ATOM 1061 CE MET A 85 12.849 -13.922 -23.770 1.00 0.00 C ATOM 0 H MET A 85 14.286 -9.817 -20.055 1.00 0.00 H new ATOM 0 HA MET A 85 11.415 -10.022 -20.605 1.00 0.00 H new ATOM 0 HB2 MET A 85 13.293 -10.204 -22.361 1.00 0.00 H new ATOM 0 HB3 MET A 85 13.597 -11.807 -21.720 1.00 0.00 H new ATOM 0 HG2 MET A 85 11.158 -12.376 -22.152 1.00 0.00 H new ATOM 0 HG3 MET A 85 10.973 -10.813 -22.922 1.00 0.00 H new ATOM 0 HE1 MET A 85 13.763 -14.157 -24.314 1.00 0.00 H new ATOM 0 HE2 MET A 85 13.058 -13.906 -22.700 1.00 0.00 H new ATOM 0 HE3 MET A 85 12.096 -14.681 -23.981 1.00 0.00 H new ATOM 1071 N ASP A 86 10.864 -11.810 -18.904 1.00 0.00 N ATOM 1072 CA ASP A 86 10.488 -12.739 -17.798 1.00 0.00 C ATOM 1073 C ASP A 86 11.329 -12.424 -16.529 1.00 0.00 C ATOM 1074 O ASP A 86 11.444 -13.223 -15.604 1.00 0.00 O ATOM 1075 CB ASP A 86 10.638 -14.233 -18.267 1.00 0.00 C ATOM 1076 CG ASP A 86 10.261 -15.288 -17.202 1.00 0.00 C ATOM 1077 OD1 ASP A 86 9.076 -15.387 -16.871 1.00 0.00 O ATOM 1078 OD2 ASP A 86 11.157 -16.014 -16.693 1.00 0.00 O ATOM 0 H ASP A 86 10.107 -11.179 -19.165 1.00 0.00 H new ATOM 0 HA ASP A 86 9.440 -12.592 -17.535 1.00 0.00 H new ATOM 0 HB2 ASP A 86 10.014 -14.387 -19.147 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.670 -14.401 -18.575 1.00 0.00 H new ATOM 1083 N GLY A 87 11.833 -11.178 -16.448 1.00 0.00 N ATOM 1084 CA GLY A 87 12.803 -10.790 -15.416 1.00 0.00 C ATOM 1085 C GLY A 87 14.185 -11.409 -15.643 1.00 0.00 C ATOM 1086 O GLY A 87 15.096 -11.214 -14.833 1.00 0.00 O ATOM 0 H GLY A 87 11.582 -10.424 -17.088 1.00 0.00 H new ATOM 0 HA2 GLY A 87 12.894 -9.704 -15.398 1.00 0.00 H new ATOM 0 HA3 GLY A 87 12.429 -11.094 -14.438 1.00 0.00 H new ATOM 1090 N CYS A 88 14.331 -12.172 -16.751 1.00 0.00 N ATOM 1091 CA CYS A 88 15.571 -12.832 -17.131 1.00 0.00 C ATOM 1092 C CYS A 88 16.409 -11.876 -17.987 1.00 0.00 C ATOM 1093 O CYS A 88 15.875 -11.203 -18.900 1.00 0.00 O ATOM 1094 CB CYS A 88 15.292 -14.131 -17.932 1.00 0.00 C ATOM 1095 SG CYS A 88 14.247 -15.329 -17.084 1.00 0.00 S ATOM 0 H CYS A 88 13.569 -12.340 -17.408 1.00 0.00 H new ATOM 0 HA CYS A 88 16.112 -13.100 -16.223 1.00 0.00 H new ATOM 0 HB2 CYS A 88 14.821 -13.864 -18.878 1.00 0.00 H new ATOM 0 HB3 CYS A 88 16.244 -14.605 -18.172 1.00 0.00 H new ATOM 0 HG CYS A 88 13.569 -16.010 -17.960 1.00 0.00 H new ATOM 1101 N ARG A 89 17.708 -11.804 -17.667 1.00 0.00 N ATOM 1102 CA ARG A 89 18.701 -11.155 -18.504 1.00 0.00 C ATOM 1103 C ARG A 89 19.155 -12.179 -19.560 1.00 0.00 C ATOM 1104 O ARG A 89 20.057 -12.991 -19.305 1.00 0.00 O ATOM 1105 CB ARG A 89 19.884 -10.619 -17.631 1.00 0.00 C ATOM 1106 CG ARG A 89 20.750 -9.504 -18.283 1.00 0.00 C ATOM 1107 CD ARG A 89 21.642 -9.984 -19.441 1.00 0.00 C ATOM 1108 NE ARG A 89 22.629 -10.987 -18.994 1.00 0.00 N ATOM 1109 CZ ARG A 89 23.773 -11.281 -19.618 1.00 0.00 C ATOM 1110 NH1 ARG A 89 24.123 -10.644 -20.723 1.00 0.00 N ATOM 1111 NH2 ARG A 89 24.569 -12.212 -19.113 1.00 0.00 N ATOM 0 H ARG A 89 18.093 -12.201 -16.810 1.00 0.00 H new ATOM 0 HA ARG A 89 18.286 -10.284 -19.011 1.00 0.00 H new ATOM 0 HB2 ARG A 89 19.477 -10.237 -16.695 1.00 0.00 H new ATOM 0 HB3 ARG A 89 20.533 -11.457 -17.378 1.00 0.00 H new ATOM 0 HG2 ARG A 89 20.091 -8.718 -18.651 1.00 0.00 H new ATOM 0 HG3 ARG A 89 21.382 -9.057 -17.516 1.00 0.00 H new ATOM 0 HD2 ARG A 89 21.019 -10.412 -20.226 1.00 0.00 H new ATOM 0 HD3 ARG A 89 22.162 -9.131 -19.877 1.00 0.00 H new ATOM 0 HE ARG A 89 22.420 -11.498 -18.137 1.00 0.00 H new ATOM 0 HH11 ARG A 89 23.517 -9.919 -21.108 1.00 0.00 H new ATOM 0 HH12 ARG A 89 24.999 -10.877 -21.190 1.00 0.00 H new ATOM 0 HH21 ARG A 89 24.306 -12.697 -18.255 1.00 0.00 H new ATOM 0 HH22 ARG A 89 25.445 -12.444 -19.582 1.00 0.00 H new ATOM 1125 N VAL A 90 18.473 -12.168 -20.718 1.00 0.00 N ATOM 1126 CA VAL A 90 18.823 -13.029 -21.864 1.00 0.00 C ATOM 1127 C VAL A 90 19.591 -12.224 -22.925 1.00 0.00 C ATOM 1128 O VAL A 90 19.212 -11.105 -23.277 1.00 0.00 O ATOM 1129 CB VAL A 90 17.573 -13.802 -22.472 1.00 0.00 C ATOM 1130 CG1 VAL A 90 16.290 -12.959 -22.471 1.00 0.00 C ATOM 1131 CG2 VAL A 90 17.869 -14.380 -23.889 1.00 0.00 C ATOM 0 H VAL A 90 17.667 -11.566 -20.887 1.00 0.00 H new ATOM 0 HA VAL A 90 19.483 -13.812 -21.491 1.00 0.00 H new ATOM 0 HB VAL A 90 17.395 -14.645 -21.804 1.00 0.00 H new ATOM 0 HG11 VAL A 90 15.472 -13.540 -22.898 1.00 0.00 H new ATOM 0 HG12 VAL A 90 16.040 -12.678 -21.448 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.445 -12.060 -23.067 1.00 0.00 H new ATOM 0 HG21 VAL A 90 16.986 -14.899 -24.262 1.00 0.00 H new ATOM 0 HG22 VAL A 90 18.126 -13.566 -24.567 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.703 -15.080 -23.830 1.00 0.00 H new ATOM 1141 N GLU A 91 20.687 -12.829 -23.405 1.00 0.00 N ATOM 1142 CA GLU A 91 21.610 -12.242 -24.370 1.00 0.00 C ATOM 1143 C GLU A 91 21.785 -13.219 -25.546 1.00 0.00 C ATOM 1144 O GLU A 91 22.242 -14.355 -25.353 1.00 0.00 O ATOM 1145 CB GLU A 91 22.971 -11.958 -23.675 1.00 0.00 C ATOM 1146 CG GLU A 91 24.036 -11.311 -24.583 1.00 0.00 C ATOM 1147 CD GLU A 91 25.356 -11.023 -23.843 1.00 0.00 C ATOM 1148 OE1 GLU A 91 25.470 -9.966 -23.187 1.00 0.00 O ATOM 1149 OE2 GLU A 91 26.278 -11.857 -23.894 1.00 0.00 O ATOM 0 H GLU A 91 20.958 -13.770 -23.119 1.00 0.00 H new ATOM 0 HA GLU A 91 21.217 -11.299 -24.750 1.00 0.00 H new ATOM 0 HB2 GLU A 91 22.797 -11.305 -22.820 1.00 0.00 H new ATOM 0 HB3 GLU A 91 23.367 -12.896 -23.285 1.00 0.00 H new ATOM 0 HG2 GLU A 91 24.235 -11.970 -25.428 1.00 0.00 H new ATOM 0 HG3 GLU A 91 23.642 -10.380 -24.990 1.00 0.00 H new ATOM 1156 N PHE A 92 21.375 -12.787 -26.751 1.00 0.00 N ATOM 1157 CA PHE A 92 21.549 -13.556 -27.992 1.00 0.00 C ATOM 1158 C PHE A 92 22.900 -13.172 -28.618 1.00 0.00 C ATOM 1159 O PHE A 92 23.095 -12.021 -29.020 1.00 0.00 O ATOM 1160 CB PHE A 92 20.391 -13.269 -28.981 1.00 0.00 C ATOM 1161 CG PHE A 92 19.003 -13.644 -28.443 1.00 0.00 C ATOM 1162 CD1 PHE A 92 18.292 -12.781 -27.610 1.00 0.00 C ATOM 