USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 750 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 62 TYR OH : rot -26:sc= 0.735 USER MOD Set 1.2: A 87 TYR OH : rot 29:sc= 1.18 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -1.91! C(o=-1.9!,f=-16!) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -130:sc= -2.46! (180deg=-3.37!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.409 K(o=-0.41,f=-1.7!) USER MOD Single : A 60 MET CE :methyl 146:sc= -2.77 (180deg=-6.47!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -84:sc= 0.546 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 110:sc= 0.408 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -147:sc= 0.215 (180deg=0.0368) USER MOD Single : A 75 THR OG1 : rot -23:sc= -0.729 USER MOD Single : A 88 LYS NZ :NH3+ 161:sc= 0.148 (180deg=0.0786) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -3.2! C(o=-3.2!,f=-3.3!) USER MOD Single : A 94 HIS : no HD1:sc= -0.546 K(o=-0.55,f=-1.7) USER MOD Single : A 97 GLN : amide:sc= -0.032 X(o=-0.032,f=0) USER MOD ----------------------------------------------------------------- ATOM 105 N LEU A 11 25.348 -10.447 -0.786 1.00 0.00 N ATOM 106 CA LEU A 11 25.782 -11.391 -1.811 1.00 0.00 C ATOM 107 C LEU A 11 24.984 -12.688 -1.731 1.00 0.00 C ATOM 108 O LEU A 11 24.376 -13.116 -2.712 1.00 0.00 O ATOM 109 CB LEU A 11 27.275 -11.687 -1.659 1.00 0.00 C ATOM 110 CG LEU A 11 27.812 -12.865 -2.473 1.00 0.00 C ATOM 111 CD1 LEU A 11 27.701 -12.579 -3.963 1.00 0.00 C ATOM 112 CD2 LEU A 11 29.254 -13.164 -2.091 1.00 0.00 C ATOM 0 HA LEU A 11 25.605 -10.937 -2.786 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.833 -10.793 -1.939 1.00 0.00 H new ATOM 0 HB3 LEU A 11 27.482 -11.875 -0.605 1.00 0.00 H new ATOM 0 HG LEU A 11 27.208 -13.744 -2.247 1.00 0.00 H new ATOM 0 HD11 LEU A 11 28.088 -13.428 -4.526 1.00 0.00 H new ATOM 0 HD12 LEU A 11 26.656 -12.415 -4.225 1.00 0.00 H new ATOM 0 HD13 LEU A 11 28.280 -11.688 -4.207 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.620 -14.005 -2.680 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.872 -12.288 -2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.305 -13.414 -1.031 1.00 0.00 H new ATOM 124 N TRP A 12 24.988 -13.307 -0.556 1.00 0.00 N ATOM 125 CA TRP A 12 24.262 -14.555 -0.347 1.00 0.00 C ATOM 126 C TRP A 12 22.906 -14.519 -1.044 1.00 0.00 C ATOM 127 O TRP A 12 22.467 -15.515 -1.618 1.00 0.00 O ATOM 128 CB TRP A 12 24.074 -14.815 1.148 1.00 0.00 C ATOM 129 CG TRP A 12 22.912 -14.075 1.738 1.00 0.00 C ATOM 130 CD1 TRP A 12 22.955 -12.892 2.420 1.00 0.00 C ATOM 131 CD2 TRP A 12 21.536 -14.469 1.701 1.00 0.00 C ATOM 132 NE1 TRP A 12 21.688 -12.528 2.809 1.00 0.00 N ATOM 133 CE2 TRP A 12 20.800 -13.478 2.379 1.00 0.00 C ATOM 134 CE3 TRP A 12 20.854 -15.562 1.159 1.00 0.00 C ATOM 135 CZ2 TRP A 12 19.418 -13.550 2.529 1.00 0.00 C ATOM 136 CZ3 TRP A 12 19.482 -15.632 1.309 1.00 0.00 C ATOM 137 CH2 TRP A 12 18.776 -14.631 1.988 1.00 0.00 C ATOM 0 H TRP A 12 25.486 -12.966 0.266 1.00 0.00 H new ATOM 0 HA TRP A 12 24.850 -15.365 -0.778 1.00 0.00 H new ATOM 0 HB2 TRP A 12 23.934 -15.884 1.309 1.00 0.00 H new ATOM 0 HB3 TRP A 12 24.984 -14.529 1.676 1.00 0.00 H new ATOM 0 HD1 TRP A 12 23.852 -12.326 2.623 1.00 0.00 H new ATOM 0 HE1 TRP A 12 21.448 -11.687 3.333 1.00 0.00 H new ATOM 0 HE3 TRP A 12 21.390 -16.338 0.632 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 18.872 -12.780 3.054 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 18.945 -16.473 0.896 1.00 0.00 H new ATOM 0 HH2 TRP A 12 17.704 -14.714 2.087 1.00 0.00 H new ATOM 148 N GLU A 13 22.248 -13.365 -0.990 1.00 0.00 N ATOM 149 CA GLU A 13 20.942 -13.201 -1.617 1.00 0.00 C ATOM 150 C GLU A 13 21.070 -13.141 -3.136 1.00 0.00 C ATOM 151 O GLU A 13 20.271 -13.732 -3.862 1.00 0.00 O ATOM 152 CB GLU A 13 20.259 -11.933 -1.101 1.00 0.00 C ATOM 153 CG GLU A 13 19.189 -12.199 -0.056 1.00 0.00 C ATOM 154 CD GLU A 13 17.871 -11.526 -0.386 1.00 0.00 C ATOM 155 OE1 GLU A 13 17.857 -10.284 -0.521 1.00 0.00 O ATOM 156 OE2 GLU A 13 16.854 -12.239 -0.510 1.00 0.00 O ATOM 0 H GLU A 13 22.598 -12.531 -0.519 1.00 0.00 H new ATOM 0 HA GLU A 13 20.332 -14.066 -1.356 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.014 -11.272 -0.675 1.00 0.00 H new ATOM 0 HB3 GLU A 13 19.810 -11.405 -1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.032 -13.274 0.032 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.539 -11.848 0.915 1.00 0.00 H new ATOM 163 N PHE A 14 22.082 -12.422 -3.610 1.00 0.00 N ATOM 164 CA PHE A 14 22.316 -12.282 -5.043 1.00 0.00 C ATOM 165 C PHE A 14 22.503 -13.647 -5.699 1.00 0.00 C ATOM 166 O PHE A 14 21.758 -14.020 -6.606 1.00 0.00 O ATOM 167 CB PHE A 14 23.546 -11.409 -5.298 1.00 0.00 C ATOM 168 CG PHE A 14 24.237 -11.712 -6.596 1.00 0.00 C ATOM 169 CD1 PHE A 14 23.843 -11.087 -7.768 1.00 0.00 C ATOM 170 CD2 PHE A 14 25.281 -12.621 -6.645 1.00 0.00 C ATOM 171 CE1 PHE A 14 24.477 -11.363 -8.965 1.00 0.00 C ATOM 172 CE2 PHE A 14 25.920 -12.901 -7.839 1.00 0.00 C ATOM 173 CZ PHE A 14 25.516 -12.272 -9.000 1.00 0.00 C ATOM 0 H PHE A 14 22.753 -11.927 -3.023 1.00 0.00 H new ATOM 0 HA PHE A 14 21.442 -11.803 -5.483 1.00 0.00 H new ATOM 0 HB2 PHE A 14 23.246 -10.361 -5.291 1.00 0.00 H new ATOM 0 HB3 PHE A 14 24.253 -11.543 -4.479 1.00 0.00 H new ATOM 0 HD1 PHE A 14 23.031 -10.376 -7.746 1.00 0.00 H new ATOM 0 HD2 PHE A 14 25.600 -13.117 -5.740 1.00 0.00 H new ATOM 0 HE1 PHE A 14 24.160 -10.869 -9.871 1.00 0.00 H new ATOM 0 HE2 PHE A 14 26.734 -13.611 -7.863 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.012 -12.491 -9.934 1.00 0.00 H new ATOM 183 N VAL A 15 23.503 -14.389 -5.234 1.00 0.00 N ATOM 184 CA VAL A 15 23.789 -15.713 -5.775 1.00 0.00 C ATOM 185 C VAL A 15 22.576 -16.629 -5.653 1.00 0.00 C ATOM 186 O VAL A 15 22.253 -17.374 -6.579 1.00 0.00 O ATOM 187 CB VAL A 15 24.985 -16.365 -5.058 1.00 0.00 C ATOM 188 CG1 VAL A 15 24.763 -16.381 -3.553 1.00 0.00 C ATOM 189 CG2 VAL A 15 25.219 -17.773 -5.585 1.00 0.00 C ATOM 0 H VAL A 15 24.129 -14.096 -4.484 1.00 0.00 H new ATOM 0 HA VAL A 15 24.036 -15.579 -6.828 1.00 0.00 H new ATOM 0 HB VAL A 15 25.876 -15.771 -5.263 1.00 0.00 H new ATOM 0 HG11 VAL A 15 25.619 -16.846 -3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 15 24.649 -15.359 -3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.862 -16.950 -3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 15 26.068 -18.219 -5.067 1.00 0.00 H new ATOM 0 HG22 VAL A 15 24.330 -18.379 -5.412 1.00 0.00 H new ATOM 0 HG23 VAL A 15 25.427 -17.731 -6.654 1.00 0.00 H new ATOM 199 N ARG A 16 21.908 -16.568 -4.506 1.00 0.00 N ATOM 200 CA ARG A 16 20.731 -17.394 -4.263 1.00 0.00 C ATOM 201 C ARG A 16 19.609 -17.040 -5.235 1.00 0.00 C ATOM 202 O ARG A 16 18.910 -17.920 -5.738 1.00 0.00 O ATOM 203 CB ARG A 16 20.247 -17.217 -2.823 1.00 0.00 C ATOM 204 CG ARG A 16 18.918 -17.898 -2.539 1.00 0.00 C ATOM 205 CD ARG A 16 17.936 -16.949 -1.871 1.00 0.00 C ATOM 206 NE ARG A 16 17.441 -15.933 -2.796 1.00 0.00 N ATOM 207 CZ ARG A 16 16.504 -15.046 -2.480 1.00 0.00 C ATOM 208 NH1 ARG A 16 15.966 -15.048 -1.269 1.00 0.00 N ATOM 209 NH2 ARG A 16 16.106 -14.153 -3.377 1.00 0.00 N ATOM 0 H ARG A 16 22.161 -15.956 -3.731 1.00 0.00 H new ATOM 0 HA ARG A 16 21.010 -18.436 -4.420 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.001 -17.614 -2.144 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.153 -16.152 -2.608 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.491 -18.268 -3.471 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.082 -18.764 -1.898 1.00 0.00 H new ATOM 0 HD2 ARG A 16 17.095 -17.518 -1.474 1.00 0.00 H new ATOM 0 HD3 ARG A 16 18.421 -16.463 -1.024 1.00 0.00 H new ATOM 0 HE ARG A 16 17.836 -15.903 -3.736 1.00 0.00 H new ATOM 0 HH11 ARG A 16 16.271 -15.732 -0.576 1.00 0.00 H new ATOM 0 HH12 ARG A 16 15.247 -14.366 -1.029 1.00 0.00 H new ATOM 0 HH21 ARG A 16 16.520 -14.148 -4.309 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.386 -13.472 -3.134 1.00 0.00 H new ATOM 223 N ASP A 17 19.443 -15.748 -5.494 1.00 0.00 N ATOM 224 CA ASP A 17 18.407 -15.277 -6.406 1.00 0.00 C ATOM 225 C ASP A 17 18.597 -15.873 -7.797 1.00 0.00 C ATOM 226 O ASP A 17 17.626 -16.148 -8.505 1.00 0.00 O ATOM 227 CB ASP A 17 18.422 -13.750 -6.485 1.00 0.00 C ATOM 228 CG ASP A 17 17.052 -13.172 -6.781 1.00 0.00 C ATOM 229 OD1 ASP A 17 16.166 -13.267 -5.905 1.00 0.00 O ATOM 230 OD2 ASP A 17 16.866 -12.624 -7.887 1.00 0.00 O ATOM 0 H ASP A 17 20.013 -15.007 -5.085 1.00 0.00 H new ATOM 0 HA ASP A 17 17.441 -15.603 -6.019 1.00 0.00 H new ATOM 0 HB2 ASP A 17 18.788 -13.344 -5.542 1.00 0.00 H new ATOM 0 HB3 ASP A 17 19.121 -13.436 -7.260 1.00 0.00 H new ATOM 235 N LEU A 18 19.852 -16.069 -8.185 1.00 0.00 N ATOM 236 CA LEU A 18 20.170 -16.631 -9.493 1.00 0.00 C ATOM 237 C LEU A 18 19.585 -18.032 -9.640 1.00 0.00 C ATOM 238 O LEU A 18 19.043 -18.384 -10.689 1.00 0.00 O ATOM 239 CB LEU A 18 21.685 -16.675 -9.697 1.00 0.00 C ATOM 240 CG LEU A 18 22.329 -15.392 -10.225 1.00 0.00 C ATOM 241 CD1 LEU A 18 23.810 -15.357 -9.880 1.00 0.00 C ATOM 242 CD2 LEU A 18 22.126 -15.273 -11.728 1.00 0.00 C ATOM 0 H LEU A 18 20.666 -15.847 -7.612 1.00 0.00 H new ATOM 0 HA LEU A 18 19.726 -15.990 -10.254 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.152 -16.927 -8.745 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.915 -17.485 -10.390 1.00 0.00 H new ATOM 0 HG LEU A 18 21.845 -14.541 -9.745 1.00 0.00 H new ATOM 0 HD11 LEU A 18 24.251 -14.437 -10.264 1.00 0.00 H new ATOM 0 HD12 LEU A 18 23.932 -15.394 -8.798 1.00 0.00 H new ATOM 0 HD13 LEU A 18 24.309 -16.215 -10.331 1.00 0.00 H new ATOM 0 HD21 LEU A 18 22.591 -14.354 -12.086 1.00 0.00 H new ATOM 0 HD22 LEU A 18 22.582 -16.129 -12.226 1.00 0.00 H new ATOM 0 HD23 LEU A 18 21.059 -15.251 -11.950 1.00 0.00 H new ATOM 254 N LEU A 19 19.696 -18.828 -8.582 1.00 0.00 N ATOM 255 CA LEU A 19 19.176 -20.191 -8.592 1.00 0.00 C ATOM 256 C LEU A 19 17.665 -20.196 -8.799 1.00 0.00 C ATOM 257 O LEU A 19 17.130 -21.030 -9.531 1.00 0.00 O ATOM 258 CB LEU A 19 19.526 -20.901 -7.283 1.00 0.00 C ATOM 259 CG LEU A 19 20.990 -21.307 -7.109 1.00 0.00 C ATOM 260 CD1 LEU A 19 21.383 -21.271 -5.641 1.00 0.00 C ATOM 261 CD2 LEU A 19 21.232 -22.690 -7.695 1.00 0.00 C ATOM 0 H LEU A 19 20.141 -18.553 -7.707 1.00 0.00 H new ATOM 0 HA LEU A 19 19.639 -20.724 -9.422 1.00 0.00 H new ATOM 0 HB2 LEU A 19 19.250 -20.249 -6.454 1.00 0.00 H new ATOM 0 HB3 LEU A 19 18.910 -21.796 -7.203 1.00 0.00 H new ATOM 0 HG LEU A 19 21.612 -20.592 -7.647 1.00 0.00 H new ATOM 0 HD11 LEU A 19 22.428 -21.563 -5.537 1.00 0.00 H new ATOM 0 HD12 LEU A 19 21.248 -20.261 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 19 20.755 -21.963 -5.079 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.279 -22.963 -7.563 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.600 -23.417 -7.185 1.00 0.00 H new ATOM 0 HD23 LEU A 19 20.991 -22.682 -8.758 1.00 0.00 H new ATOM 273 N LEU A 20 16.982 -19.259 -8.151 1.00 0.00 N ATOM 274 CA LEU A 20 15.531 -19.153 -8.266 1.00 0.00 C ATOM 275 C LEU A 20 15.138 -18.414 -9.541 1.00 0.00 C ATOM 276 O LEU A 20 13.968 -18.393 -9.922 1.00 0.00 O ATOM 277 CB LEU A 20 14.955 -18.431 -7.046 1.00 0.00 C ATOM 278 CG LEU A 20 15.584 -18.785 -5.698 1.00 0.00 C ATOM 279 CD1 LEU A 20 14.875 -18.052 -4.570 1.00 0.00 C ATOM 280 CD2 LEU A 20 15.544 -20.289 -5.469 1.00 0.00 C ATOM 0 H LEU A 20 17.409 -18.562 -7.541 1.00 0.00 H new ATOM 0 HA LEU A 20 15.120 -20.162 -8.312 1.00 0.00 H new ATOM 0 HB2 LEU A 20 15.059 -17.357 -7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.887 -18.644 -6.993 1.00 0.00 H new ATOM 0 HG LEU A 20 16.627 -18.468 -5.710 1.00 0.00 H new ATOM 0 HD11 LEU A 20 15.336 -18.316 -3.618 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.957 -16.976 -4.727 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.823 -18.337 -4.555 1.00 0.00 H new ATOM 0 HD21 LEU A 20 15.996 -20.522 -4.505 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.509 -20.631 -5.477 1.00 0.00 H new ATOM 0 HD23 LEU A 20 16.098 -20.792 -6.261 1.00 0.00 H new ATOM 292 N SER A 21 16.124 -17.811 -10.197 1.00 0.00 N ATOM 293 CA SER A 21 15.881 -17.069 -11.429 1.00 0.00 C ATOM 294 C SER A 21 16.687 -17.656 -12.584 1.00 0.00 C ATOM 295 O SER A 21 17.749 -17.153 -12.951 1.00 0.00 O ATOM 296 CB SER A 21 16.238 -15.594 -11.240 1.00 0.00 C ATOM 297 OG SER A 21 15.168 -14.882 -10.643 1.00 0.00 O ATOM 0 H SER A 21 17.099 -17.822 -9.896 1.00 0.00 H new ATOM 0 HA SER A 21 14.821 -17.150 -11.670 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.128 -15.509 -10.616 1.00 0.00 H new ATOM 0 HB3 SER A 21 16.481 -15.149 -12.205 1.00 0.00 H new ATOM 0 HG SER A 21 15.422 -13.942 -10.532 1.00 0.00 H new ATOM 303 N PRO A 22 16.171 -18.746 -13.171 1.00 0.00 N ATOM 304 CA PRO A 22 16.825 -19.425 -14.293 1.00 0.00 C ATOM 305 C PRO A 22 16.787 -18.597 -15.573 1.00 0.00 C ATOM 306 O PRO A 22 17.398 -18.963 -16.577 1.00 0.00 O ATOM 307 CB PRO A 22 16.004 -20.706 -14.460 1.00 0.00 C ATOM 308 CG PRO A 22 14.662 -20.371 -13.905 1.00 0.00 C ATOM 309 CD PRO A 22 14.909 -19.399 -12.785 1.00 0.00 C ATOM 0 HA PRO A 22 17.883 -19.603 -14.101 1.00 0.00 H new ATOM 0 HB2 PRO A 22 15.937 -21.000 -15.508 1.00 0.00 H new ATOM 0 HB3 PRO A 22 16.457 -21.540 -13.924 1.00 0.00 H new ATOM 0 HG2 PRO A 22 14.022 -19.931 -14.670 1.00 0.00 H new ATOM 0 HG3 PRO A 22 14.156 -21.265 -13.541 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.096 -18.679 -12.692 1.00 0.00 H new ATOM 0 HD3 PRO A 22 14.997 -19.907 -11.824 1.00 0.00 H new ATOM 317 N GLU A 23 16.067 -17.481 -15.530 1.00 0.00 N ATOM 318 CA GLU A 23 15.950 -16.602 -16.688 1.00 0.00 C ATOM 319 C GLU A 23 17.151 -15.666 -16.783 1.00 0.00 C ATOM 320 O GLU A 23 17.529 -15.234 -17.872 1.00 0.00 O ATOM 321 CB GLU A 23 14.658 -15.786 -16.609 1.00 0.00 C ATOM 322 CG GLU A 23 13.479 -16.445 -17.304 1.00 0.00 C ATOM 323 CD GLU A 23 12.153 -15.813 -16.929 1.00 0.00 C ATOM 324 OE1 GLU A 23 11.610 -16.164 -15.860 1.00 0.00 O ATOM 325 OE2 GLU A 23 11.658 -14.967 -17.703 1.00 0.00 O ATOM 0 H GLU A 23 15.556 -17.164 -14.706 1.00 0.00 H new ATOM 0 HA GLU A 23 15.924 -17.224 -17.583 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.406 -15.621 -15.561 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.830 -14.806 -17.054 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.616 -16.380 -18.383 1.00 0.00 H new ATOM 0 HG3 GLU A 23 13.457 -17.504 -17.049 1.00 0.00 H new ATOM 332 N GLU A 24 17.746 -15.356 -15.635 1.00 0.00 N ATOM 333 CA GLU A 24 18.903 -14.470 -15.589 1.00 0.00 C ATOM 334 C GLU A 24 20.197 -15.270 -15.471 1.00 0.00 C ATOM 335 O GLU A 24 21.206 -14.933 -16.090 1.00 0.00 O ATOM 336 CB GLU A 24 18.782 -13.498 -14.413 1.00 0.00 C ATOM 337 CG GLU A 24 18.291 -12.117 -14.813 1.00 0.00 C ATOM 338 CD GLU A 24 19.356 -11.050 -14.656 1.00 0.00 C ATOM 339 OE1 GLU A 24 20.176 -10.890 -15.584 1.00 0.00 O ATOM 340 OE2 GLU A 24 19.371 -10.376 -13.605 1.00 0.00 O ATOM 0 H GLU A 24 17.446 -15.705 -14.725 1.00 0.00 H new ATOM 0 HA GLU A 24 18.931 -13.902 -16.519 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.099 -13.918 -13.675 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.754 -13.403 -13.930 1.00 0.00 H new ATOM 0 HG2 GLU A 24 17.957 -12.141 -15.850 1.00 0.00 H new ATOM 0 HG3 GLU A 24 17.426 -11.853 -14.205 1.00 0.00 H new ATOM 347 N ASN A 25 20.159 -16.331 -14.672 1.00 0.00 N ATOM 348 CA ASN A 25 21.328 -17.179 -14.472 1.00 0.00 C ATOM 349 C ASN A 25 21.575 -18.062 -15.691 1.00 0.00 C ATOM 350 O ASN A 25 20.655 -18.698 -16.207 1.00 0.00 O ATOM 351 CB ASN A 25 21.146 -18.050 -13.227 1.00 0.00 C ATOM 352 CG ASN A 25 22.107 -19.222 -13.194 1.00 0.00 C ATOM 353 OD1 ASN A 25 23.102 -19.243 -13.919 1.00 0.00 O ATOM 354 ND2 ASN A 25 21.814 -20.205 -12.351 1.00 0.00 N ATOM 0 H ASN A 25 19.331 -16.624 -14.153 1.00 0.00 H new ATOM 0 HA ASN A 25 22.194 -16.532 -14.332 1.00 0.00 H new ATOM 0 HB2 ASN A 25 21.292 -17.440 -12.336 1.00 0.00 H new ATOM 0 HB3 ASN A 25 20.122 -18.423 -13.194 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.424 -21.020 -12.286 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.979 -20.146 -11.769 1.00 0.00 H new ATOM 361 N CYS A 26 22.823 -18.097 -16.146 1.00 0.00 N ATOM 362 CA CYS A 26 23.192 -18.902 -17.305 1.00 0.00 C ATOM 363 C CYS A 26 24.183 -19.994 -16.916 1.00 0.00 C ATOM 364 O CYS A 26 25.394 -19.821 -17.040 1.00 0.00 O ATOM 365 CB CYS A 26 23.794 -18.016 -18.397 1.00 0.00 C ATOM 366 SG CYS A 26 23.319 -18.489 -20.076 1.00 0.00 S ATOM 