1163 CD2 PHE A 92 18.415 -14.865 -28.771 1.00 0.00 C ATOM 1164 CE1 PHE A 92 17.046 -13.125 -27.128 1.00 0.00 C ATOM 1165 CE2 PHE A 92 17.167 -15.207 -28.287 1.00 0.00 C ATOM 1166 CZ PHE A 92 16.480 -14.338 -27.469 1.00 0.00 C ATOM 0 H PHE A 92 20.911 -11.889 -26.890 1.00 0.00 H new ATOM 0 HA PHE A 92 21.535 -14.623 -27.768 1.00 0.00 H new ATOM 0 HB2 PHE A 92 20.397 -12.209 -29.234 1.00 0.00 H new ATOM 0 HB3 PHE A 92 20.572 -13.818 -29.905 1.00 0.00 H new ATOM 0 HD1 PHE A 92 18.723 -11.829 -27.338 1.00 0.00 H new ATOM 0 HD2 PHE A 92 18.943 -15.554 -29.413 1.00 0.00 H new ATOM 0 HE1 PHE A 92 16.512 -12.444 -26.482 1.00 0.00 H new ATOM 0 HE2 PHE A 92 16.729 -16.158 -28.551 1.00 0.00 H new ATOM 0 HZ PHE A 92 15.502 -14.604 -27.095 1.00 0.00 H new ATOM 1176 N ASN A 93 23.818 -14.143 -28.679 1.00 0.00 N ATOM 1177 CA ASN A 93 25.200 -13.949 -29.148 1.00 0.00 C ATOM 1178 C ASN A 93 25.382 -14.590 -30.523 1.00 0.00 C ATOM 1179 O ASN A 93 25.540 -15.813 -30.631 1.00 0.00 O ATOM 1180 CB ASN A 93 26.197 -14.576 -28.132 1.00 0.00 C ATOM 1181 CG ASN A 93 26.251 -13.843 -26.793 1.00 0.00 C ATOM 1182 OD1 ASN A 93 26.309 -14.463 -25.736 1.00 0.00 O ATOM 1183 ND2 ASN A 93 26.298 -12.521 -26.837 1.00 0.00 N ATOM 0 H ASN A 93 23.621 -15.104 -28.399 1.00 0.00 H new ATOM 0 HA ASN A 93 25.400 -12.881 -29.228 1.00 0.00 H new ATOM 0 HB2 ASN A 93 25.918 -15.615 -27.956 1.00 0.00 H new ATOM 0 HB3 ASN A 93 27.194 -14.584 -28.572 1.00 0.00 H new ATOM 0 HD21 ASN A 93 26.385 -11.985 -25.974 1.00 0.00 H new ATOM 0 HD22 ASN A 93 26.247 -12.038 -27.734 1.00 0.00 H new ATOM 1190 N LEU A 94 25.309 -13.767 -31.572 1.00 0.00 N ATOM 1191 CA LEU A 94 25.653 -14.190 -32.933 1.00 0.00 C ATOM 1192 C LEU A 94 27.164 -14.432 -33.023 1.00 0.00 C ATOM 1193 O LEU A 94 27.943 -13.637 -32.470 1.00 0.00 O ATOM 1194 CB LEU A 94 25.199 -13.144 -33.985 1.00 0.00 C ATOM 1195 CG LEU A 94 23.670 -12.843 -34.000 1.00 0.00 C ATOM 1196 CD1 LEU A 94 23.274 -11.901 -35.156 1.00 0.00 C ATOM 1197 CD2 LEU A 94 22.853 -14.129 -34.062 1.00 0.00 C ATOM 0 H LEU A 94 25.012 -12.794 -31.504 1.00 0.00 H new ATOM 0 HA LEU A 94 25.125 -15.118 -33.154 1.00 0.00 H new ATOM 0 HB2 LEU A 94 25.735 -12.213 -33.803 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.494 -13.494 -34.974 1.00 0.00 H new ATOM 0 HG LEU A 94 23.444 -12.332 -33.064 1.00 0.00 H new ATOM 0 HD11 LEU A 94 22.200 -11.720 -35.126 1.00 0.00 H new ATOM 0 HD12 LEU A 94 23.805 -10.955 -35.052 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.538 -12.362 -36.108 1.00 0.00 H new ATOM 0 HD21 LEU A 94 21.791 -13.885 -34.071 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.107 -14.678 -34.969 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.076 -14.744 -33.191 1.00 0.00 H new ATOM 1209 N PRO A 95 27.606 -15.533 -33.708 1.00 0.00 N ATOM 1210 CA PRO A 95 29.029 -15.872 -33.802 1.00 0.00 C ATOM 1211 C PRO A 95 29.791 -14.867 -34.672 1.00 0.00 C ATOM 1212 O PRO A 95 29.213 -14.198 -35.550 1.00 0.00 O ATOM 1213 CB PRO A 95 29.023 -17.280 -34.436 1.00 0.00 C ATOM 1214 CG PRO A 95 27.785 -17.302 -35.262 1.00 0.00 C ATOM 1215 CD PRO A 95 26.765 -16.505 -34.473 1.00 0.00 C ATOM 0 HA PRO A 95 29.533 -15.846 -32.836 1.00 0.00 H new ATOM 0 HB2 PRO A 95 29.911 -17.446 -35.045 1.00 0.00 H new ATOM 0 HB3 PRO A 95 29.008 -18.060 -33.675 1.00 0.00 H new ATOM 0 HG2 PRO A 95 27.958 -16.858 -36.242 1.00 0.00 H new ATOM 0 HG3 PRO A 95 27.442 -18.323 -35.430 1.00 0.00 H new ATOM 0 HD2 PRO A 95 26.058 -15.997 -35.128 1.00 0.00 H new ATOM 0 HD3 PRO A 95 26.182 -17.143 -33.809 1.00 0.00 H new ATOM 1223 N GLY A 96 31.088 -14.799 -34.414 1.00 0.00 N ATOM 1224 CA GLY A 96 31.986 -13.939 -35.161 1.00 0.00 C ATOM 1225 C GLY A 96 32.249 -14.484 -36.558 1.00 0.00 C ATOM 1226 O GLY A 96 31.968 -15.658 -36.840 1.00 0.00 O ATOM 0 H GLY A 96 31.546 -15.340 -33.680 1.00 0.00 H new ATOM 0 HA2 GLY A 96 31.557 -12.940 -35.234 1.00 0.00 H new ATOM 0 HA3 GLY A 96 32.929 -13.842 -34.624 1.00 0.00 H new ATOM 1230 N GLU A 97 32.806 -13.631 -37.422 1.00 0.00 N ATOM 1231 CA GLU A 97 33.141 -13.973 -38.825 1.00 0.00 C ATOM 1232 C GLU A 97 34.222 -15.084 -38.923 1.00 0.00 C ATOM 1233 O GLU A 97 34.415 -15.672 -39.992 1.00 0.00 O ATOM 1234 CB GLU A 97 33.602 -12.683 -39.556 1.00 0.00 C ATOM 1235 CG GLU A 97 34.825 -12.007 -38.901 1.00 0.00 C ATOM 1236 CD GLU A 97 35.184 -10.654 -39.522 1.00 0.00 C ATOM 1237 OE1 GLU A 97 35.837 -10.629 -40.589 1.00 0.00 O ATOM 1238 OE2 GLU A 97 34.810 -9.606 -38.948 1.00 0.00 O ATOM 0 H GLU A 97 33.043 -12.671 -37.173 1.00 0.00 H new ATOM 0 HA GLU A 97 32.249 -14.376 -39.305 1.00 0.00 H new ATOM 0 HB2 GLU A 97 33.843 -12.928 -40.590 1.00 0.00 H new ATOM 0 HB3 GLU A 97 32.775 -11.974 -39.581 1.00 0.00 H new ATOM 0 HG2 GLU A 97 34.627 -11.868 -37.838 1.00 0.00 H new ATOM 0 HG3 GLU A 97 35.684 -12.673 -38.981 1.00 0.00 H new ATOM 1245 N ASN A 98 34.920 -15.357 -37.794 1.00 0.00 N ATOM 1246 CA ASN A 98 35.978 -16.388 -37.703 1.00 0.00 C ATOM 1247 C ASN A 98 35.539 -17.595 -36.832 1.00 0.00 C ATOM 1248 O ASN A 98 36.355 -18.479 -36.562 1.00 0.00 O ATOM 1249 CB ASN A 98 37.286 -15.760 -37.133 1.00 0.00 C ATOM 1250 CG ASN A 98 37.843 -14.630 -38.009 1.00 0.00 C ATOM 1251 OD1 ASN A 98 37.514 -13.391 -37.690 1.00 0.00 O flip ATOM 1252 ND2 ASN A 98 38.572 -14.872 -38.965 1.00 0.00 N flip ATOM 0 H ASN A 98 34.762 -14.863 -36.916 1.00 0.00 H new ATOM 0 HA ASN A 98 36.163 -16.762 -38.710 1.00 0.00 H new ATOM 0 HB2 ASN A 98 37.090 -15.373 -36.133 1.00 0.00 H new ATOM 0 HB3 ASN A 98 38.042 -16.539 -37.031 1.00 0.00 H new ATOM 0 HD21 ASN A 98 38.812 -15.837 -39.192 1.00 0.00 H new ATOM 0 HD22 ASN A 98 38.938 -14.108 -39.533 1.00 0.00 H new ATOM 1259 N ASN A 99 34.255 -17.644 -36.400 1.00 0.00 N ATOM 1260 CA ASN A 99 33.717 -18.776 -35.595 1.00 0.00 C ATOM 1261 C ASN A 99 33.328 -19.931 -36.532 1.00 0.00 C ATOM 1262 O ASN A 99 32.349 -19.831 -37.286 1.00 0.00 O ATOM 1263 CB ASN A 99 32.493 -18.340 -34.731 1.00 0.00 C ATOM 1264 CG ASN A 99 32.833 -17.440 -33.529 1.00 0.00 C ATOM 1265 OD1 ASN A 99 33.794 -16.541 -33.671 1.00 0.00 O flip ATOM 1266 ND2 ASN A 99 32.189 -17.522 -32.485 1.00 0.00 N flip ATOM 0 H ASN A 99 33.570 -16.914 -36.594 1.00 0.00 H new ATOM 0 HA ASN A 99 34.496 -19.108 -34.908 1.00 0.00 H new ATOM 0 HB2 ASN A 99 31.785 -17.814 -35.371 1.00 0.00 H new ATOM 0 HB3 ASN A 99 31.989 -19.234 -34.365 1.00 0.00 H new ATOM 0 HD21 ASN A 99 31.452 -18.221 -32.394 1.00 0.00 H new ATOM 0 HD22 ASN A 99 32.392 -16.891 -31.710 1.00 0.00 H new ATOM 1273 N GLU A 100 34.102 -21.025 -36.461 1.00 0.00 N ATOM 1274 CA GLU A 100 34.013 -22.162 -37.398 1.00 0.00 C ATOM 1275 C GLU A 100 32.847 -23.114 -37.068 1.00 0.00 C ATOM 1276 O GLU A 100 32.520 -23.991 -37.870 1.00 0.00 O ATOM 1277 CB GLU A 100 35.373 -22.917 -37.407 1.00 0.00 C ATOM 1278 CG GLU A 100 36.586 -22.019 -37.738 1.00 0.00 C ATOM 1279 CD GLU A 100 36.460 -21.311 -39.102 1.00 0.00 C ATOM 1280 OE1 GLU A 100 36.674 -21.974 -40.138 1.00 0.00 O ATOM 1281 OE2 GLU A 100 36.137 -20.103 -39.147 1.00 0.00 O ATOM 0 H GLU A 100 34.817 -21.149 -35.744 1.00 0.00 H new ATOM 0 HA GLU A 100 33.803 -21.769 -38.393 1.00 0.00 H new ATOM 0 HB2 GLU A 100 35.529 -23.376 -36.431 1.00 0.00 H new ATOM 0 HB3 GLU A 100 35.323 -23.726 -38.135 1.00 0.00 H new ATOM 0 HG2 GLU A 100 36.700 -21.269 -36.955 1.00 0.00 H new ATOM 0 HG3 GLU A 100 37.492 -22.625 -37.732 1.00 0.00 H new ATOM 1288 N ALA A 101 32.236 -22.942 -35.881 1.00 0.00 N ATOM 1289 CA ALA A 101 31.041 -23.700 -35.475 1.00 0.00 C ATOM 1290 C ALA A 101 29.794 -23.180 -36.212 1.00 0.00 C ATOM 1291 O ALA A 101 28.932 -23.967 -36.628 1.00 0.00 O ATOM 1292 CB ALA A 101 30.856 -23.620 -33.955 1.00 0.00 C ATOM 0 H ALA A 101 32.557 -22.275 -35.179 1.00 0.00 H new ATOM 0 HA ALA A 101 31.179 -24.746 -35.749 1.00 0.00 H new ATOM 0 HB1 ALA A 101 29.969 -24.184 -33.666 1.00 0.00 H new ATOM 0 HB2 ALA A 101 31.731 -24.041 -33.459 1.00 0.00 H new ATOM 0 HB3 ALA A 101 30.736 -22.578 -33.657 1.00 0.00 H new ATOM 1298 N GLY A 102 29.733 -21.842 -36.373 1.00 0.00 N ATOM 1299 CA GLY A 102 28.638 -21.175 -37.080 1.00 0.00 C ATOM 1300 C GLY A 102 27.281 -21.360 -36.402 1.00 0.00 C ATOM 1301 O GLY A 102 26.278 -21.652 -37.066 1.00 0.00 O ATOM 0 H GLY A 102 30.442 -21.202 -36.015 1.00 0.00 H new ATOM 0 HA2 GLY A 102 28.858 -20.110 -37.154 1.00 0.00 H new ATOM 0 HA3 GLY A 102 28.584 -21.561 -38.098 1.00 0.00 H new ATOM 1305 N GLN A 103 27.265 -21.229 -35.065 1.00 0.00 N ATOM 1306 CA GLN A 103 26.044 -21.352 -34.242 1.00 0.00 C ATOM 1307 C GLN A 103 25.885 -20.127 -33.334 1.00 0.00 C ATOM 1308 O GLN A 103 26.874 -19.533 -32.891 1.00 0.00 O ATOM 1309 CB GLN A 103 26.069 -22.639 -33.368 1.00 0.00 C ATOM 1310 CG GLN A 103 26.142 -23.967 -34.159 1.00 0.00 C ATOM 1311 CD GLN A 103 25.803 -25.206 -33.323 1.00 0.00 C ATOM 1312 OE1 GLN A 103 24.820 -25.086 -32.440 1.00 0.00 O flip ATOM 1313 NE2 GLN A 103 26.370 -26.281 -33.520 1.00 0.00 N flip ATOM 0 H GLN A 103 28.104 -21.033 -34.518 1.00 0.00 H new ATOM 0 HA GLN A 103 25.198 -21.415 -34.926 1.00 0.00 H new ATOM 0 HB2 GLN A 103 26.925 -22.587 -32.696 1.00 0.00 H new ATOM 0 HB3 GLN A 103 25.175 -22.654 -32.745 1.00 0.00 H new ATOM 0 HG2 GLN A 103 25.457 -23.913 -35.005 1.00 0.00 H new ATOM 0 HG3 GLN A 103 27.146 -24.080 -34.568 1.00 0.00 H new ATOM 0 HE21 GLN A 103 27.123 -26.342 -34.206 1.00 0.00 H new ATOM 0 HE22 GLN A 103 26.087 -27.110 -32.998 1.00 0.00 H new ATOM 1322 N VAL A 104 24.622 -19.779 -33.068 1.00 0.00 N ATOM 1323 CA VAL A 104 24.230 -18.681 -32.174 1.00 0.00 C ATOM 1324 C VAL A 104 24.048 -19.217 -30.746 1.00 0.00 C ATOM 1325 O VAL A 104 23.497 -20.299 -30.557 1.00 0.00 O ATOM 1326 CB VAL A 104 22.899 -18.029 -32.683 1.00 0.00 C ATOM 1327 CG1 VAL A 104 22.415 -16.881 -31.764 1.00 0.00 C ATOM 1328 CG2 VAL A 104 23.053 -17.575 -34.150 1.00 0.00 C ATOM 0 H VAL A 104 23.823 -20.264 -33.478 1.00 0.00 H new ATOM 0 HA VAL A 104 25.012 -17.922 -32.170 1.00 0.00 H new ATOM 0 HB VAL A 104 22.118 -18.789 -32.644 1.00 0.00 H new ATOM 0 HG11 VAL A 104 21.490 -16.463 -32.161 1.00 0.00 H new ATOM 0 HG12 VAL A 104 22.237 -17.268 -30.761 1.00 0.00 H new ATOM 0 HG13 VAL A 104 23.177 -16.102 -31.723 1.00 0.00 H new ATOM 0 HG21 VAL A 104 22.121 -17.124 -34.491 1.00 0.00 H new ATOM 0 HG22 VAL A 104 23.858 -16.844 -34.222 1.00 0.00 H new ATOM 0 HG23 VAL A 104 23.289 -18.437 -34.775 1.00 0.00 H new ATOM 1338 N ILE A 105 24.498 -18.439 -29.750 1.00 0.00 N ATOM 1339 CA ILE A 105 24.488 -18.846 -28.331 1.00 0.00 C ATOM 1340 C ILE A 105 23.453 -17.991 -27.576 1.00 0.00 C ATOM 1341 O ILE A 105 23.623 -16.776 -27.465 1.00 0.00 O ATOM 1342 CB ILE A 105 25.918 -18.675 -27.648 1.00 0.00 C ATOM 1343 CG1 ILE A 105 27.014 -19.614 -28.284 1.00 0.00 C ATOM 1344 CG2 ILE A 105 25.842 -18.908 -26.115 1.00 0.00 C ATOM 1345 CD1 ILE A 105 27.487 -19.235 -29.682 1.00 0.00 C ATOM 0 H ILE A 105 24.881 -17.506 -29.903 1.00 0.00 H new ATOM 0 HA ILE A 105 24.227 -19.903 -28.283 1.00 0.00 H new ATOM 0 HB ILE A 105 26.221 -17.645 -27.836 1.00 0.00 H new ATOM 0 HG12 ILE A 105 27.879 -19.631 -27.621 1.00 0.00 H new ATOM 0 HG13 ILE A 105 26.619 -20.629 -28.318 1.00 0.00 H new ATOM 0 HG21 ILE A 105 26.833 -18.784 -25.679 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.157 -18.186 -25.671 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.482 -19.918 -25.918 1.00 0.00 H new ATOM 0 HD11 ILE A 105 28.239 -19.949 -30.018 1.00 0.00 H new ATOM 0 HD12 ILE A 105 26.641 -19.249 -30.369 1.00 0.00 H new ATOM 0 HD13 ILE A 105 27.920 -18.235 -29.661 1.00 0.00 H new ATOM 1357 N VAL A 106 22.382 -18.622 -27.072 1.00 0.00 N ATOM 1358 CA VAL A 106 21.404 -17.953 -26.197 1.00 0.00 C ATOM 1359 C VAL A 106 21.818 -18.164 -24.719 1.00 0.00 C ATOM 1360 O VAL A 106 22.096 -19.294 -24.286 1.00 0.00 O ATOM 1361 CB VAL A 106 19.922 -18.446 -26.471 1.00 0.00 C ATOM 1362 CG1 VAL A 106 19.539 -18.221 -27.956 1.00 0.00 C ATOM 1363 CG2 VAL A 106 19.703 -19.924 -26.069 1.00 0.00 C ATOM 0 H VAL A 106 22.169 -19.602 -27.257 1.00 0.00 H new ATOM 0 HA VAL A 106 21.408 -16.886 -26.419 1.00 0.00 H new ATOM 0 HB VAL A 106 19.266 -17.846 -25.840 1.00 0.00 H new ATOM 0 HG11 VAL A 106 18.519 -18.565 -28.125 1.00 0.00 H new ATOM 0 HG12 VAL A 106 19.607 -17.159 -28.193 1.00 0.00 H new ATOM 0 HG13 VAL A 106 20.221 -18.780 -28.596 1.00 0.00 H new ATOM 0 HG21 VAL A 106 18.672 -20.209 -26.278 1.00 0.00 H new ATOM 0 HG22 VAL A 106 20.378 -20.560 -26.641 1.00 0.00 H new ATOM 0 HG23 VAL A 106 19.904 -20.045 -25.005 1.00 0.00 H new ATOM 1373 N ARG A 107 21.922 -17.053 -23.980 1.00 0.00 N ATOM 1374 CA ARG A 107 22.288 -17.044 -22.551 1.00 0.00 C ATOM 1375 C ARG A 107 21.148 -16.400 -21.753 1.00 0.00 C ATOM 1376 O ARG A 107 21.089 -15.180 -21.642 1.00 0.00 O ATOM 1377 CB ARG A 107 23.631 -16.266 -22.359 1.00 0.00 C ATOM 1378 CG ARG A 107 24.065 -16.012 -20.889 1.00 0.00 C ATOM 1379 CD ARG A 107 24.364 -17.294 -20.102 1.00 0.00 C ATOM 1380 NE ARG A 107 24.821 -16.992 -18.729 1.00 0.00 N ATOM 1381 CZ ARG A 107 25.929 -17.472 -18.142 1.00 0.00 C ATOM 1382 NH1 ARG A 107 26.715 -18.344 -18.764 1.00 0.00 N ATOM 1383 NH2 ARG A 107 26.234 -17.082 -16.912 1.00 0.00 N ATOM 0 H ARG A 107 21.753 -16.121 -24.359 1.00 0.00 H new ATOM 0 HA ARG A 107 22.436 -18.061 -22.188 1.00 0.00 H new ATOM 0 HB2 ARG A 107 24.424 -16.820 -22.861 1.00 0.00 H new ATOM 0 HB3 ARG A 107 23.546 -15.304 -22.864 1.00 0.00 H new ATOM 0 HG2 ARG A 107 24.953 -15.380 -20.886 1.00 0.00 H new ATOM 0 HG3 ARG A 107 23.277 -15.458 -20.378 1.00 0.00 H new ATOM 0 HD2 ARG A 107 23.468 -17.914 -20.061 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.128 -17.872 -20.622 1.00 0.00 H new ATOM 0 HE ARG A 107 24.241 -16.361 -18.176 1.00 0.00 H new ATOM 0 HH11 ARG A 107 26.481 -18.661 -19.705 1.00 0.00 H new ATOM 0 HH12 ARG A 107 27.552 -18.697 -18.301 1.00 0.00 H new ATOM 0 HH21 ARG A 107 25.629 -16.424 -16.421 1.00 0.00 H new ATOM 0 HH22 ARG A 107 27.073 -17.440 -16.457 1.00 0.00 H new ATOM 1397 N VAL A 108 20.233 -17.226 -21.219 1.00 0.00 N ATOM 1398 CA VAL A 108 19.078 -16.741 -20.440 1.00 0.00 C ATOM 1399 C VAL A 108 19.382 -16.930 -18.942 1.00 0.00 C ATOM 1400 O VAL A 108 19.333 -18.047 -18.422 1.00 0.00 O ATOM 1401 CB VAL A 108 17.744 -17.488 -20.840 1.00 0.00 C ATOM 1402 CG1 VAL A 108 16.498 -16.796 -20.242 1.00 0.00 C ATOM 1403 CG2 VAL A 108 17.616 -17.645 -22.376 1.00 0.00 C ATOM 0 H VAL A 108 20.271 -18.241 -21.313 1.00 0.00 H new ATOM 0 HA VAL A 108 18.922 -15.685 -20.659 1.00 0.00 H new ATOM 0 HB VAL A 108 17.799 -18.488 -20.411 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.602 -17.340 -20.540 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.573 -16.788 -19.155 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.440 -15.771 -20.609 1.00 0.00 H new ATOM 0 HG21 VAL A 108 16.687 -18.163 -22.613 1.00 0.00 H new ATOM 0 HG22 VAL A 108 17.612 -16.660 -22.843 1.00 0.00 H new ATOM 0 HG23 VAL A 108 18.460 -18.222 -22.754 1.00 0.00 H new ATOM 1413 N SER A 109 19.715 -15.826 -18.263 1.00 0.00 N ATOM 1414 CA SER A 109 20.143 -15.829 -16.848 1.00 0.00 C ATOM 1415 C SER A 109 19.092 -15.116 -15.984 1.00 0.00 C ATOM 1416 O SER A 109 18.448 -14.186 -16.463 1.00 0.00 O ATOM 1417 CB SER A 109 21.512 -15.123 -16.744 1.00 0.00 C ATOM 1418 OG SER A 109 22.436 -15.655 -17.682 1.00 0.00 O ATOM 0 H SER A 109 19.697 -14.895 -18.678 1.00 0.00 H new ATOM 0 HA SER A 109 20.239 -16.852 -16.485 1.00 0.00 H new ATOM 0 HB2 SER A 109 21.387 -14.054 -16.918 1.00 0.00 H new ATOM 0 HB3 SER A 109 21.908 -15.237 -15.735 1.00 0.00 H new ATOM 0 HG SER A 109 22.966 -14.927 -18.068 1.00 0.00 H new ATOM 1424 N LYS A 110 18.923 -15.544 -14.718 1.00 0.00 N ATOM 1425 CA LYS A 110 17.907 -14.970 -13.817 1.00 0.00 C ATOM 1426 C LYS A 110 18.317 -15.187 -12.349 1.00 0.00 C ATOM 1427 O LYS A 110 18.062 -16.256 -11.780 1.00 0.00 O ATOM 1428 CB LYS A 110 16.516 -15.585 -14.125 1.00 0.00 C ATOM 1429 CG LYS A 110 15.318 -14.924 -13.402 1.00 0.00 C ATOM 1430 CD LYS A 110 13.976 -15.571 -13.808 1.00 0.00 C ATOM 1431 CE LYS A 110 12.757 -14.855 -13.233 1.00 0.00 C ATOM 1432 NZ LYS A 110 11.503 -15.363 -13.839 1.00 0.00 N ATOM 0 H LYS A 110 19.479 -16.288 -14.296 1.00 0.00 H new ATOM 0 HA LYS A 110 17.838 -13.895 -13.984 1.00 0.00 H new ATOM 0 HB2 LYS A 110 16.344 -15.530 -15.200 1.00 0.00 H new ATOM 0 HB3 LYS A 110 16.539 -16.642 -13.860 1.00 0.00 H new ATOM 0 HG2 LYS A 110 15.452 -15.010 -12.324 1.00 0.00 H new ATOM 0 HG3 LYS A 110 15.294 -13.860 -13.636 1.00 0.00 H new ATOM 0 HD2 LYS A 110 13.901 -15.583 -14.895 1.00 0.00 H new ATOM 0 HD3 LYS A 110 13.967 -16.609 -13.477 1.00 0.00 H new ATOM 0 HE2 LYS A 110 12.725 -14.996 -12.153 1.00 0.00 H new ATOM 0 HE3 LYS A 110 12.843 -13.783 -13.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 10.717 -15.235 -13.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.302 -14.837 -14.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.609 -16.374 -14.059 1.00 0.00 H new ATOM 1446 N GLY A 111 18.991 -14.173 -11.767 1.00 0.00 N ATOM 1447 CA GLY A 111 19.424 -14.208 -10.368 1.00 0.00 C ATOM 1448 C GLY A 111 20.478 -15.285 -10.107 1.00 0.00 C ATOM 1449 O GLY A 111 21.614 -15.159 -10.567 1.00 0.00 O ATOM 0 H GLY A 111 19.246 -13.315 -12.256 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.828 -13.234 -10.092 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.560 -14.387 -9.728 1.00 0.00 H new ATOM 1453 N ASP A 112 20.080 -16.361 -9.399 1.00 0.00 N ATOM 1454 CA ASP A 112 20.966 -17.508 -9.084 1.00 0.00 C ATOM 1455 C ASP A 112 21.114 -18.442 -10.306 1.00 0.00 C ATOM 1456 O ASP A 112 22.059 -19.235 -10.387 1.00 0.00 O ATOM 1457 CB ASP A 112 20.403 -18.304 -7.874 1.00 0.00 C ATOM 1458 CG ASP A 112 19.075 -19.025 -8.182 1.00 0.00 C ATOM 1459 OD1 ASP A 112 18.057 -18.348 -8.450 1.00 0.00 O ATOM 1460 OD2 ASP A 112 19.039 -20.269 -8.185 1.00 0.00 O ATOM 0 H ASP A 112 19.135 -16.463 -9.028 1.00 0.00 H new ATOM 0 HA ASP A 112 21.951 -17.117 -8.828 1.00 0.00 H new ATOM 0 HB2 ASP A 112 