0 H CYS A 26 23.596 -17.577 -15.730 1.00 0.00 H new ATOM 0 HA CYS A 26 22.289 -19.376 -17.689 1.00 0.00 H new ATOM 0 HB2 CYS A 26 23.489 -16.984 -18.222 1.00 0.00 H new ATOM 0 HB3 CYS A 26 24.881 -18.046 -18.316 1.00 0.00 H new ATOM 0 HG CYS A 26 23.875 -17.680 -20.928 1.00 0.00 H new ATOM 372 N GLY A 27 23.658 -21.121 -16.442 1.00 0.00 N ATOM 373 CA GLY A 27 24.511 -22.224 -16.040 1.00 0.00 C ATOM 374 C GLY A 27 25.640 -21.782 -15.130 1.00 0.00 C ATOM 375 O GLY A 27 26.751 -22.307 -15.209 1.00 0.00 O ATOM 0 H GLY A 27 22.658 -21.289 -16.330 1.00 0.00 H new ATOM 0 HA2 GLY A 27 23.910 -22.976 -15.529 1.00 0.00 H new ATOM 0 HA3 GLY A 27 24.929 -22.699 -16.928 1.00 0.00 H new ATOM 379 N ILE A 28 25.357 -20.814 -14.265 1.00 0.00 N ATOM 380 CA ILE A 28 26.357 -20.302 -13.337 1.00 0.00 C ATOM 381 C ILE A 28 26.379 -21.116 -12.048 1.00 0.00 C ATOM 382 O ILE A 28 27.423 -21.261 -11.410 1.00 0.00 O ATOM 383 CB ILE A 28 26.101 -18.823 -12.993 1.00 0.00 C ATOM 384 CG1 ILE A 28 25.870 -18.012 -14.270 1.00 0.00 C ATOM 385 CG2 ILE A 28 27.269 -18.253 -12.202 1.00 0.00 C ATOM 386 CD1 ILE A 28 25.410 -16.595 -14.011 1.00 0.00 C ATOM 0 H ILE A 28 24.443 -20.368 -14.188 1.00 0.00 H new ATOM 0 HA ILE A 28 27.323 -20.389 -13.835 1.00 0.00 H new ATOM 0 HB ILE A 28 25.204 -18.759 -12.377 1.00 0.00 H new ATOM 0 HG12 ILE A 28 26.795 -17.985 -14.846 1.00 0.00 H new ATOM 0 HG13 ILE A 28 25.126 -18.520 -14.884 1.00 0.00 H new ATOM 0 HG21 ILE A 28 27.073 -17.207 -11.967 1.00 0.00 H new ATOM 0 HG22 ILE A 28 27.391 -18.816 -11.277 1.00 0.00 H new ATOM 0 HG23 ILE A 28 28.181 -18.327 -12.795 1.00 0.00 H new ATOM 0 HD11 ILE A 28 25.266 -16.080 -14.961 1.00 0.00 H new ATOM 0 HD12 ILE A 28 24.469 -16.613 -13.462 1.00 0.00 H new ATOM 0 HD13 ILE A 28 26.163 -16.070 -13.423 1.00 0.00 H new ATOM 398 N LEU A 29 25.222 -21.647 -11.670 1.00 0.00 N ATOM 399 CA LEU A 29 25.107 -22.449 -10.457 1.00 0.00 C ATOM 400 C LEU A 29 24.203 -23.656 -10.686 1.00 0.00 C ATOM 401 O LEU A 29 23.551 -23.767 -11.724 1.00 0.00 O ATOM 402 CB LEU A 29 24.561 -21.598 -9.309 1.00 0.00 C ATOM 403 CG LEU A 29 25.192 -20.216 -9.139 1.00 0.00 C ATOM 404 CD1 LEU A 29 24.205 -19.253 -8.497 1.00 0.00 C ATOM 405 CD2 LEU A 29 26.465 -20.309 -8.309 1.00 0.00 C ATOM 0 H LEU A 29 24.349 -21.537 -12.186 1.00 0.00 H new ATOM 0 HA LEU A 29 26.102 -22.809 -10.193 1.00 0.00 H new ATOM 0 HB2 LEU A 29 23.489 -21.470 -9.456 1.00 0.00 H new ATOM 0 HB3 LEU A 29 24.691 -22.152 -8.379 1.00 0.00 H new ATOM 0 HG LEU A 29 25.452 -19.833 -10.126 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.672 -18.275 -8.384 1.00 0.00 H new ATOM 0 HD12 LEU A 29 23.322 -19.163 -9.129 1.00 0.00 H new ATOM 0 HD13 LEU A 29 23.913 -19.631 -7.517 1.00 0.00 H new ATOM 0 HD21 LEU A 29 26.901 -19.316 -8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 29 26.229 -20.713 -7.325 1.00 0.00 H new ATOM 0 HD23 LEU A 29 27.178 -20.964 -8.809 1.00 0.00 H new ATOM 417 N GLU A 30 24.167 -24.555 -9.708 1.00 0.00 N ATOM 418 CA GLU A 30 23.341 -25.753 -9.803 1.00 0.00 C ATOM 419 C GLU A 30 22.787 -26.142 -8.435 1.00 0.00 C ATOM 420 O GLU A 30 23.415 -25.893 -7.406 1.00 0.00 O ATOM 421 CB GLU A 30 24.151 -26.914 -10.385 1.00 0.00 C ATOM 422 CG GLU A 30 25.091 -27.563 -9.383 1.00 0.00 C ATOM 423 CD GLU A 30 24.693 -28.988 -9.049 1.00 0.00 C ATOM 424 OE1 GLU A 30 23.645 -29.173 -8.397 1.00 0.00 O ATOM 425 OE2 GLU A 30 25.430 -29.917 -9.440 1.00 0.00 O ATOM 0 H GLU A 30 24.700 -24.477 -8.842 1.00 0.00 H new ATOM 0 HA GLU A 30 22.504 -25.534 -10.467 1.00 0.00 H new ATOM 0 HB2 GLU A 30 23.464 -27.669 -10.768 1.00 0.00 H new ATOM 0 HB3 GLU A 30 24.732 -26.552 -11.233 1.00 0.00 H new ATOM 0 HG2 GLU A 30 26.104 -27.557 -9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 30 25.107 -26.970 -8.468 1.00 0.00 H new ATOM 432 N TRP A 31 21.607 -26.751 -8.433 1.00 0.00 N ATOM 433 CA TRP A 31 20.967 -27.174 -7.193 1.00 0.00 C ATOM 434 C TRP A 31 21.394 -28.587 -6.813 1.00 0.00 C ATOM 435 O TRP A 31 20.845 -29.567 -7.316 1.00 0.00 O ATOM 436 CB TRP A 31 19.445 -27.108 -7.332 1.00 0.00 C ATOM 437 CG TRP A 31 18.876 -25.761 -7.005 1.00 0.00 C ATOM 438 CD1 TRP A 31 18.208 -24.925 -7.853 1.00 0.00 C ATOM 439 CD2 TRP A 31 18.927 -25.093 -5.739 1.00 0.00 C ATOM 440 NE1 TRP A 31 17.841 -23.778 -7.191 1.00 0.00 N ATOM 441 CE2 TRP A 31 18.269 -23.857 -5.893 1.00 0.00 C ATOM 442 CE3 TRP A 31 19.463 -25.420 -4.490 1.00 0.00 C ATOM 443 CZ2 TRP A 31 18.135 -22.950 -4.845 1.00 0.00 C ATOM 444 CZ3 TRP A 31 19.329 -24.519 -3.452 1.00 0.00 C ATOM 445 CH2 TRP A 31 18.669 -23.296 -3.634 1.00 0.00 C ATOM 0 H TRP A 31 21.074 -26.963 -9.276 1.00 0.00 H new ATOM 0 HA TRP A 31 21.283 -26.495 -6.401 1.00 0.00 H new ATOM 0 HB2 TRP A 31 19.169 -27.373 -8.353 1.00 0.00 H new ATOM 0 HB3 TRP A 31 18.995 -27.853 -6.676 1.00 0.00 H new ATOM 0 HD1 TRP A 31 17.999 -25.134 -8.892 1.00 0.00 H new ATOM 0 HE1 TRP A 31 17.332 -22.995 -7.600 1.00 0.00 H new ATOM 0 HE3 TRP A 31 19.973 -26.360 -4.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 17.627 -22.007 -4.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 19.740 -24.761 -2.483 1.00 0.00 H new ATOM 0 HH2 TRP A 31 18.580 -22.613 -2.802 1.00 0.00 H new ATOM 456 N GLU A 32 22.378 -28.685 -5.924 1.00 0.00 N ATOM 457 CA GLU A 32 22.878 -29.980 -5.478 1.00 0.00 C ATOM 458 C GLU A 32 21.880 -30.657 -4.543 1.00 0.00 C ATOM 459 O GLU A 32 21.822 -31.884 -4.464 1.00 0.00 O ATOM 460 CB GLU A 32 24.225 -29.815 -4.771 1.00 0.00 C ATOM 461 CG GLU A 32 25.414 -30.232 -5.622 1.00 0.00 C ATOM 462 CD GLU A 32 25.187 -31.550 -6.335 1.00 0.00 C ATOM 463 OE1 GLU A 32 25.369 -32.608 -5.697 1.00 0.00 O ATOM 464 OE2 GLU A 32 24.828 -31.524 -7.531 1.00 0.00 O ATOM 0 H GLU A 32 22.844 -27.883 -5.499 1.00 0.00 H new ATOM 0 HA GLU A 32 23.011 -30.611 -6.357 1.00 0.00 H new ATOM 0 HB2 GLU A 32 24.347 -28.772 -4.478 1.00 0.00 H new ATOM 0 HB3 GLU A 32 24.220 -30.405 -3.855 1.00 0.00 H new ATOM 0 HG2 GLU A 32 25.619 -29.455 -6.359 1.00 0.00 H new ATOM 0 HG3 GLU A 32 26.298 -30.313 -4.990 1.00 0.00 H new ATOM 471 N ASP A 33 21.097 -29.848 -3.838 1.00 0.00 N ATOM 472 CA ASP A 33 20.101 -30.367 -2.908 1.00 0.00 C ATOM 473 C ASP A 33 19.176 -29.254 -2.425 1.00 0.00 C ATOM 474 O ASP A 33 19.564 -28.426 -1.600 1.00 0.00 O ATOM 475 CB ASP A 33 20.785 -31.034 -1.714 1.00 0.00 C ATOM 476 CG ASP A 33 20.483 -32.517 -1.627 1.00 0.00 C ATOM 477 OD1 ASP A 33 19.319 -32.901 -1.869 1.00 0.00 O ATOM 478 OD2 ASP A 33 21.410 -33.294 -1.318 1.00 0.00 O ATOM 0 H ASP A 33 21.133 -28.830 -3.893 1.00 0.00 H new ATOM 0 HA ASP A 33 19.501 -31.110 -3.434 1.00 0.00 H new ATOM 0 HB2 ASP A 33 21.863 -30.890 -1.789 1.00 0.00 H new ATOM 0 HB3 ASP A 33 20.462 -30.546 -0.795 1.00 0.00 H new ATOM 483 N ARG A 34 17.953 -29.240 -2.945 1.00 0.00 N ATOM 484 CA ARG A 34 16.975 -28.228 -2.568 1.00 0.00 C ATOM 485 C ARG A 34 16.550 -28.397 -1.112 1.00 0.00 C ATOM 486 O ARG A 34 16.369 -27.417 -0.391 1.00 0.00 O ATOM 487 CB ARG A 34 15.749 -28.308 -3.480 1.00 0.00 C ATOM 488 CG ARG A 34 15.077 -26.965 -3.717 1.00 0.00 C ATOM 489 CD ARG A 34 15.657 -26.258 -4.932 1.00 0.00 C ATOM 490 NE ARG A 34 14.827 -26.442 -6.120 1.00 0.00 N ATOM 491 CZ ARG A 34 13.644 -25.861 -6.287 1.00 0.00 C ATOM 492 NH1 ARG A 34 13.155 -25.063 -5.348 1.00 0.00 N ATOM 493 NH2 ARG A 34 12.948 -26.078 -7.396 1.00 0.00 N ATOM 0 H ARG A 34 17.616 -29.918 -3.628 1.00 0.00 H new ATOM 0 HA ARG A 34 17.441 -27.249 -2.681 1.00 0.00 H new ATOM 0 HB2 ARG A 34 16.048 -28.730 -4.440 1.00 0.00 H new ATOM 0 HB3 ARG A 34 15.025 -28.995 -3.042 1.00 0.00 H new ATOM 0 HG2 ARG A 34 14.006 -27.113 -3.857 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.199 -26.335 -2.836 1.00 0.00 H new ATOM 0 HD2 ARG A 34 15.755 -25.193 -4.720 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.660 -26.638 -5.128 1.00 0.00 H new ATOM 0 HE ARG A 34 15.175 -27.050 -6.862 1.00 0.00 H new ATOM 0 HH11 ARG A 34 13.687 -24.894 -4.495 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.246 -24.618 -5.479 1.00 0.00 H new ATOM 0 HH21 ARG A 34 13.321 -26.691 -8.121 1.00 0.00 H new ATOM 0 HH22 ARG A 34 12.040 -25.632 -7.524 1.00 0.00 H new ATOM 507 N GLU A 35 16.393 -29.647 -0.688 1.00 0.00 N ATOM 508 CA GLU A 35 15.988 -29.944 0.681 1.00 0.00 C ATOM 509 C GLU A 35 16.998 -29.385 1.680 