21.142 -19.039 -7.556 1.00 0.00 H new ATOM 0 HB3 ASP A 112 20.252 -17.622 -7.038 1.00 0.00 H new ATOM 1465 N HIS A 113 20.155 -18.341 -11.242 1.00 0.00 N ATOM 1466 CA HIS A 113 20.137 -19.134 -12.481 1.00 0.00 C ATOM 1467 C HIS A 113 21.004 -18.467 -13.564 1.00 0.00 C ATOM 1468 O HIS A 113 21.150 -17.238 -13.596 1.00 0.00 O ATOM 1469 CB HIS A 113 18.687 -19.307 -13.000 1.00 0.00 C ATOM 1470 CG HIS A 113 17.873 -20.377 -12.313 1.00 0.00 C ATOM 1471 ND1 HIS A 113 17.815 -20.535 -10.949 1.00 0.00 N ATOM 1472 CD2 HIS A 113 17.079 -21.346 -12.829 1.00 0.00 C ATOM 1473 CE1 HIS A 113 17.023 -21.547 -10.656 1.00 0.00 C ATOM 1474 NE2 HIS A 113 16.561 -22.055 -11.780 1.00 0.00 N ATOM 0 H HIS A 113 19.365 -17.701 -11.158 1.00 0.00 H new ATOM 0 HA HIS A 113 20.549 -20.118 -12.257 1.00 0.00 H new ATOM 0 HB2 HIS A 113 18.166 -18.355 -12.895 1.00 0.00 H new ATOM 0 HB3 HIS A 113 18.726 -19.533 -14.066 1.00 0.00 H new ATOM 0 HD2 HIS A 113 16.890 -21.526 -13.877 1.00 0.00 H new ATOM 0 HE1 HIS A 113 16.792 -21.900 -9.662 1.00 0.00 H new ATOM 0 HE2 HIS A 113 15.922 -22.847 -11.856 1.00 0.00 H new ATOM 1483 N SER A 114 21.542 -19.303 -14.453 1.00 0.00 N ATOM 1484 CA SER A 114 22.358 -18.890 -15.598 1.00 0.00 C ATOM 1485 C SER A 114 22.361 -20.056 -16.604 1.00 0.00 C ATOM 1486 O SER A 114 23.083 -21.048 -16.426 1.00 0.00 O ATOM 1487 CB SER A 114 23.786 -18.511 -15.120 1.00 0.00 C ATOM 1488 OG SER A 114 24.333 -19.509 -14.269 1.00 0.00 O ATOM 0 H SER A 114 21.419 -20.314 -14.396 1.00 0.00 H new ATOM 0 HA SER A 114 21.951 -18.003 -16.084 1.00 0.00 H new ATOM 0 HB2 SER A 114 24.435 -18.373 -15.984 1.00 0.00 H new ATOM 0 HB3 SER A 114 23.753 -17.559 -14.591 1.00 0.00 H new ATOM 0 HG SER A 114 24.166 -20.395 -14.654 1.00 0.00 H new ATOM 1494 N GLU A 115 21.507 -19.946 -17.630 1.00 0.00 N ATOM 1495 CA GLU A 115 21.207 -21.044 -18.568 1.00 0.00 C ATOM 1496 C GLU A 115 21.802 -20.694 -19.940 1.00 0.00 C ATOM 1497 O GLU A 115 21.686 -19.544 -20.378 1.00 0.00 O ATOM 1498 CB GLU A 115 19.654 -21.249 -18.683 1.00 0.00 C ATOM 1499 CG GLU A 115 18.870 -21.194 -17.344 1.00 0.00 C ATOM 1500 CD GLU A 115 19.339 -22.205 -16.282 1.00 0.00 C ATOM 1501 OE1 GLU A 115 19.152 -23.419 -16.484 1.00 0.00 O ATOM 1502 OE2 GLU A 115 19.879 -21.793 -15.227 1.00 0.00 O ATOM 0 H GLU A 115 20.999 -19.086 -17.837 1.00 0.00 H new ATOM 0 HA GLU A 115 21.646 -21.973 -18.203 1.00 0.00 H new ATOM 0 HB2 GLU A 115 19.253 -20.486 -19.350 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.467 -22.214 -19.154 1.00 0.00 H new ATOM 0 HG2 GLU A 115 18.953 -20.189 -16.931 1.00 0.00 H new ATOM 0 HG3 GLU A 115 17.814 -21.367 -17.550 1.00 0.00 H new ATOM 1509 N THR A 116 22.435 -21.673 -20.606 1.00 0.00 N ATOM 1510 CA THR A 116 23.072 -21.466 -21.919 1.00 0.00 C ATOM 1511 C THR A 116 22.805 -22.669 -22.842 1.00 0.00 C ATOM 1512 O THR A 116 22.934 -23.826 -22.418 1.00 0.00 O ATOM 1513 CB THR A 116 24.618 -21.256 -21.789 1.00 0.00 C ATOM 1514 OG1 THR A 116 24.907 -20.282 -20.776 1.00 0.00 O ATOM 1515 CG2 THR A 116 25.243 -20.794 -23.115 1.00 0.00 C ATOM 0 H THR A 116 22.520 -22.626 -20.253 1.00 0.00 H new ATOM 0 HA THR A 116 22.635 -20.564 -22.348 1.00 0.00 H new ATOM 0 HB THR A 116 25.050 -22.219 -21.516 1.00 0.00 H new ATOM 0 HG1 THR A 116 25.835 -20.385 -20.478 1.00 0.00 H new ATOM 0 HG21 THR A 116 26.317 -20.659 -22.984 1.00 0.00 H new ATOM 0 HG22 THR A 116 25.063 -21.546 -23.884 1.00 0.00 H new ATOM 0 HG23 THR A 116 24.793 -19.849 -23.419 1.00 0.00 H new ATOM 1523 N ARG A 117 22.441 -22.371 -24.100 1.00 0.00 N ATOM 1524 CA ARG A 117 22.207 -23.377 -25.150 1.00 0.00 C ATOM 1525 C ARG A 117 22.447 -22.722 -26.516 1.00 0.00 C ATOM 1526 O ARG A 117 22.497 -21.490 -26.620 1.00 0.00 O ATOM 1527 CB ARG A 117 20.770 -23.951 -25.027 1.00 0.00 C ATOM 1528 CG ARG A 117 20.451 -25.187 -25.901 1.00 0.00 C ATOM 1529 CD ARG A 117 19.067 -25.775 -25.590 1.00 0.00 C ATOM 1530 NE ARG A 117 18.727 -26.913 -26.454 1.00 0.00 N ATOM 1531 CZ ARG A 117 17.645 -27.695 -26.303 1.00 0.00 C ATOM 1532 NH1 ARG A 117 16.785 -27.489 -25.315 1.00 0.00 N ATOM 1533 NH2 ARG A 117 17.425 -28.682 -27.151 1.00 0.00 N ATOM 0 H ARG A 117 22.299 -21.413 -24.421 1.00 0.00 H new ATOM 0 HA ARG A 117 22.897 -24.214 -25.039 1.00 0.00 H new ATOM 0 HB2 ARG A 117 20.594 -24.214 -23.984 1.00 0.00 H new ATOM 0 HB3 ARG A 117 20.063 -23.161 -25.280 1.00 0.00 H new ATOM 0 HG2 ARG A 117 20.497 -24.907 -26.954 1.00 0.00 H new ATOM 0 HG3 ARG A 117 21.213 -25.950 -25.740 1.00 0.00 H new ATOM 0 HD2 ARG A 117 19.038 -26.094 -24.548 1.00 0.00 H new ATOM 0 HD3 ARG A 117 18.312 -24.997 -25.706 1.00 0.00 H new ATOM 0 HE ARG A 117 19.359 -27.125 -27.226 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.940 -26.727 -24.655 1.00 0.00 H new ATOM 0 HH12 ARG A 117 15.969 -28.092 -25.215 1.00 0.00 H new ATOM 0 HH21 ARG A 117 18.076 -28.850 -27.919 1.00 0.00 H new ATOM 0 HH22 ARG A 117 16.604 -29.277 -27.039 1.00 0.00 H new ATOM 1547 N GLU A 118 22.626 -23.540 -27.561 1.00 0.00 N ATOM 1548 CA GLU A 118 22.925 -23.057 -28.914 1.00 0.00 C ATOM 1549 C GLU A 118 21.827 -23.456 -29.906 1.00 0.00 C ATOM 1550 O GLU A 118 21.136 -24.465 -29.742 1.00 0.00 O ATOM 1551 CB GLU A 118 24.303 -23.589 -29.393 1.00 0.00 C ATOM 1552 CG GLU A 118 25.489 -23.146 -28.516 1.00 0.00 C ATOM 1553 CD GLU A 118 26.841 -23.628 -29.056 1.00 0.00 C ATOM 1554 OE1 GLU A 118 27.124 -24.842 -28.969 1.00 0.00 O ATOM 1555 OE2 GLU A 118 27.625 -22.810 -29.582 1.00 0.00 O ATOM 0 H GLU A 118 22.567 -24.556 -27.492 1.00 0.00 H new ATOM 0 HA GLU A 118 22.963 -21.968 -28.875 1.00 0.00 H new ATOM 0 HB2 GLU A 118 24.271 -24.678 -29.418 1.00 0.00 H new ATOM 0 HB3 GLU A 118 24.475 -23.252 -30.415 1.00 0.00 H new ATOM 0 HG2 GLU A 118 25.498 -22.058 -28.447 1.00 0.00 H new ATOM 0 HG3 GLU A 118 25.350 -23.528 -27.505 1.00 0.00 H new ATOM 1562 N ILE A 119 21.687 -22.605 -30.913 1.00 0.00 N ATOM 1563 CA ILE A 119 20.864 -22.808 -32.110 1.00 0.00 C ATOM 1564 C ILE A 119 21.775 -22.630 -33.343 1.00 0.00 C ATOM 1565 O ILE A 119 22.838 -22.016 -33.222 1.00 0.00 O ATOM 1566 CB ILE A 119 19.664 -21.766 -32.181 1.00 0.00 C ATOM 1567 CG1 ILE A 119 20.153 -20.334 -31.789 1.00 0.00 C ATOM 1568 CG2 ILE A 119 18.467 -22.217 -31.314 1.00 0.00 C ATOM 1569 CD1 ILE A 119 19.125 -19.229 -31.933 1.00 0.00 C ATOM 0 H ILE A 119 22.167 -21.705 -30.923 1.00 0.00 H new ATOM 0 HA ILE A 119 20.428 -23.806 -32.080 1.00 0.00 H new ATOM 0 HB ILE A 119 19.312 -21.729 -33.212 1.00 0.00 H new ATOM 0 HG12 ILE A 119 20.493 -20.356 -30.754 1.00 0.00 H new ATOM 0 HG13 ILE A 119 21.018 -20.084 -32.404 1.00 0.00 H new ATOM 0 HG21 ILE A 119 17.667 -21.481 -31.387 1.00 0.00 H new ATOM 0 HG22 ILE A 119 18.105 -23.183 -31.667 1.00 0.00 H new ATOM 0 HG23 ILE A 119 18.784 -22.306 -30.275 1.00 0.00 H new ATOM 0 HD11 ILE A 119 19.568 -18.279 -31.635 1.00 0.00 H new ATOM 0 HD12 ILE A 119 18.799 -19.168 -32.971 1.00 0.00 H new ATOM 0 HD13 ILE A 119 18.267 -19.445 -31.296 1.00 0.00 H new ATOM 1581 N PRO A 120 21.409 -23.190 -34.536 1.00 0.00 N ATOM 1582 CA PRO A 120 22.092 -22.856 -35.806 1.00 0.00 C ATOM 1583 C PRO A 120 22.053 -21.341 -36.106 1.00 0.00 C ATOM 1584 O PRO A 120 21.106 -20.644 -35.694 1.00 0.00 O ATOM 1585 CB PRO A 120 21.288 -23.640 -36.879 1.00 0.00 C ATOM 1586 CG PRO A 120 20.631 -24.757 -36.127 1.00 0.00 C ATOM 1587 CD PRO A 120 20.359 -24.222 -34.734 1.00 0.00 C ATOM 0 HA PRO A 120 23.149 -23.119 -35.778 1.00 0.00 H new ATOM 0 HB2 PRO A 120 20.549 -23.002 -37.364 1.00 0.00 H new ATOM 0 HB3 PRO A 120 21.943 -24.022 -37.662 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.706 -25.064 -36.614 1.00 0.00 H new ATOM 0 HG3 PRO A 120 21.277 -25.634 -36.089 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.359 -23.794 -34.659 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.426 -25.010 -33.983 1.00 0.00 H new ATOM 1595 N LEU A 121 23.078 -20.846 -36.826 1.00 0.00 N ATOM 1596 CA LEU A 121 23.081 -19.465 -37.356 1.00 0.00 C ATOM 1597 C LEU A 121 21.896 -19.318 -38.337 1.00 0.00 C ATOM 1598 O LEU A 121 21.247 -18.281 -38.372 1.00 0.00 O ATOM 1599 CB LEU A 121 24.447 -19.135 -38.054 1.00 0.00 C ATOM 1600 CG LEU A 121 24.986 -17.654 -37.962 1.00 0.00 C ATOM 1601 CD1 LEU A 121 26.344 -17.506 -38.701 1.00 0.00 C ATOM 1602 CD2 LEU A 121 23.968 -16.600 -38.471 1.00 0.00 C ATOM 0 H LEU A 121 23.916 -21.381 -37.055 1.00 0.00 H new ATOM 0 HA LEU A 121 22.966 -18.753 -36.539 1.00 0.00 H new ATOM 0 HB2 LEU A 121 25.206 -19.794 -37.632 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.354 -19.392 -39.109 1.00 0.00 H new ATOM 0 HG LEU A 121 25.138 -17.453 -36.901 1.00 0.00 H new ATOM 0 HD11 LEU A 121 26.691 -16.476 -38.621 1.00 0.00 H new ATOM 0 HD12 LEU A 121 27.079 -18.173 -38.249 1.00 0.00 H new ATOM 0 HD13 LEU A 121 26.216 -17.765 -39.752 1.00 0.00 H new ATOM 0 HD21 LEU A 121 24.400 -15.603 -38.381 1.00 0.00 H new ATOM 0 HD22 LEU A 121 23.730 -16.799 -39.516 1.00 0.00 H new ATOM 0 HD23 LEU A 121 23.057 -16.656 -37.875 1.00 0.00 H new ATOM 1614 N ALA A 122 21.610 -20.419 -39.069 1.00 0.00 N ATOM 1615 CA ALA A 122 20.528 -20.501 -40.061 1.00 0.00 C ATOM 1616 C ALA A 122 19.149 -20.276 -39.412 1.00 0.00 C ATOM 1617 O ALA A 122 18.289 -19.617 -39.998 1.00 0.00 O ATOM 1618 CB ALA A 122 20.579 -21.868 -40.774 1.00 0.00 C ATOM 0 H ALA A 122 22.138 -21.288 -38.981 1.00 0.00 H new ATOM 0 HA ALA A 122 20.674 -19.708 -40.795 1.00 0.00 H new ATOM 0 HB1 ALA A 122 19.776 -21.925 -41.509 1.00 0.00 H new ATOM 0 HB2 ALA A 122 21.539 -21.980 -41.277 1.00 0.00 H new ATOM 0 HB3 ALA A 122 20.458 -22.665 -40.041 1.00 0.00 H new ATOM 1624 N SER A 123 18.961 -20.839 -38.200 1.00 0.00 N ATOM 1625 CA SER A 123 17.711 -20.701 -37.428 1.00 0.00 C ATOM 1626 C SER A 123 17.460 -19.233 -37.048 1.00 0.00 C ATOM 1627 O SER A 123 16.395 -18.671 -37.348 1.00 0.00 O ATOM 1628 CB SER A 123 17.760 -21.589 -36.169 1.00 0.00 C ATOM 1629 OG SER A 123 17.862 -22.956 -36.523 1.00 0.00 O ATOM 0 H SER A 123 19.671 -21.401 -37.731 1.00 0.00 H new ATOM 0 HA SER A 123 16.882 -21.032 -38.054 1.00 0.00 H new ATOM 0 HB2 SER A 123 18.611 -21.304 -35.550 1.00 0.00 H new ATOM 0 HB3 SER A 123 16.863 -21.429 -35.570 1.00 0.00 H new ATOM 0 HG SER A 123 17.432 -23.505 -35.835 1.00 0.00 H new ATOM 1635 N PHE A 124 18.476 -18.605 -36.429 1.00 0.00 N ATOM 1636 CA PHE A 124 18.383 -17.202 -36.002 1.00 0.00 C ATOM 1637 C PHE A 124 18.259 -16.277 -37.219 1.00 0.00 C ATOM 1638 O PHE A 124 17.533 -15.297 -37.161 1.00 0.00 O ATOM 1639 CB PHE A 124 19.605 -16.791 -35.139 1.00 0.00 C ATOM 1640 CG PHE A 124 19.426 -15.466 -34.362 1.00 0.00 C ATOM 1641 CD1 PHE A 124 19.484 -14.221 -35.006 1.00 0.00 C ATOM 1642 CD2 PHE A 124 19.188 -15.471 -32.990 1.00 0.00 C ATOM 1643 CE1 PHE A 124 19.314 -13.045 -34.305 1.00 0.00 C ATOM 1644 CE2 PHE A 124 19.020 -14.293 -32.293 1.00 0.00 C ATOM 1645 CZ PHE A 124 19.082 -13.082 -32.949 1.00 0.00 C ATOM 0 H PHE A 124 19.369 -19.049 -36.215 1.00 0.00 H new ATOM 0 HA PHE A 124 17.488 -17.101 -35.388 1.00 0.00 H new ATOM 0 HB2 PHE A 124 19.816 -17.589 -34.427 1.00 0.00 H new ATOM 0 HB3 PHE A 124 20.478 -16.703 -35.786 1.00 0.00 H new ATOM 0 HD1 PHE A 124 19.665 -14.182 -36.070 1.00 0.00 H new ATOM 0 HD2 PHE A 124 19.134 -16.412 -32.463 1.00 0.00 H new ATOM 0 HE1 PHE A 124 19.363 -12.097 -34.820 1.00 0.00 H new ATOM 0 HE2 PHE A 124 18.839 -14.319 -31.229 1.00 0.00 H new ATOM 0 HZ PHE A 124 18.948 -12.162 -32.399 1.00 0.00 H new ATOM 1655 N GLU A 125 18.961 -16.614 -38.314 1.00 0.00 N ATOM 1656 CA GLU A 125 19.023 -15.761 -39.511 1.00 0.00 C ATOM 1657 C GLU A 125 17.645 -15.690 -40.176 1.00 0.00 C ATOM 1658 O GLU A 125 17.123 -14.598 -40.372 1.00 0.00 O ATOM 1659 CB GLU A 125 20.087 -16.269 -40.517 1.00 0.00 C ATOM 1660 CG GLU A 125 20.239 -15.389 -41.782 1.00 0.00 C ATOM 1661 CD GLU A 125 21.320 -15.892 -42.747 1.00 0.00 C ATOM 1662 OE1 GLU A 125 21.136 -16.978 -43.341 1.00 0.00 O ATOM 1663 OE2 GLU A 125 22.354 -15.212 -42.926 1.00 0.00 O ATOM 0 H GLU A 125 19.497 -17.478 -38.394 