1.00 0.00 C ATOM 510 O GLU A 35 16.637 -28.638 2.589 1.00 0.00 O ATOM 511 CB GLU A 35 15.842 -31.454 0.877 1.00 0.00 C ATOM 512 CG GLU A 35 14.614 -32.040 0.201 1.00 0.00 C ATOM 513 CD GLU A 35 14.815 -32.257 -1.287 1.00 0.00 C ATOM 514 OE1 GLU A 35 14.970 -31.256 -2.017 1.00 0.00 O ATOM 515 OE2 GLU A 35 14.818 -33.428 -1.720 1.00 0.00 O ATOM 0 H GLU A 35 16.540 -30.470 -1.272 1.00 0.00 H new ATOM 0 HA GLU A 35 15.024 -29.467 0.860 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.732 -31.950 0.488 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.797 -31.671 1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.363 -32.990 0.672 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.766 -31.373 0.356 1.00 0.00 H new ATOM 522 N GLN A 36 18.262 -29.754 1.503 1.00 0.00 N ATOM 523 CA GLN A 36 19.324 -29.291 2.389 1.00 0.00 C ATOM 524 C GLN A 36 19.703 -27.848 2.076 1.00 0.00 C ATOM 525 O GLN A 36 20.119 -27.099 2.960 1.00 0.00 O ATOM 526 CB GLN A 36 20.552 -30.193 2.263 1.00 0.00 C ATOM 527 CG GLN A 36 20.218 -31.676 2.230 1.00 0.00 C ATOM 528 CD GLN A 36 21.232 -32.520 2.976 1.00 0.00 C ATOM 529 OE1 GLN A 36 22.052 -33.209 2.368 1.00 0.00 O ATOM 530 NE2 GLN A 36 21.183 -32.470 4.302 1.00 0.00 N ATOM 0 H GLN A 36 18.576 -30.372 0.755 1.00 0.00 H new ATOM 0 HA GLN A 36 18.954 -29.336 3.413 1.00 0.00 H new ATOM 0 HB2 GLN A 36 21.093 -29.931 1.354 1.00 0.00 H new ATOM 0 HB3 GLN A 36 21.222 -29.999 3.100 1.00 0.00 H new ATOM 0 HG2 GLN A 36 19.231 -31.832 2.665 1.00 0.00 H new ATOM 0 HG3 GLN A 36 20.166 -32.010 1.194 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.487 -31.886 4.765 1.00 0.00 H new ATOM 0 HE22 GLN A 36 21.841 -33.016 4.858 1.00 0.00 H new ATOM 539 N GLY A 37 19.558 -27.464 0.812 1.00 0.00 N ATOM 540 CA GLY A 37 19.890 -26.111 0.404 1.00 0.00 C ATOM 541 C GLY A 37 21.313 -25.992 -0.104 1.00 0.00 C ATOM 542 O GLY A 37 21.929 -24.931 0.000 1.00 0.00 O ATOM 0 H GLY A 37 19.216 -28.066 0.063 1.00 0.00 H new ATOM 0 HA2 GLY A 37 19.201 -25.791 -0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.751 -25.436 1.248 1.00 0.00 H new ATOM 546 N ILE A 38 21.837 -27.083 -0.652 1.00 0.00 N ATOM 547 CA ILE A 38 23.197 -27.095 -1.177 1.00 0.00 C ATOM 548 C ILE A 38 23.218 -26.732 -2.658 1.00 0.00 C ATOM 549 O ILE A 38 22.326 -27.116 -3.415 1.00 0.00 O ATOM 550 CB ILE A 38 23.860 -28.472 -0.989 1.00 0.00 C ATOM 551 CG1 ILE A 38 23.916 -28.837 0.496 1.00 0.00 C ATOM 552 CG2 ILE A 38 25.257 -28.474 -1.593 1.00 0.00 C ATOM 553 CD1 ILE A 38 23.928 -30.328 0.751 1.00 0.00 C ATOM 0 H ILE A 38 21.341 -27.970 -0.744 1.00 0.00 H new ATOM 0 HA ILE A 38 23.759 -26.349 -0.614 1.00 0.00 H new ATOM 0 HB ILE A 38 23.260 -29.221 -1.506 1.00 0.00 H new ATOM 0 HG12 ILE A 38 24.809 -28.394 0.937 1.00 0.00 H new ATOM 0 HG13 ILE A 38 23.057 -28.397 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 38 25.713 -29.454 -1.452 1.00 0.00 H new ATOM 0 HG22 ILE A 38 25.193 -28.253 -2.658 1.00 0.00 H new ATOM 0 HG23 ILE A 38 25.867 -27.716 -1.101 1.00 0.00 H new ATOM 0 HD11 ILE A 38 23.968 -30.513 1.824 1.00 0.00 H new ATOM 0 HD12 ILE A 38 23.023 -30.775 0.339 1.00 0.00 H new ATOM 0 HD13 ILE A 38 24.801 -30.772 0.273 1.00 0.00 H new ATOM 565 N PHE A 39 24.243 -25.990 -3.065 1.00 0.00 N ATOM 566 CA PHE A 39 24.381 -25.575 -4.456 1.00 0.00 C ATOM 567 C PHE A 39 25.851 -25.491 -4.855 1.00 0.00 C ATOM 568 O PHE A 39 26.723 -25.283 -4.012 1.00 0.00 O ATOM 569 CB PHE A 39 23.703 -24.221 -4.676 1.00 0.00 C ATOM 570 CG PHE A 39 24.358 -23.094 -3.930 1.00 0.00 C ATOM 571 CD1 PHE A 39 23.989 -22.802 -2.626 1.00 0.00 C ATOM 572 CD2 PHE A 39 25.342 -22.326 -4.532 1.00 0.00 C ATOM 573 CE1 PHE A 39 24.590 -21.766 -1.936 1.00 0.00 C ATOM 574 CE2 PHE A 39 25.946 -21.289 -3.846 1.00 0.00 C ATOM 575 CZ PHE A 39 25.569 -21.008 -2.548 1.00 0.00 C ATOM 0 H PHE A 39 24.990 -25.664 -2.451 1.00 0.00 H new ATOM 0 HA PHE A 39 23.895 -26.323 -5.082 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.706 -23.991 -5.741 1.00 0.00 H new ATOM 0 HB3 PHE A 39 22.660 -24.292 -4.368 1.00 0.00 H new ATOM 0 HD1 PHE A 39 23.223 -23.391 -2.144 1.00 0.00 H new ATOM 0 HD2 PHE A 39 25.640 -22.540 -5.548 1.00 0.00 H new ATOM 0 HE1 PHE A 39 24.295 -21.550 -0.920 1.00 0.00 H new ATOM 0 HE2 PHE A 39 26.713 -20.699 -4.325 1.00 0.00 H new ATOM 0 HZ PHE A 39 26.039 -20.197 -2.012 1.00 0.00 H new ATOM 585 N ARG A 40 26.118 -25.654 -6.147 1.00 0.00 N ATOM 586 CA ARG A 40 27.482 -25.599 -6.658 1.00 0.00 C ATOM 587 C ARG A 40 27.651 -24.438 -7.633 1.00 0.00 C ATOM 588 O ARG A 40 26.708 -24.052 -8.325 1.00 0.00 O ATOM 589 CB ARG A 40 27.845 -26.915 -7.349 1.00 0.00 C ATOM 590 CG ARG A 40 29.159 -26.862 -8.109 1.00 0.00 C ATOM 591 CD ARG A 40 29.509 -28.213 -8.713 1.00 0.00 C ATOM 592 NE ARG A 40 30.418 -28.087 -9.849 1.00 0.00 N ATOM 593 CZ ARG A 40 30.711 -29.088 -10.671 1.00 0.00 C ATOM 594 NH1 ARG A 40 30.168 -30.283 -10.485 1.00 0.00 N ATOM 595 NH2 ARG A 40 31.548 -28.895 -11.682 1.00 0.00 N ATOM 0 H ARG A 40 25.408 -25.825 -6.859 1.00 0.00 H new ATOM 0 HA ARG A 40 28.153 -25.443 -5.813 1.00 0.00 H new ATOM 0 HB2 ARG A 40 27.900 -27.705 -6.600 1.00 0.00 H new ATOM 0 HB3 ARG A 40 27.046 -27.185 -8.040 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.093 -26.115 -8.900 1.00 0.00 H new ATOM 0 HG3 ARG A 40 29.957 -26.545 -7.437 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.967 -28.843 -7.951 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.596 -28.714 -9.034 1.00 0.00 H new ATOM 0 HE ARG A 40 30.852 -27.180 -10.021 1.00 0.00 H new ATOM 0 HH11 ARG A 40 29.524 -30.435 -9.709 1.00 0.00 H new ATOM 0 HH12 ARG A 40 30.395 -31.050 -11.118 1.00 0.00 H new ATOM 0 HH21 ARG A 40 31.967 -27.977 -11.829 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.772 -29.665 -12.313 1.00 0.00 H new ATOM 609 N VAL A 41 28.858 -23.883 -7.682 1.00 0.00 N ATOM 610 CA VAL A 41 29.150 -22.766 -8.573 1.00 0.00 C ATOM 611 C VAL A 41 29.770 -23.251 -9.878 1.00 0.00 C ATOM 612 O VAL A 41 30.993 -23.317 -10.011 1.00 0.00 O ATOM 613 CB VAL A 41 30.103 -21.754 -7.909 1.00 0.00 C ATOM 614 CG1 VAL A 41 30.364 -20.578 -8.838 1.00 0.00 C ATOM 615 CG2 VAL A 41 29.535 -21.280 -6.580 1.00 0.00 C ATOM 0 H VAL A 41 29.649 -24.189 -7.115 1.00 0.00 H new ATOM 0 HA VAL A 41 28.201 -22.275 -8.787 1.00 0.00 H new ATOM 0 HB VAL A 41 31.054 -22.250 -7.714 1.00 0.00 H new ATOM 0 HG11 VAL A 41 31.039 -19.873 -8.352 1.00 0.00 H new ATOM 0 HG12 VAL A 41 30.818 -20.938 -9.761 1.00 0.00 H new ATOM 0 HG13 VAL A 41 29.422 -20.079 -9.067 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.221 -20.566 -6.125 1.00 0.00 H new ATOM 0 HG22 VAL A 41 28.570 -20.801 -6.747 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.406 -22.133 -5.914 1.00 0.00 H new ATOM 625 N VAL A 42 28.919 -23.591 -10.841 1.00 0.00 N ATOM 626 CA VAL A 42 29.383 -24.069 -12.138 1.00 0.00 C ATOM 627 C VAL A 42 30.363 -23.085 -12.768 1.00 0.00 C ATOM 628 O VAL A 42 31.405 -23.479 -13.293 1.00 0.00 O ATOM 629 CB VAL A 42 28.207 -24.296 -13.106 1.00 0.00 C ATOM 630 CG1 VAL A 42 28.705 -24.858 -14.429 1.00 0.00 C ATOM 631 CG2 VAL A 42 27.173 -25.220 -12.480 1.00 0.00 C ATOM 0 H VAL A 42 27.904 -23.544 -10.747 1.00 0.00 H new ATOM 0 HA VAL A 42 29.888 -25.019 -11.963 1.00 0.00 H new ATOM 0 HB VAL A 42 27.731 -23.336 -13.303 1.00 0.00 H new ATOM 0 HG11 VAL A 42 27.860 -25.012 -15.100 1.00 0.00 H new ATOM 0 HG12 VAL A 42 29.405 -24.156 -14.882 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.207 -25.809 -14.254 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.349 -25.370 -13.178 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.634 -26.181 -12.252 1.00 0.00 H new ATOM 0 HG23 VAL A 42 26.794 -24.772 -11.561 1.00 0.00 H new ATOM 641 N LYS A 43 30.023 -21.802 -12.713 1.00 0.00 N ATOM 642 CA LYS A 43 30.872 -20.760 -13.276 1.00 0.00 C ATOM 643 C LYS A 43 31.334 -19.790 -12.193 1.00 0.00 C ATOM 644 O LYS A 43 30.640 -18.823 -11.876 1.00 0.00 O ATOM 645 CB LYS A 43 30.122 -19.999 -14.371 1.00 0.00 C ATOM 646 CG LYS A 43 29.830 -20.837 -15.604 1.00 0.00 C ATOM 647 CD LYS A 43 28.881 -20.124 -16.552 1.00 0.00 C ATOM 648 CE LYS A 43 28.590 -20.963 -17.786 1.00 0.00 C ATOM 649 NZ LYS A 43 29.597 -20.738 -18.860 1.00 0.00 N ATOM 0 H LYS A 43 29.164 -21.459 -12.283 1.00 0.00 H new ATOM 0 HA LYS A 43 31.751 -21.237 -13.710 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.182 -19.627 -13.964 1.00 0.00 H new ATOM 0 HB3 LYS A 43 30.709 -19.129 -14.664 1.00 0.00 H new ATOM 0 HG2 LYS A 43 30.763 -21.061 -16.122 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.396 -21.790 -15.302 1.00 0.00 H new ATOM 0 HD2 LYS A 43 27.948 -19.901 -16.035 1.00 0.00 H new ATOM 0 HD3 LYS A 43 29.315 -19.170 -16.853 1.00 0.00 H new ATOM 0 HE2 LYS A 43 28.579 -22.018 -17.513 1.00 0.00 H new ATOM 0 HE3 LYS A 43 27.596 -20.721 -18.