1.00 0.00 H new ATOM 0 HA GLU A 125 19.320 -14.760 -39.198 1.00 0.00 H new ATOM 0 HB2 GLU A 125 21.051 -16.327 -40.011 1.00 0.00 H new ATOM 0 HB3 GLU A 125 19.827 -17.282 -40.823 1.00 0.00 H new ATOM 0 HG2 GLU A 125 19.284 -15.351 -42.306 1.00 0.00 H new ATOM 0 HG3 GLU A 125 20.478 -14.369 -41.480 1.00 0.00 H new ATOM 1670 N LYS A 126 17.051 -16.872 -40.473 1.00 0.00 N ATOM 1671 CA LYS A 126 15.724 -16.958 -41.120 1.00 0.00 C ATOM 1672 C LYS A 126 14.670 -16.217 -40.272 1.00 0.00 C ATOM 1673 O LYS A 126 13.855 -15.479 -40.816 1.00 0.00 O ATOM 1674 CB LYS A 126 15.273 -18.438 -41.366 1.00 0.00 C ATOM 1675 CG LYS A 126 15.012 -19.254 -40.075 1.00 0.00 C ATOM 1676 CD LYS A 126 14.232 -20.567 -40.295 1.00 0.00 C ATOM 1677 CE LYS A 126 13.877 -21.268 -38.964 1.00 0.00 C ATOM 1678 NZ LYS A 126 12.988 -22.443 -39.159 1.00 0.00 N ATOM 0 H LYS A 126 17.473 -17.779 -40.273 1.00 0.00 H new ATOM 0 HA LYS A 126 15.811 -16.481 -42.096 1.00 0.00 H new ATOM 0 HB2 LYS A 126 14.364 -18.432 -41.967 1.00 0.00 H new ATOM 0 HB3 LYS A 126 16.039 -18.945 -41.952 1.00 0.00 H new ATOM 0 HG2 LYS A 126 15.969 -19.488 -39.609 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.459 -18.631 -39.372 1.00 0.00 H new ATOM 0 HD2 LYS A 126 13.316 -20.355 -40.847 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.827 -21.241 -40.911 1.00 0.00 H new ATOM 0 HE2 LYS A 126 14.794 -21.588 -38.470 1.00 0.00 H new ATOM 0 HE3 LYS A 126 13.390 -20.554 -38.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 12.903 -22.966 -38.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 12.047 -22.120 -39.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 13.391 -23.066 -39.887 1.00 0.00 H new ATOM 1692 N ILE A 127 14.743 -16.392 -38.928 1.00 0.00 N ATOM 1693 CA ILE A 127 13.794 -15.774 -37.986 1.00 0.00 C ATOM 1694 C ILE A 127 13.959 -14.239 -37.935 1.00 0.00 C ATOM 1695 O ILE A 127 12.983 -13.511 -38.095 1.00 0.00 O ATOM 1696 CB ILE A 127 13.952 -16.394 -36.542 1.00 0.00 C ATOM 1697 CG1 ILE A 127 13.439 -17.882 -36.504 1.00 0.00 C ATOM 1698 CG2 ILE A 127 13.266 -15.526 -35.458 1.00 0.00 C ATOM 1699 CD1 ILE A 127 11.968 -18.081 -36.848 1.00 0.00 C ATOM 0 H ILE A 127 15.458 -16.962 -38.476 1.00 0.00 H new ATOM 0 HA ILE A 127 12.789 -15.988 -38.349 1.00 0.00 H new ATOM 0 HB ILE A 127 15.017 -16.404 -36.309 1.00 0.00 H new ATOM 0 HG12 ILE A 127 14.039 -18.472 -37.197 1.00 0.00 H new ATOM 0 HG13 ILE A 127 13.618 -18.284 -35.507 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.400 -15.991 -34.481 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.713 -14.532 -35.451 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.202 -15.444 -35.678 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.721 -19.141 -36.791 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.351 -17.527 -36.141 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.778 -17.718 -37.858 1.00 0.00 H new ATOM 1711 N CYS A 128 15.200 -13.776 -37.719 1.00 0.00 N ATOM 1712 CA CYS A 128 15.515 -12.345 -37.518 1.00 0.00 C ATOM 1713 C CYS A 128 15.143 -11.539 -38.760 1.00 0.00 C ATOM 1714 O CYS A 128 14.413 -10.552 -38.664 1.00 0.00 O ATOM 1715 CB CYS A 128 17.008 -12.155 -37.181 1.00 0.00 C ATOM 1716 SG CYS A 128 17.503 -10.444 -36.917 1.00 0.00 S ATOM 0 H CYS A 128 16.019 -14.382 -37.678 1.00 0.00 H new ATOM 0 HA CYS A 128 14.926 -11.981 -36.676 1.00 0.00 H new ATOM 0 HB2 CYS A 128 17.241 -12.730 -36.285 1.00 0.00 H new ATOM 0 HB3 CYS A 128 17.606 -12.572 -37.991 1.00 0.00 H new ATOM 0 HG CYS A 128 18.702 -10.412 -36.415 1.00 0.00 H new ATOM 1722 N ARG A 129 15.610 -12.027 -39.923 1.00 0.00 N ATOM 1723 CA ARG A 129 15.303 -11.444 -41.246 1.00 0.00 C ATOM 1724 C ARG A 129 13.785 -11.432 -41.499 1.00 0.00 C ATOM 1725 O ARG A 129 13.248 -10.431 -41.977 1.00 0.00 O ATOM 1726 CB ARG A 129 16.026 -12.238 -42.371 1.00 0.00 C ATOM 1727 CG ARG A 129 17.571 -12.212 -42.290 1.00 0.00 C ATOM 1728 CD ARG A 129 18.184 -10.854 -42.656 1.00 0.00 C ATOM 1729 NE ARG A 129 19.659 -10.861 -42.533 1.00 0.00 N ATOM 1730 CZ ARG A 129 20.517 -11.545 -43.321 1.00 0.00 C ATOM 1731 NH1 ARG A 129 20.082 -12.303 -44.331 1.00 0.00 N ATOM 1732 NH2 ARG A 129 21.821 -11.449 -43.100 1.00 0.00 N ATOM 0 H ARG A 129 16.217 -12.845 -39.974 1.00 0.00 H new ATOM 0 HA ARG A 129 15.663 -10.415 -41.254 1.00 0.00 H new ATOM 0 HB2 ARG A 129 15.691 -13.275 -42.338 1.00 0.00 H new ATOM 0 HB3 ARG A 129 15.719 -11.835 -43.336 1.00 0.00 H new ATOM 0 HG2 ARG A 129 17.878 -12.479 -41.279 1.00 0.00 H new ATOM 0 HG3 ARG A 129 17.974 -12.974 -42.957 1.00 0.00 H new ATOM 0 HD2 ARG A 129 17.907 -10.594 -43.678 1.00 0.00 H new ATOM 0 HD3 ARG A 129 17.770 -10.082 -42.007 1.00 0.00 H new ATOM 0 HE ARG A 129 20.065 -10.298 -41.785 1.00 0.00 H new ATOM 0 HH11 ARG A 129 19.082 -12.375 -44.521 1.00 0.00 H new ATOM 0 HH12 ARG A 129 20.749 -12.810 -44.912 1.00 0.00 H new ATOM 0 HH21 ARG A 129 22.168 -10.863 -42.341 1.00 0.00 H new ATOM 0 HH22 ARG A 129 22.477 -11.961 -43.689 1.00 0.00 H new ATOM 1746 N ALA A 130 13.104 -12.549 -41.138 1.00 0.00 N ATOM 1747 CA ALA A 130 11.636 -12.671 -41.273 1.00 0.00 C ATOM 1748 C ALA A 130 10.914 -11.618 -40.422 1.00 0.00 C ATOM 1749 O ALA A 130 9.956 -11.035 -40.881 1.00 0.00 O ATOM 1750 CB ALA A 130 11.146 -14.082 -40.906 1.00 0.00 C ATOM 0 H ALA A 130 13.553 -13.379 -40.750 1.00 0.00 H new ATOM 0 HA ALA A 130 11.395 -12.495 -42.321 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.063 -14.132 -41.018 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.613 -14.813 -41.567 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.415 -14.303 -39.873 1.00 0.00 H new ATOM 1756 N LEU A 131 11.404 -11.367 -39.193 1.00 0.00 N ATOM 1757 CA LEU A 131 10.813 -10.351 -38.280 1.00 0.00 C ATOM 1758 C LEU A 131 11.005 -8.926 -38.850 1.00 0.00 C ATOM 1759 O LEU A 131 10.093 -8.098 -38.772 1.00 0.00 O ATOM 1760 CB LEU A 131 11.414 -10.479 -36.834 1.00 0.00 C ATOM 1761 CG LEU A 131 10.629 -11.400 -35.824 1.00 0.00 C ATOM 1762 CD1 LEU A 131 10.391 -12.826 -36.377 1.00 0.00 C ATOM 1763 CD2 LEU A 131 11.343 -11.455 -34.445 1.00 0.00 C ATOM 0 H LEU A 131 12.211 -11.853 -38.802 1.00 0.00 H new ATOM 0 HA LEU A 131 9.742 -10.537 -38.207 1.00 0.00 H new ATOM 0 HB2 LEU A 131 12.432 -10.858 -36.920 1.00 0.00 H new ATOM 0 HB3 LEU A 131 11.481 -9.480 -36.403 1.00 0.00 H new ATOM 0 HG LEU A 131 9.648 -10.945 -35.689 1.00 0.00 H new ATOM 0 HD11 LEU A 131 9.846 -13.416 -35.640 1.00 0.00 H new ATOM 0 HD12 LEU A 131 9.809 -12.767 -37.297 1.00 0.00 H new ATOM 0 HD13 LEU A 131 11.350 -13.300 -36.585 1.00 0.00 H new ATOM 0 HD21 LEU A 131 10.779 -12.097 -33.769 1.00 0.00 H new ATOM 0 HD22 LEU A 131 12.349 -11.856 -34.572 1.00 0.00 H new ATOM 0 HD23 LEU A 131 11.403 -10.451 -34.026 1.00 0.00 H new ATOM 1775 N LEU A 132 12.184 -8.681 -39.447 1.00 0.00 N ATOM 1776 CA LEU A 132 12.543 -7.376 -40.047 1.00 0.00 C ATOM 1777 C LEU A 132 11.629 -7.024 -41.239 1.00 0.00 C ATOM 1778 O LEU A 132 11.100 -5.908 -41.326 1.00 0.00 O ATOM 1779 CB LEU A 132 14.032 -7.394 -40.491 1.00 0.00 C ATOM 1780 CG LEU A 132 15.076 -7.561 -39.336 1.00 0.00 C ATOM 1781 CD1 LEU A 132 16.505 -7.797 -39.886 1.00 0.00 C ATOM 1782 CD2 LEU A 132 15.027 -6.355 -38.359 1.00 0.00 C ATOM 0 H LEU A 132 12.920 -9.382 -39.529 1.00 0.00 H new ATOM 0 HA LEU A 132 12.400 -6.605 -39.290 1.00 0.00 H new ATOM 0 HB2 LEU A 132 14.171 -8.207 -41.204 1.00 0.00 H new ATOM 0 HB3 LEU A 132 14.247 -6.466 -41.020 1.00 0.00 H new ATOM 0 HG LEU A 132 14.803 -8.452 -38.771 1.00 0.00 H new ATOM 0 HD11 LEU A 132 17.201 -7.908 -39.055 1.00 0.00 H new ATOM 0 HD12 LEU A 132 16.516 -8.703 -40.492 1.00 0.00 H new ATOM 0 HD13 LEU A 132 16.804 -6.946 -40.498 1.00 0.00 H new ATOM 0 HD21 LEU A 132 15.762 -6.498 -37.567 1.00 0.00 H new ATOM 0 HD22 LEU A 132 15.252 -5.437 -38.902 1.00 0.00 H new ATOM 0 HD23 LEU A 132 14.032 -6.282 -37.921 1.00 0.00 H new ATOM 1794 N PHE A 133 11.448 -7.995 -42.147 1.00 0.00 N ATOM 1795 CA PHE A 133 10.656 -7.809 -43.380 1.00 0.00 C ATOM 1796 C PHE A 133 9.144 -7.855 -43.071 1.00 0.00 C ATOM 1797 O PHE A 133 8.387 -7.009 -43.544 1.00 0.00 O ATOM 1798 CB PHE A 133 11.041 -8.877 -44.449 1.00 0.00 C ATOM 1799 CG PHE A 133 12.541 -8.924 -44.799 1.00 0.00 C ATOM 1800 CD1 PHE A 133 13.314 -7.759 -44.847 1.00 0.00 C ATOM 1801 CD2 PHE A 133 13.176 -10.138 -45.081 1.00 0.00 C ATOM 1802 CE1 PHE A 133 14.662 -7.809 -45.151 1.00 0.00 C ATOM 1803 CE2 PHE A 133 14.527 -10.185 -45.388 1.00 0.00 C ATOM 1804 CZ PHE A 133 15.268 -9.022 -45.423 1.00 0.00 C ATOM 0 H PHE A 133 11.844 -8.930 -42.051 1.00 0.00 H new ATOM 0 HA PHE A 133 10.886 -6.825 -43.789 1.00 0.00 H new ATOM 0 HB2 PHE A 133 10.735 -9.859 -44.089 1.00 0.00 H new ATOM 0 HB3 PHE A 133 10.475 -8.681 -45.360 1.00 0.00 H new ATOM 0 HD1 PHE A 133 12.850 -6.805 -44.643 1.00 0.00 H new ATOM 0 HD2 PHE A 133 12.604 -11.054 -45.059 1.00 0.00 H new ATOM 0 HE1 PHE A 133 15.243 -6.899 -45.176 1.00 0.00 H new ATOM 0 HE2 PHE A 133 15.000 -11.133 -45.600 1.00 0.00 H new ATOM 0 HZ PHE A 133 16.320 -9.059 -45.663 1.00 0.00 H new ATOM 1814 N ARG A 134 8.728 -8.830 -42.234 1.00 0.00 N ATOM 1815 CA ARG A 134 7.297 -9.061 -41.887 1.00 0.00 C ATOM 1816 C ARG A 134 6.780 -8.022 -40.859 1.00 0.00 C ATOM 1817 O ARG A 134 5.578 -7.957 -40.580 1.00 0.00 O ATOM 1818 CB ARG A 134 7.079 -10.513 -41.378 1.00 0.00 C ATOM 1819 CG ARG A 134 5.604 -10.955 -41.254 1.00 0.00 C ATOM 1820 CD ARG A 134 5.443 -12.416 -40.782 1.00 0.00 C ATOM 1821 NE ARG A 134 6.104 -13.384 -41.684 1.00 0.00 N ATOM 1822 CZ ARG A 134 5.604 -13.852 -42.846 1.00 0.00 C ATOM 1823 NH1 ARG A 134 4.461 -13.387 -43.338 1.00 0.00 N ATOM 1824 NH2 ARG A 134 6.260 -14.791 -43.510 1.00 0.00 N ATOM 0 H ARG A 134 9.368 -9.481 -41.778 1.00 0.00 H new ATOM 0 HA ARG A 134 6.713 -8.930 -42.798 1.00 0.00 H new ATOM 0 HB2 ARG A 134 7.591 -11.198 -42.054 1.00 0.00 H new ATOM 0 HB3 ARG A 134 7.554 -10.614 -40.402 1.00 0.00 H new ATOM 0 HG2 ARG A 134 5.092 -10.295 -40.553 1.00 0.00 H new ATOM 0 HG3 ARG A 134 5.114 -10.836 -42.220 1.00 0.00 H new ATOM 0 HD2 ARG A 134 5.859 -12.517 -39.780 1.00 0.00 H new ATOM 0 HD3 ARG A 134 4.382 -12.656 -40.713 1.00 0.00 H new ATOM 0 HE ARG A 134 7.021 -13.729 -41.402 1.00 0.00 H new ATOM 0 HH11 ARG A 134 3.946 -12.664 -42.835 1.00 0.00 H new ATOM 0 HH12 ARG A 134 4.098 -13.753 -44.218 1.00 0.00 H new ATOM 0 HH21 ARG A 134 7.138 -15.156 -43.142 1.00 0.00 H new ATOM 0 HH22 ARG A 134 5.887 -15.149 -44.389 1.00 0.00 H new ATOM 1838 N CYS A 135 7.696 -7.205 -40.296 1.00 0.00 N ATOM 1839 CA CYS A 135 7.319 -5.978 -39.555 1.00 0.00 C ATOM 1840 C CYS A 135 6.560 -4.987 -40.479 1.00 0.00 C ATOM 1841 O CYS A 135 5.800 -4.140 -40.004 1.00 0.00 O ATOM 1842 CB CYS A 135 8.574 -5.299 -38.964 1.00 0.00 C ATOM 1843 SG CYS A 135 8.238 -3.794 -38.023 1.00 0.00 S ATOM 0 H CYS A 135 8.701 -7.371 -40.339 1.00 0.00 H new ATOM 0 HA CYS A 135 6.656 -6.264 -38.739 1.00 0.00 H new ATOM 0 HB2 CYS A 135 9.086 -6.011 -38.316 1.00 0.00 H new ATOM 0 HB3 CYS A 135 9.259 -5.059 -39.777 1.00 0.00 H new ATOM 0 HG CYS A 135 7.110 -3.280 -38.415 1.00 0.00 H new ATOM 1849 N GLU A 136 6.791 -5.117 -41.798 1.00 0.00 N ATOM 1850 CA GLU A 136 6.160 -4.298 -42.848 1.00 0.00 C ATOM 1851 C GLU A 136 5.065 -5.107 -43.610 1.00 0.00 C ATOM 1852 O GLU A 136 4.211 -4.526 -44.292 1.00 0.00 O ATOM 1853 CB GLU A 136 7.278 -3.812 -43.818 1.00 0.00 C ATOM 1854 CG GLU A 136 6.841 -2.783 -44.879 1.00 0.00 C ATOM 1855 CD GLU A 136 6.210 -1.517 -44.267 1.00 0.00 C ATOM 1856 OE1 GLU A 136 6.926 -0.759 -43.584 1.00 0.00 O ATOM 1857 OE2 GLU A 136 4.994 -1.276 -44.457 1.00 0.00 O ATOM 0 H GLU A 136 7.438 -5.812 -42.172 1.00 0.00 H new ATOM 0 HA GLU A 136 5.660 -3.440 -42.399 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.083 -3.377 -43.226 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.692 -4.681 -44.330 1.00 0.00 H new ATOM 0 HG2 GLU A 136 7.706 -2.498 -45.478 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.124 -3.249 -45.555 1.00 0.00 H new