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 29.363 -21.328 -19.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 29.590 -19.736 -19.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.542 -20.993 -18.509 1.00 0.00 H new ATOM 663 N SER A 44 32.509 -20.053 -11.630 1.00 0.00 N ATOM 664 CA SER A 44 33.061 -19.204 -10.581 1.00 0.00 C ATOM 665 C SER A 44 33.453 -17.839 -11.137 1.00 0.00 C ATOM 666 O SER A 44 33.497 -16.849 -10.407 1.00 0.00 O ATOM 667 CB SER A 44 34.278 -19.875 -9.941 1.00 0.00 C ATOM 668 OG SER A 44 35.313 -20.067 -10.891 1.00 0.00 O ATOM 0 H SER A 44 33.097 -20.847 -11.883 1.00 0.00 H new ATOM 0 HA SER A 44 32.292 -19.060 -9.822 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.645 -19.261 -9.118 1.00 0.00 H new ATOM 0 HB3 SER A 44 33.986 -20.836 -9.517 1.00 0.00 H new ATOM 0 HG SER A 44 36.080 -20.496 -10.457 1.00 0.00 H new ATOM 674 N GLU A 45 33.736 -17.794 -12.436 1.00 0.00 N ATOM 675 CA GLU A 45 34.125 -16.551 -13.090 1.00 0.00 C ATOM 676 C GLU A 45 32.903 -15.685 -13.383 1.00 0.00 C ATOM 677 O GLU A 45 32.950 -14.462 -13.252 1.00 0.00 O ATOM 678 CB GLU A 45 34.878 -16.846 -14.389 1.00 0.00 C ATOM 679 CG GLU A 45 34.012 -17.482 -15.463 1.00 0.00 C ATOM 680 CD GLU A 45 34.823 -18.270 -16.474 1.00 0.00 C ATOM 681 OE1 GLU A 45 35.179 -19.429 -16.174 1.00 0.00 O ATOM 682 OE2 GLU A 45 35.100 -17.729 -17.564 1.00 0.00 O ATOM 0 H GLU A 45 33.703 -18.604 -13.055 1.00 0.00 H new ATOM 0 HA GLU A 45 34.782 -16.005 -12.414 1.00 0.00 H new ATOM 0 HB2 GLU A 45 35.297 -15.917 -14.775 1.00 0.00 H new ATOM 0 HB3 GLU A 45 35.716 -17.508 -14.171 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.283 -18.142 -14.993 1.00 0.00 H new ATOM 0 HG3 GLU A 45 33.450 -16.704 -15.980 1.00 0.00 H new ATOM 689 N ALA A 46 31.811 -16.329 -13.781 1.00 0.00 N ATOM 690 CA ALA A 46 30.576 -15.619 -14.091 1.00 0.00 C ATOM 691 C ALA A 46 29.869 -15.165 -12.818 1.00 0.00 C ATOM 692 O ALA A 46 29.270 -14.090 -12.778 1.00 0.00 O ATOM 693 CB ALA A 46 29.656 -16.500 -14.923 1.00 0.00 C ATOM 0 H ALA A 46 31.756 -17.341 -13.896 1.00 0.00 H new ATOM 0 HA ALA A 46 30.831 -14.731 -14.669 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.738 -15.957 -15.147 1.00 0.00 H new ATOM 0 HB2 ALA A 46 30.155 -16.770 -15.854 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.416 -17.405 -14.365 1.00 0.00 H new ATOM 699 N LEU A 47 29.941 -15.992 -11.781 1.00 0.00 N ATOM 700 CA LEU A 47 29.306 -15.676 -10.505 1.00 0.00 C ATOM 701 C LEU A 47 29.805 -14.339 -9.966 1.00 0.00 C ATOM 702 O LEU A 47 29.012 -13.468 -9.609 1.00 0.00 O ATOM 703 CB LEU A 47 29.582 -16.784 -9.488 1.00 0.00 C ATOM 704 CG LEU A 47 29.182 -16.483 -8.043 1.00 0.00 C ATOM 705 CD1 LEU A 47 27.722 -16.064 -7.970 1.00 0.00 C ATOM 706 CD2 LEU A 47 29.436 -17.693 -7.156 1.00 0.00 C ATOM 0 H LEU A 47 30.432 -16.886 -11.798 1.00 0.00 H new ATOM 0 HA LEU A 47 28.231 -15.602 -10.670 1.00 0.00 H new ATOM 0 HB2 LEU A 47 29.057 -17.684 -9.809 1.00 0.00 H new ATOM 0 HB3 LEU A 47 30.648 -17.012 -9.509 1.00 0.00 H new ATOM 0 HG LEU A 47 29.795 -15.657 -7.681 1.00 0.00 H new ATOM 0 HD11 LEU A 47 27.455 -15.854 -6.934 1.00 0.00 H new ATOM 0 HD12 LEU A 47 27.570 -15.169 -8.573 1.00 0.00 H new ATOM 0 HD13 LEU A 47 27.093 -16.869 -8.351 1.00 0.00 H new ATOM 0 HD21 LEU A 47 29.146 -17.460 -6.131 1.00 0.00 H new ATOM 0 HD22 LEU A 47 28.849 -18.538 -7.517 1.00 0.00 H new ATOM 0 HD23 LEU A 47 30.495 -17.949 -7.184 1.00 0.00 H new ATOM 718 N ALA A 48 31.124 -14.183 -9.911 1.00 0.00 N ATOM 719 CA ALA A 48 31.728 -12.951 -9.420 1.00 0.00 C ATOM 720 C ALA A 48 31.492 -11.799 -10.390 1.00 0.00 C ATOM 721 O ALA A 48 31.050 -10.720 -9.994 1.00 0.00 O ATOM 722 CB ALA A 48 33.218 -13.150 -9.187 1.00 0.00 C ATOM 0 H ALA A 48 31.794 -14.895 -10.201 1.00 0.00 H new ATOM 0 HA ALA A 48 31.254 -12.696 -8.472 1.00 0.00 H new ATOM 0 HB1 ALA A 48 33.656 -12.222 -8.820 1.00 0.00 H new ATOM 0 HB2 ALA A 48 33.369 -13.938 -8.450 1.00 0.00 H new ATOM 0 HB3 ALA A 48 33.698 -13.433 -10.124 1.00 0.00 H new ATOM 728 N LYS A 49 31.789 -12.034 -11.664 1.00 0.00 N ATOM 729 CA LYS A 49 31.609 -11.016 -12.692 1.00 0.00 C ATOM 730 C LYS A 49 30.232 -10.368 -12.582 1.00 0.00 C ATOM 731 O LYS A 49 30.106 -9.145 -12.630 1.00 0.00 O ATOM 732 CB LYS A 49 31.786 -11.630 -14.083 1.00 0.00 C ATOM 733 CG LYS A 49 33.186 -11.461 -14.648 1.00 0.00 C ATOM 734 CD LYS A 49 33.505 -12.534 -15.677 1.00 0.00 C ATOM 735 CE LYS A 49 34.927 -12.401 -16.198 1.00 0.00 C ATOM 736 NZ LYS A 49 35.067 -11.260 -17.145 1.00 0.00 N ATOM 0 H LYS A 49 32.156 -12.921 -12.009 1.00 0.00 H new ATOM 0 HA LYS A 49 32.366 -10.246 -12.542 1.00 0.00 H new ATOM 0 HB2 LYS A 49 31.548 -12.693 -14.035 1.00 0.00 H new ATOM 0 HB3 LYS A 49 31.070 -11.174 -14.766 1.00 0.00 H new ATOM 0 HG2 LYS A 49 33.278 -10.477 -15.107 1.00 0.00 H new ATOM 0 HG3 LYS A 49 33.914 -11.504 -13.838 1.00 0.00 H new ATOM 0 HD2 LYS A 49 33.371 -13.519 -15.230 1.00 0.00 H new ATOM 0 HD3 LYS A 49 32.804 -12.462 -16.508 1.00 0.00 H new ATOM 0 HE2 LYS A 49 35.609 -12.263 -15.359 1.00 0.00 H new ATOM 0 HE3 LYS A 49 35.219 -13.325 -16.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 36.051 -11.203 -17.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 34.435 -11.404 -17.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 34.813 -10.375 -16.662 1.00 0.00 H new ATOM 750 N MET A 50 29.204 -11.197 -12.434 1.00 0.00 N ATOM 751 CA MET A 50 27.837 -10.704 -12.314 1.00 0.00 C ATOM 752 C MET A 50 27.643 -9.952 -11.001 1.00 0.00 C ATOM 753 O MET A 50 27.061 -8.868 -10.977 1.00 0.00 O ATOM 754 CB MET A 50 26.844 -11.865 -12.401 1.00 0.00 C ATOM 755 CG MET A 50 26.321 -12.113 -13.807 1.00 0.00 C ATOM 756 SD MET A 50 24.675 -11.425 -14.067 1.00 0.00 S ATOM 757 CE MET A 50 23.700 -12.458 -12.976 1.00 0.00 C ATOM 0 H MET A 50 29.292 -12.212 -12.394 1.00 0.00 H new ATOM 0 HA MET A 50 27.653 -10.015 -13.138 1.00 0.00 H new ATOM 0 HB2 MET A 50 27.325 -12.772 -12.036 1.00 0.00 H new ATOM 0 HB3 MET A 50 26.002 -11.663 -11.739 1.00 0.00 H new ATOM 0 HG2 MET A 50 27.011 -11.677 -14.529 1.00 0.00 H new ATOM 0 HG3 MET A 50 26.296 -13.186 -13.997 1.00 0.00 H new ATOM 0 HE1 MET A 50 22.837 -12.847 -13.517 1.00 0.00 H new ATOM 0 HE2 MET A 50 24.310 -13.289 -12.620 1.00 0.00 H new ATOM 0 HE3 MET A 50 23.359 -11.868 -12.125 1.00 0.00 H new ATOM 767 N TRP A 51 28.135 -10.534 -9.913 1.00 0.00 N ATOM 768 CA TRP A 51 28.015 -9.917 -8.597 1.00 0.00 C ATOM 769 C TRP A 51 28.530 -8.483 -8.618 1.00 0.00 C ATOM 770 O TRP A 51 27.813 -7.550 -8.261 1.00 0.00 O ATOM 771 CB TRP A 51 28.785 -10.733 -7.557 1.00 0.00 C ATOM 772 CG TRP A 51 28.913 -10.040 -6.234 1.00 0.00 C ATOM 773 CD1 TRP A 51 30.059 -9.853 -5.515 1.00 0.00 C ATOM 774 CD2 TRP A 51 27.857 -9.444 -5.473 1.00 0.00 C ATOM 775 NE1 TRP A 51 29.779 -9.176 -4.353 1.00 0.00 N ATOM 776 CE2 TRP A 51 28.436 -8.913 -4.303 1.00 0.00 C ATOM 777 CE3 TRP A 51 26.481 -9.305 -5.666 1.00 0.00 C ATOM 778 CZ2 TRP A 51 27.683 -8.256 -3.333 1.00 0.00 C ATOM 779 CZ3 TRP A 51 25.735 -8.653 -4.703 1.00 0.00 C ATOM 780 CH2 TRP A 51 26.337 -8.135 -3.548 1.00 0.00 C ATOM 0 H TRP A 51 28.620 -11.431 -9.916 1.00 0.00 H new ATOM 0 HA TRP A 51 26.959 -9.899 -8.327 1.00 0.00 H new ATOM 0 HB2 TRP A 51 28.282 -11.689 -7.411 1.00 0.00 H new ATOM 0 HB3 TRP A 51 29.781 -10.952 -7.942 1.00 0.00 H new ATOM 0 HD1 TRP A 51 31.041 -10.188 -5.816 1.00 0.00 H new ATOM 0 HE1 TRP A 51 30.461 -8.912 -3.642 1.00 0.00 H new ATOM 0 HE3 TRP A 51 26.008 -9.700 -6.553 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 28.145 -7.856 -2.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 24.670 -8.541 -4.843 1.00 0.00 H new ATOM 0 HH2 TRP A 51 25.727 -7.631 -2.814 1.00 0.00 H new ATOM 791 N GLY A 52 29.780 -8.313 -9.041 1.00 0.00 N ATOM 792 CA GLY A 52 30.369 -6.989 -9.101 1.00 0.00 C ATOM 793 C GLY A 52 29.490 -5.995 -9.833 1.00 0.00 C ATOM 794 O GLY A 52 29.376 -4.840 -9.426 1.00 0.00 O ATOM 0 H GLY A 52 30.394 -9.069 -9.343 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.552 -6.630 -8.088 1.00 0.00 H new ATOM 0 HA3 GLY A 52 31.337 -7.048 -9.598 1.00 0.00 H new ATOM 798 N GLN A 53 28.868 -6.445 -10.918 1.00 0.00 N ATOM 799 CA GLN A 53 27.996 -5.586 -11.710 1.00 0.00 C ATOM 800 C GLN A 53 26.915 -4.955 -10.838 1.00 0.00 C ATOM 801 O GLN A 53 26.521 -3.809 -11.054 1.00 0.00 O ATOM 802 CB GLN A 53 27.350 -6.385 -12.844 1.00 0.00 C ATOM 803 CG GLN A 53 28.353 -6.955 -13.834 1.00 0.00 C ATOM 804 CD GLN A 53 28.183 -6.387 -15.229 1.00 0.00 C ATOM 805 OE1 GLN A 53 27.316 -6.822 -15.987 1.00 0.00 O ATOM 806 NE2 GLN A 53 29.013 -5.410 -15.576 1.00 0.00 N ATOM 0 H GLN A 53 28.952 -7.399 -11.269 1.00 0.00 H new ATOM 0 HA GLN A 53 28.605 -4.789 -12.137 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.769 -7.202 -12.416 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.650 -5.742 -13.378 1.00 0.00 H new ATOM 0 HG2 GLN A 53 29.363 -6.747 -13.482 1.00 0.00 H new ATOM 0 HG3 GLN A 53 28.245 -8.039 -13.871 1.00 0.00 H new ATOM 0 HE21 GLN A 53 29.717 -5.080 -14.916 1.00 0.00 H new ATOM 0 HE22 GLN A 53 28.946 -4.989 -16.503 1.00 0.00 H new ATOM 815 N ARG A 54 26.440 -5.710 -9.853 1.00 0.00 N ATOM 816 CA ARG A 54 25.404 -5.225 -8.950 1.00 0.00 C ATOM 817 C ARG A 54 25.957 -4.152 -8.016 1.00 0.00 C ATOM 818 O ARG A 54 25.258 -3.202 -7.662 1.00 0.00 O ATOM 819 CB ARG A 54 24.829 -6.382 -8.131 1.00 0.00 C ATOM 820 CG ARG A 54 24.697 -7.677 -8.915 1.00 0.00 C ATOM 821 CD ARG A 54 23.944 -7.464 -10.219 1.00 0.00 C ATOM 822 NE ARG A 54 22.497 -7.478 -10.023 1.00 0.00 N ATOM 823 CZ ARG A 54 21.620 -7.332 -11.010 1.00 0.00 C ATOM 824 NH1 ARG A 54 22.042 -7.162 -12.256 1.00 0.00 N ATOM 825 NH2 ARG A 54 20.319 -7.356 -10.753 1.00 0.00 N ATOM 0 H ARG A 54 26.756 -6.660 -9.660 1.00 0.00 H new ATOM 0 HA ARG A 54 24.609 -4.785 -9.552 1.00 0.00 H new ATOM 0 HB2 ARG A 54 25.467 -6.555 -7.265 1.00 0.00 H new ATOM 0 HB3 ARG A 54 23.848 -6.095 -7.752 1.00 0.00 H new ATOM 0 HG2 ARG A 54 25.688 -8.078 -9.127 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.176 -8.419 -8.310 1.00 0.00 H new ATOM 0 HD2 ARG A 54 24.241 -6.512 -10.658 1.00 0.00 H new ATOM 0 HD3 ARG A 54 24.221 -8.243 -10.929 1.00 0.00 H new ATOM 0 HE ARG A 54 22.140 -7.607 -9.076 1.00 0.00 H new ATOM 0 HH11 ARG A 54 23.042 -7.143 -12.458 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.367 -7.050 -13.012 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.990 -7.487 -9.796 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.647 -7.244 -11.512 1.00 0.00 H new ATOM 839 N LYS A 55 27.215 -4.310 -7.620 1.00 0.00 N ATOM 840 CA LYS A 55 27.863 -3.355 -6.728 1.00 0.00 C ATOM 841 C LYS A 55 28.648 -2.316 -7.522 1.00 0.00 C ATOM 842 O LYS A 55 29.340 -1.474 -6.948 1.00 0.00 O ATOM 843 CB LYS A 55 28.795 -4.084 -5.758 1.00 0.00 C ATOM 844 CG LYS A 55 28.071 -5.018 -4.805 1.00 0.00 C ATOM 845 CD LYS A 55 28.268 -4.600 -3.357 1.00 0.00 C ATOM 846 CE LYS A 55 26.990 -4.769 -2.549 1.00 0.00 C ATOM 847 NZ LYS A 55 27.274 -5.099 -1.125 1.00 0.00 N ATOM 0 H LYS A 55 27.807 -5.091 -7.903 1.00 0.00 H new ATOM 0 HA LYS A 55 27.088 -2.842 -6.160 1.00 0.00 H new ATOM 0 HB2 LYS A 55 29.525 -4.657 -6.330 1.00 0.00 H new ATOM 0 HB3 LYS A 55 29.351 -3.347 -5.179 1.00 0.00 H new ATOM 0 HG2 LYS A 55 27.007 -5.026 -5.041 1.00 0.00 H new ATOM 0 HG3 LYS A 55 28.436 -6.036 -4.944 1.00 0.00 H new ATOM 0 HD2 LYS A 55 29.064 -5.196 -2.910 1.00 0.00 H new ATOM 0 HD3 LYS A 55 28.589 -3.559 -3.318 1.00 0.00 H new ATOM 0 HE2 LYS A 55 26.404 -3.851 -2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 55 26.383 -5.559 -2.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 26.378 -5.206 -0.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 27.811 -5.988 -1.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 27.832 -4.333 -0.696 1.00 0.00 H new ATOM 861 N LYS A 56 28.537 -2.380 -8.844 1.00 0.00 N ATOM 862 CA LYS A 56 29.234 -1.443 -9.717 1.00 0.00 C ATOM 863 C LYS A 56 30.678 -1.248 -9.264 1.00 0.00 C ATOM 864 O LYS A 56 31.149 -0.120 -9.130 1.00 0.00 O ATOM 865 CB LYS A 56 28.509 -0.095 -9.737 1.00 0.00 C ATOM 866 CG LYS A 56 27.072 -0.186 -10.221 1.00 0.00 C ATOM 867 CD LYS A 56 26.448 1.191 -10.376 1.00 0.00 C ATOM 868 CE LYS A 56 24.943 1.149 -10.160 1.00 0.00 C ATOM 869 NZ LYS A 56 24.419 2.448 -9.655 1.00 0.00 N ATOM 0 H LYS A 56 27.970 -3.072 -9.335 1.00 0.00 H new ATOM 0 HA LYS A 56 29.240 -1.860 -10.724 1.00 0.00 H new ATOM 0 HB2 LYS A 56 28.519 0.329 -8.733 1.00 0.00 H new ATOM 0 HB3 LYS A 56 29.057 0.594 -10.380 1.00 0.00 H new ATOM 0 HG2 LYS A 56 27.041 -0.710 -11.176 1.00 0.00 H new ATOM 0 HG3 LYS A 56 26.486 -0.775 -9.515 1.00 0.00 H new ATOM 0 HD2 LYS A 56 26.900 1.879 -9.661 1.00 0.00 H new ATOM 0 HD3 LYS A 56 26.663 1.579 -11.372 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.448 0.898 -11.098 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.700 0.359 -9.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 23.390 2.379 -9.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 24.872 2.676 -8.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.628 3.198 -10.344 1.00 0.00 H new ATOM 883 N ASN A 57 31.375 -2.355 -9.031 1.00 0.00 N ATOM 884 CA ASN A 57 32.765 -2.306 -8.594 1.00 0.00 C ATOM 885 C ASN A 57 33.714 -2.395 -9.786 1.00 0.00 C ATOM 886 O ASN A 57 34.663 -1.619 -9.896 1.00 0.00 O ATOM 887 CB ASN A 57 33.054 -3.443 -7.612 1.00 0.00 C ATOM 888 CG ASN A 57 34.489 -3.434 -7.123 1.00 0.00 C ATOM 889 OD1 ASN A 57 35.244 -2.500 -7.396 1.00 0.00 O ATOM 890 ND2 ASN A 57 34.873 -4.477 -6.396 1.00 0.00 N ATOM 0 H ASN A 57 31.000 -3.297 -9.138 1.00 0.00 H new ATOM 0 HA ASN A 57 32.928 -1.352 -8.093 1.00 0.00 H new ATOM 0 HB2 ASN A 57 32.382 -3.361 -6.758 1.00 0.00 H new ATOM 0 HB3 ASN A 57 32.843 -4.398 -8.094 1.00 0.00 H new ATOM 0 HD21 ASN A 57 35.827 -4.526 -6.039 1.00 0.00 H new ATOM 0 HD22 ASN A 57 34.214 -5.229 -6.194 1.00 0.00 H new ATOM 897 N ASP A 58 33.449 -3.345 -10.676 1.00 0.00 N ATOM 898 CA ASP A 58 34.278 -3.535 -11.861 1.00 0.00 C ATOM 899 C ASP A 58 35.501 -4.388 -11.537 1.00 0.00 C ATOM 900 O ASP A 58 35.967 -5.163 -12.372 1.00 0.00 O ATOM 901 CB ASP A 58 34.718 -2.183 -12.424 1.00 0.00 C ATOM 902 CG ASP A 58 33.638 -1.125 -12.299 1.00 0.00 C ATOM 903 OD1 ASP A 58 32.471 -1.495 -12.052 1.00 0.00 O ATOM 904 OD2 ASP A 58 33.961 0.071 -12.449 1.00 0.00 O ATOM 0 H ASP A 58 32.667 -3.995 -10.600 1.00 0.00 H new ATOM 0 HA ASP A 58 33.683 -4.055 -12.611 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.613 -1.848 -11.900 1.00 0.00 H new ATOM 0 HB3 ASP A 58 34.988 -2.300 -13.473 1.00 0.00 H new ATOM 909 N ARG A 59 36.016 -4.237 -10.322 1.00 0.00 N ATOM 910 CA ARG A 59 37.186 -4.992 -9.889 1.00 0.00 C ATOM 911 C ARG A 59 36.774 -6.224 -9.089 1.00 0.00 C ATOM 912 O ARG A 59 37.555 -6.754 -8.300 1.00 0.00 O ATOM 913 CB ARG A 59 38.106 -4.108 -9.045 1.00 0.00 C ATOM 914 CG ARG A 59 38.969 -3.166 -9.869 1.00 0.00 C ATOM 915 CD ARG A 59 38.667 -1.710 -9.550 1.00 0.00 C ATOM 916 NE ARG A 59 39.188 -1.317 -8.243 1.00 0.00 N ATOM 917 CZ ARG A 59 38.842 -0.195 -7.622 1.00 0.00 C ATOM 918 NH1 ARG A 59 37.980 0.640 -8.184 1.00 0.00 N ATOM 919 NH2 ARG A 59 39.360 0.093 -6.434 1.00 0.00 N ATOM 0 H ARG A 59 35.642 -3.599 -9.620 1.00 0.00 H new ATOM 0 HA ARG A 59 37.724 -5.321 -10.778 1.00 0.00 H new ATOM 0 HB2 ARG A 59 37.500 -3.522 -8.355 1.00 0.00 H new ATOM 0 HB3 ARG A 59 38.752 -4.744 -8.440 1.00 0.00 H new ATOM 0 HG2 ARG A 59 40.022 -3.371 -9.674 1.00 0.00 H new ATOM 0 HG3 ARG A 59 38.799 -3.350 -10.930 1.00 0.00 H new ATOM 0 HD2 ARG A 59 39.101 -1.072 -10.320 1.00 0.00 H new ATOM 0 HD3 ARG A 59 37.589 -1.550 -9.574 1.00 0.00 H new ATOM 0 HE ARG A 59 39.853 -1.938 -7.782 1.00 0.00 H new ATOM 0 HH11 ARG A 59 37.580 0.422 -9.097 1.00 0.00 H new ATOM 0 HH12 ARG A 59 37.717 1.501 -7.704 1.00 0.00 H new ATOM 0 HH21 ARG A 59 40.024 -0.547 -5.998 1.00 0.00 H new ATOM 0 HH22 ARG A 59 39.094 0.955 -5.957 1.00 0.00 H new ATOM 933 N MET A 60 35.541 -6.674 -9.299 1.00 0.00 N ATOM 934 CA MET A 60 35.025 -7.843 -8.597 1.00 0.00 C ATOM 935 C MET A 60 35.607 -9.127 -9.180 1.00 0.00 C ATOM 936 O MET A 60 35.838 -9.225 -10.386 1.00 0.00 O ATOM 937 CB MET A 60 33.497 -7.880 -8.677 1.00 0.00 C ATOM 938 CG MET A 60 32.880 -9.074 -7.967 1.00 0.00 C ATOM 939 SD MET A 60 33.401 -9.203 -6.245 1.00 0.00 S ATOM 940 CE MET A 60 32.410 -7.914 -5.494 1.00 0.00 C ATOM 0 H MET A 60 34.881 -6.247 -9.949 1.00 0.00 H new ATOM 0 HA MET A 60 35.325 -7.770 -7.552 1.00 0.00 H new ATOM 0 HB2 MET A 60 33.096 -6.963 -8.244 1.00 0.00 H new ATOM 0 HB3 MET A 60 33.196 -7.896 -9.725 1.00 0.00 H new ATOM 0 HG2 MET A 60 31.794 -8.995 -8.009 1.00 0.00 H new ATOM 0 HG3 MET A 60 33.154 -9.987 -8.495 1.00 0.00 H new ATOM 0 HE1 MET A 60 32.130 -8.212 -4.484 1.00 0.00 H new ATOM 0 HE2 MET A 60 32.986 -6.989 -5.453 1.00 0.00 H new ATOM 0 HE3 MET A 60 31.510 -7.755 -6.088 1.00 0.00 H new ATOM 950 N THR A 61 35.842 -10.111 -8.317 1.00 0.00 N ATOM 951 CA THR A 61 36.398 -11.388 -8.746 1.00 0.00 C ATOM 952 C THR A 61 36.249 -12.446 -7.659 1.00 0.00 C ATOM 953 O THR A 61 36.404 -12.157 -6.472 1.00 0.00 O ATOM 954 CB THR A 61 37.887 -11.256 -9.117 1.00 0.00 C ATOM 955 OG1 THR A 61 38.393 -12.516 -9.572 1.00 0.00 O ATOM 956 CG2 THR A 61 38.702 -10.778 -7.924 1.00 0.00 C ATOM 0 H THR A 61 35.656 -10.047 -7.316 1.00 0.00 H new ATOM 0 HA THR A 61 35.837 -11.696 -9.628 1.00 0.00 H new ATOM 0 HB THR A 61 37.975 -10.520 -9.916 1.00 0.00 H new ATOM 0 HG1 THR A 61 39.340 -12.423 -9.807 1.00 0.00 H new ATOM 0 HG21 THR A 61 39.750 -10.692 -8.210 1.00 0.00 H new ATOM 0 HG22 THR A 61 38.334 -9.805 -7.598 1.00 0.00 H new ATOM 0 HG23 THR A 61 38.606 -11.494 -7.108 1.00 0.00 H new ATOM 964 N TYR A 62 35.947 -13.672 -8.071 1.00 0.00 N ATOM 965 CA TYR A 62 35.775 -14.773 -7.131 1.00 0.00 C ATOM 966 C TYR A 62 36.773 -14.670 -5.983 1.00 0.00 C ATOM 967 O TYR A 62 36.425 -14.887 -4.822 1.00 0.00 O ATOM 968 CB TYR A 62 35.942 -16.114 -7.848 1.00 0.00 C ATOM 969 CG TYR A 62 35.212 -17.255 -7.177 1.00 0.00 C ATOM 970 CD1 TYR A 62 33.895 -17.112 -6.758 1.00 0.00 C ATOM 971 CD2 TYR A 62 35.840 -18.476 -6.960 1.00 0.00 C ATOM 972 CE1 TYR A 62 33.224 -18.152 -6.144 1.00 0.00 C ATOM 973 CE2 TYR A 62 35.177 -19.521 -6.347 1.00 0.00 C ATOM 974 CZ TYR A 62 33.869 -19.354 -5.941 1.00 0.00 C ATOM 975 OH TYR A 62 33.205 -20.393 -5.329 1.00 0.00 O ATOM 0 H TYR A 62 35.816 -13.928 -9.050 1.00 0.00 H new ATOM 0 HA TYR A 62 34.768 -14.712 -6.719 1.00 0.00 H new ATOM 0 HB2 TYR A 62 35.582 -16.016 -8.872 1.00 0.00 H new ATOM 0 HB3 TYR A 62 37.003 -16.356 -7.905 1.00 0.00 H new ATOM 0 HD1 TYR A 62 33.387 -16.172 -6.915 1.00 0.00 H new ATOM 0 HD2 TYR A 62 36.864 -18.610 -7.276 1.00 0.00 H new ATOM 0 HE1 TYR A 62 32.200 -18.024 -5.825 1.00 0.00 H new ATOM 0 HE2 TYR A 62 35.679 -20.463 -6.186 1.00 0.00 H new ATOM 0 HH TYR A 62 32.499 -20.035 -4.751 1.00 0.00 H new ATOM 985 N GLU A 63 38.016 -14.337 -6.316 1.00 0.00 N ATOM 986 CA GLU A 63 39.066 -14.205 -5.312 1.00 0.00 C ATOM 987 C GLU A 63 38.622 -13.285 -4.178 1.00 0.00 C ATOM 988 O GLU A 63 38.795 -13.603 -3.001 1.00 0.00 O ATOM 989 CB GLU A 63 40.347 -13.664 -5.950 1.00 0.00 C ATOM 990 CG GLU A 63 41.557 -14.560 -5.741 1.00 0.00 C ATOM 991 CD GLU A 63 42.835 -13.949 -6.281 1.00 0.00 C ATOM 992 OE1 GLU A 63 42.761 -13.199 -7.276 1.00 0.00 O ATOM 993 OE2 GLU A 63 43.911 -14.223 -5.708 1.00 0.00 O ATOM 0 H GLU A 63 38.321 -14.154 -7.272 1.00 0.00 H new ATOM 0 HA GLU A 63 39.264 -15.194 -4.898 1.00 0.00 H new ATOM 0 HB2 GLU A 63 40.183 -13.533 -7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 63 40.560 -12.678 -5.537 1.00 0.00 H new ATOM 0 HG2 GLU A 63 41.676 -14.761 -4.676 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.383 -15.519 -6.229 1.00 0.00 H new ATOM 1000 N LYS A 64 38.049 -12.142 -4.541 1.00 0.00 N ATOM 1001 CA LYS A 64 37.579 -11.175 -3.556 1.00 0.00 C ATOM 1002 C LYS A 64 36.200 -11.560 -3.031 1.00 0.00 C ATOM 1003 O LYS A 64 35.944 -11.502 -1.827 1.00 0.00 O ATOM 1004 CB LYS A 64 37.530 -9.774 -4.170 1.00 0.00 C ATOM 1005 CG LYS A 64 38.857 -9.317 -4.750 1.00 0.00 C ATOM 1006 CD LYS A 64 38.714 -8.008 -5.508 1.00 0.00 C ATOM 1007 CE LYS A 64 39.898 -7.766 -6.431 1.00 0.00 C ATOM 1008 NZ LYS A 64 40.860 -6.787 -5.855 1.00 0.00 N ATOM 0 H LYS A 64 37.899 -11.863 -5.511 1.00 0.00 H new ATOM 0 HA LYS A 64 38.279 -11.175 -2.721 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.775 -9.757 -4.956 1.00 0.00 H new ATOM 0 HB3 LYS A 64 37.212 -9.063 -3.407 1.00 0.00 H new ATOM 0 HG2 LYS A 64 39.584 -9.196 -3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.246 -10.085 -5.419 1.00 0.00 H new ATOM 0 HD2 LYS A 64 37.794 -8.023 -6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.629 -7.184 -4.800 1.00 0.00 H new ATOM 0 HE2 LYS A 64 40.410 -8.710 -6.620 1.00 0.00 H new ATOM 0 HE3 LYS A 64 39.539 -7.400 -7.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 41.652 -6.650 -6.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 40.379 -5.879 -5.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 41.222 -7.148 -4.949 1.00 0.00 H new ATOM 1022 N LEU A 65 35.315 -11.955 -3.940 1.00 0.00 N ATOM 1023 CA LEU A 65 33.961 -12.352 -3.567 1.00 0.00 C ATOM 1024 C LEU A 65 33.986 -13.392 -2.451 1.00 0.00 C ATOM 1025 O LEU A 65 33.264 -13.271 -1.461 1.00 0.00 O ATOM 1026 CB LEU A 65 33.220 -12.910 -4.783 1.00 0.00 C ATOM 1027 CG LEU A 65 31.870 -13.570 -4.501 1.00 0.00 C ATOM 1028 CD1 LEU A 65 30.838 -13.137 -5.531 1.00 0.00 C ATOM 1029 CD2 LEU A 65 32.009 -15.086 -4.488 1.00 0.00 C ATOM 0 H LEU A 65 35.510 -12.009 -4.940 1.00 0.00 H new ATOM 0 HA LEU A 65 33.437 -11.468 -3.203 1.00 0.00 H new ATOM 0 HB2 LEU A 65 33.064 -12.097 -5.493 1.00 0.00 H new ATOM 0 HB3 LEU A 65 33.864 -13.641 -5.272 1.00 0.00 H new ATOM 0 HG LEU A 65 31.529 -13.248 -3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 65 29.884 -13.617 -5.314 1.00 0.00 H new ATOM 0 HD12 LEU A 65 30.717 -12.054 -5.492 1.00 0.00 H new ATOM 0 HD13 LEU A 65 31.173 -13.429 -6.526 1.00 0.00 H new ATOM 0 HD21 LEU A 65 31.038 -15.539 -4.286 1.00 0.00 H new ATOM 0 HD22 LEU A 65 32.373 -15.426 -5.457 1.00 0.00 H new ATOM 0 HD23 LEU A 65 32.715 -15.380 -3.712 1.00 0.00 H new ATOM 1041 N SER A 66 34.823 -14.411 -2.618 1.00 0.00 N ATOM 1042 CA SER A 66 34.940 -15.473 -1.625 1.00 0.00 C ATOM 1043 C SER A 66 34.982 -14.895 -0.214 1.00 0.00 C ATOM 1044 O SER A 66 34.429 -15.473 0.722 1.00 0.00 O ATOM 1045 CB SER A 66 36.197 -16.306 -1.885 1.00 0.00 C ATOM 1046 OG SER A 66 37.362 -15.616 -1.465 1.00 0.00 O ATOM 0 H SER A 66 35.429 -14.524 -3.430 1.00 0.00 H new ATOM 0 HA SER A 66 34.063 -16.115 -1.710 1.00 0.00 H new ATOM 0 HB2 SER A 66 36.123 -17.256 -1.356 1.00 0.00 H new ATOM 0 HB3 SER A 66 36.271 -16.537 -2.948 1.00 0.00 H new ATOM 0 HG SER A 66 37.654 -15.006 -2.174 1.00 0.00 H new ATOM 1052 N ARG A 67 35.642 -13.751 -0.069 1.00 0.00 N ATOM 1053 CA ARG A 67 35.758 -13.094 1.228 1.00 0.00 C ATOM 1054 C ARG A 67 34.427 -13.123 1.972 1.00 0.00 C ATOM 1055 O ARG A 67 34.385 -13.349 3.181 1.00 0.00 O ATOM 1056 CB ARG A 67 36.225 -11.648 1.051 1.00 0.00 C ATOM 1057 CG ARG A 67 35.086 -10.658 0.873 1.00 0.00 C ATOM 1058 CD ARG A 67 35.597 -9.226 0.814 1.00 0.00 C ATOM 1059 NE ARG A 67 34.526 -8.254 1.017 1.00 0.00 N ATOM 1060 CZ ARG A 67 33.677 -7.887 0.065 1.00 0.00 C ATOM 1061 NH1 ARG A 67 33.772 -8.408 -1.151 1.00 0.00 N ATOM 1062 NH2 ARG A 67 32.729 -6.996 0.327 1.00 0.00 N ATOM 0 H ARG A 67 36.105 -13.259 -0.834 1.00 0.00 H new ATOM 0 HA ARG A 67 36.496 -13.637 1.818 1.00 0.00 H new ATOM 0 HB2 ARG A 67 36.816 -11.357 1.920 1.00 0.00 H new ATOM 0 HB3 ARG A 67 36.883 -11.591 0.184 1.00 0.00 H new ATOM 0 HG2 ARG A 67 34.541 -10.889 -0.042 1.00 0.00 H new ATOM 0 HG3 ARG A 67 34.381 -10.760 1.698 1.00 0.00 H new ATOM 0 HD2 ARG A 67 36.365 -9.083 1.574 1.00 0.00 H new ATOM 0 HD3 ARG A 67 36.069 -9.049 -0.153 1.00 0.00 H new ATOM 0 HE ARG A 67 34.425 -7.834 1.941 1.00 0.00 H new ATOM 0 HH11 ARG A 67 34.499 -9.093 -1.357 1.00 0.00 H new ATOM 0 HH12 ARG A 67 33.118 -8.124 -1.880 1.00 0.00 H new ATOM 0 HH21 ARG A 67 32.652 -6.593 1.261 1.00 0.00 H new ATOM 0 HH22 ARG A 67 32.077 -6.715 -0.405 1.00 0.00 H new ATOM 1076 N ALA A 68 33.341 -12.890 1.242 1.00 0.00 N ATOM 1077 CA ALA A 68 32.009 -12.891 1.832 1.00 0.00 C ATOM 1078 C ALA A 68 31.515 -14.313 2.072 1.00 0.00 C ATOM 1079 O ALA A 68 30.813 -14.582 3.049 1.00 0.00 O ATOM 1080 CB ALA A 68 31.035 -12.136 0.939 1.00 0.00 C ATOM 0 H ALA A 68 33.358 -12.698 0.240 1.00 0.00 H new ATOM 0 HA ALA A 68 32.067 -12.387 2.797 1.00 0.00 H new ATOM 0 HB1 ALA A 68 30.044 -12.145 1.392 1.00 0.00 H new ATOM 0 HB2 ALA A 68 31.372 -11.106 0.823 1.00 0.00 H new ATOM 0 HB3 ALA A 68 30.991 -12.616 -0.039 1.00 0.00 H new ATOM 1086 N LEU A 69 31.885 -15.222 1.177 1.00 0.00 N ATOM 1087 CA LEU A 69 31.478 -16.618 1.290 1.00 0.00 C ATOM 1088 C LEU A 69 32.042 -17.248 2.560 1.00 0.00 C ATOM 1089 O LEU A 69 31.409 -18.108 3.172 1.00 0.00 O ATOM 1090 CB LEU A 69 31.945 -17.407 0.066 1.00 0.00 C ATOM 1091 CG LEU A 69 31.559 -16.826 -1.294 1.00 0.00 C ATOM 1092 CD1 LEU A 69 32.058 -17.721 -2.418 1.00 0.00 C ATOM 1093 CD2 LEU A 69 30.051 -16.641 -1.387 1.00 0.00 C ATOM 0 H LEU A 69 32.467 -15.017 0.364 1.00 0.00 H new ATOM 0 HA LEU A 69 30.390 -16.650 1.342 1.00 0.00 H new ATOM 0 HB2 LEU A 69 33.031 -17.493 0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.542 -18.417 0.135 1.00 0.00 H new ATOM 0 HG LEU A 69 32.032 -15.849 -1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.774 -17.291 -3.379 1.00 0.00 H new ATOM 0 HD12 LEU A 69 33.144 -17.802 -2.364 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.615 -18.712 -2.318 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.795 -16.226 -2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.558 -17.605 -1.261 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.719 -15.959 -0.604 1.00 0.00 H new ATOM 1105 N ARG A 70 33.235 -16.811 2.952 1.00 0.00 N ATOM 1106 CA ARG A 70 33.883 -17.331 4.150 1.00 0.00 C ATOM 1107 C ARG A 70 33.491 -16.515 5.378 1.00 0.00 C ATOM 1108 O ARG A 70 33.547 -17.005 6.506 1.00 0.00 O ATOM 1109 CB ARG A 70 35.403 -17.317 3.979 1.00 0.00 C ATOM 1110 CG ARG A 70 35.879 -17.987 2.701 1.00 0.00 C ATOM 1111 CD ARG A 70 36.143 -19.469 2.914 1.00 0.00 C ATOM 1112 NE ARG A 70 37.449 -19.872 2.399 1.00 0.00 N ATOM 1113 CZ ARG A 70 38.595 -19.331 2.798 1.00 0.00 C ATOM 1114 NH1 ARG A 70 38.596 -18.371 3.712 1.00 0.00 N ATOM 1115 NH2 ARG A 70 39.743 -19.751 2.282 1.00 0.00 N ATOM 0 H ARG A 70 33.772 -16.099 2.457 1.00 0.00 H new ATOM 0 HA ARG A 70 33.550 -18.358 4.297 1.00 0.00 H new ATOM 0 HB2 ARG A 70 35.752 -16.284 3.989 1.00 0.00 H new ATOM 0 HB3 ARG A 70 35.861 -17.816 4.833 1.00 0.00 H new ATOM 0 HG2 ARG A 70 35.129 -17.858 1.920 1.00 0.00 H new ATOM 0 HG3 ARG A 70 36.790 -17.501 2.351 1.00 0.00 H new ATOM 0 HD2 ARG A 70 36.087 -19.698 3.978 1.00 0.00 H new ATOM 0 HD3 ARG A 70 35.364 -20.050 2.421 1.00 0.00 H new ATOM 0 HE ARG A 70 37.483 -20.609 1.695 1.00 0.00 H new ATOM 0 HH11 ARG A 70 37.715 -18.046 4.111 1.00 0.00 H new ATOM 0 HH12 ARG A 70 39.477 -17.958 4.016 1.00 0.00 H new ATOM 0 HH21 ARG A 70 39.746 -20.490 1.579 1.00 0.00 H new ATOM 0 HH22 ARG A 70 40.622 -19.335 2.589 1.00 0.00 H new ATOM 1129 N TYR A 71 33.094 -15.267 5.151 1.00 0.00 N ATOM 1130 CA TYR A 71 32.695 -14.382 6.239 1.00 0.00 C ATOM 1131 C TYR A 71 31.260 -14.663 6.671 1.00 0.00 C ATOM 1132 O TYR A 71 30.818 -14.211 7.728 1.00 0.00 O ATOM 1133 CB TYR A 71 32.834 -12.920 5.812 1.00 0.00 C ATOM 1134 CG TYR A 71 32.353 -11.936 6.854 1.00 0.00 C ATOM 1135 CD1 TYR A 71 31.015 -11.573 6.930 1.00 0.00 C ATOM 1136 CD2 TYR A 71 33.238 -11.371 7.765 1.00 0.00 C ATOM 1137 CE1 TYR A 71 30.571 -10.674 7.880 1.00 0.00 C ATOM 1138 CE2 TYR A 71 32.803 -10.473 8.720 1.00 0.00 C ATOM 1139 CZ TYR A 71 31.469 -10.127 8.773 1.00 0.00 C ATOM 1140 OH TYR A 71 31.031 -9.232 9.722 1.00 0.00 O ATOM 0 H TYR A 71 33.040 -14.846 4.224 1.00 0.00 H new ATOM 0 HA TYR A 71 33.354 -14.570 7.087 1.00 0.00 H new ATOM 0 HB2 TYR A 71 33.880 -12.714 5.586 1.00 0.00 H new ATOM 0 HB3 TYR A 71 32.272 -12.764 4.891 1.00 0.00 H new ATOM 0 HD1 TYR A 71 30.309 -12.001 6.234 1.00 0.00 H new ATOM 0 HD2 TYR A 71 34.284 -11.639 7.725 1.00 0.00 H new ATOM 0 HE1 TYR A 71 29.527 -10.401 7.923 1.00 0.00 H new ATOM 0 HE2 TYR A 71 33.504 -10.044 9.421 1.00 0.00 H new ATOM 0 HH TYR A 71 31.788 -8.942 10.273 1.00 0.00 H new ATOM 1150 N TYR A 72 30.537 -15.413 5.847 1.00 0.00 N ATOM 1151 CA TYR A 72 29.150 -15.754 6.142 1.00 0.00 C ATOM 1152 C TYR A 72 29.072 -16.849 7.201 1.00 0.00 C ATOM 1153 O TYR A 72 28.093 -16.943 7.943 1.00 0.00 O ATOM 1154 CB TYR A 72 28.433 -16.208 4.869 1.00 0.00 C ATOM 1155 CG TYR A 72 27.857 -15.068 4.059 1.00 0.00 C ATOM 1156 CD1 TYR A 72 27.097 -14.075 4.664 1.00 0.00 C ATOM 1157 CD2 TYR A 72 28.074 -14.984 2.690 1.00 0.00 C ATOM 1158 CE1 TYR A 72 26.569 -13.032 3.928 1.00 0.00 C ATOM 1159 CE2 TYR A 72 27.551 -13.944 1.946 1.00 0.00 C ATOM 1160 CZ TYR A 72 26.798 -12.971 2.569 1.00 0.00 C ATOM 1161 OH TYR A 72 26.275 -11.933 1.833 1.00 0.00 O ATOM 0 H TYR A 72 30.888 -15.797 4.969 1.00 0.00 H new ATOM 0 HA TYR A 72 28.658 -14.862 6.530 1.00 0.00 H new ATOM 0 HB2 TYR A 72 29.133 -16.767 4.248 1.00 0.00 H new ATOM 0 HB3 TYR A 72 27.629 -16.893 5.139 1.00 0.00 H new ATOM 0 HD1 TYR A 72 26.916 -14.119 5.728 1.00 0.00 H new ATOM 0 HD2 TYR A 72 28.662 -15.745 2.198 1.00 0.00 H new ATOM 0 HE1 TYR A 72 25.980 -12.268 4.414 1.00 0.00 H new ATOM 0 HE2 TYR A 72 27.731 -13.893 0.882 1.00 0.00 H new ATOM 0 HH TYR A 72 27.000 -11.343 1.539 1.00 0.00 H new ATOM 1171 N TYR A 73 30.109 -17.676 7.266 1.00 0.00 N ATOM 1172 CA TYR A 73 30.159 -18.766 8.232 1.00 0.00 C ATOM 1173 C TYR A 73 30.111 -18.231 9.660 1.00 0.00 C ATOM 1174 O TYR A 73 29.804 -18.964 10.601 1.00 0.00 O ATOM 1175 CB TYR A 73 31.427 -19.598 8.030 1.00 0.00 C ATOM 1176 CG TYR A 73 31.548 -20.188 6.643 1.00 0.00 C ATOM 1177 CD1 TYR A 73 30.464 -20.806 6.032 1.00 0.00 C ATOM 1178 CD2 TYR A 73 32.748 -20.128 5.944 1.00 0.00 C ATOM 1179 CE1 TYR A 73 30.571 -21.347 4.766 1.00 0.00 C ATOM 1180 CE2 TYR A 73 32.864 -20.665 4.677 1.00 0.00 C ATOM 1181 CZ TYR A 73 31.773 -21.274 4.092 1.00 0.00 C ATOM 1182 OH TYR A 73 31.883 -21.811 2.830 1.00 0.00 O ATOM 0 H TYR A 73 30.927 -17.612 6.660 1.00 0.00 H new ATOM 0 HA TYR A 73 29.287 -19.400 8.071 1.00 0.00 H new ATOM 0 HB2 TYR A 73 32.298 -18.972 8.227 1.00 0.00 H new ATOM 0 HB3 TYR A 73 31.442 -20.405 8.762 1.00 0.00 H new ATOM 0 HD1 TYR A 73 29.522 -20.864 6.556 1.00 0.00 H new ATOM 0 HD2 TYR A 73 33.604 -19.653 6.400 1.00 0.00 H new ATOM 0 HE1 TYR A 73 29.719 -21.825 4.306 1.00 0.00 H new ATOM 0 HE2 TYR A 73 33.803 -20.609 4.147 1.00 0.00 H new ATOM 0 HH TYR A 73 32.794 -21.675 2.495 1.00 0.00 H new ATOM 1192 N LYS A 74 30.416 -16.947 9.814 1.00 0.00 N ATOM 1193 CA LYS A 74 30.407 -16.310 11.126 1.00 0.00 C ATOM 1194 C LYS A 74 28.983 -15.975 11.558 1.00 0.00 C ATOM 1195 O LYS A 74 28.662 -15.997 12.747 1.00 0.00 O ATOM 1196 CB LYS A 74 31.258 -15.038 11.104 1.00 0.00 C ATOM 1197 CG LYS A 74 32.520 -15.165 10.268 1.00 0.00 C ATOM 1198 CD LYS A 74 33.653 -14.329 10.839 1.00 0.00 C ATOM 1199 CE LYS A 74 34.982 -14.666 10.180 1.00 0.00 C ATOM 1200 NZ LYS A 74 35.502 -13.532 9.368 1.00 0.00 N ATOM 0 H LYS A 74 30.673 -16.327 9.046 1.00 0.00 H new ATOM 0 HA LYS A 74 30.831 -17.010 11.846 1.00 0.00 H new ATOM 0 HB2 LYS A 74 30.657 -14.215 10.717 1.00 0.00 H new ATOM 0 HB3 LYS A 74 31.534 -14.778 12.126 1.00 0.00 H new ATOM 0 HG2 LYS A 74 32.825 -16.211 10.224 1.00 0.00 H new ATOM 0 HG3 LYS A 74 32.313 -14.850 9.245 1.00 0.00 H new ATOM 0 HD2 LYS A 74 33.433 -13.271 10.697 1.00 0.00 H new ATOM 0 HD3 LYS A 74 33.725 -14.498 11.913 1.00 0.00 H new ATOM 0 HE2 LYS A 74 35.711 -14.928 10.947 1.00 0.00 H new ATOM 0 HE3 LYS A 74 34.860 -15.542 9.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 36.022 -13.903 8.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 34.707 -12.948 9.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 36.140 -12.952 9.950 1.00 0.00 H new ATOM 1214 N THR A 75 28.132 -15.665 10.585 1.00 0.00 N ATOM 1215 CA THR A 75 26.742 -15.326 10.864 1.00 0.00 C ATOM 1216 C THR A 75 25.820 -16.506 10.579 1.00 0.00 C ATOM 1217 O THR A 75 24.626 -16.458 10.874 1.00 0.00 O ATOM 1218 CB THR A 75 26.281 -14.115 10.031 1.00 0.00 C ATOM 1219 OG1 THR A 75 26.234 -14.465 8.643 1.00 0.00 O ATOM 1220 CG2 THR A 75 27.218 -12.933 10.229 1.00 0.00 C ATOM 0 H THR A 75 28.381 -15.642 9.596 1.00 0.00 H new ATOM 0 HA THR A 75 26.685 -15.072 11.922 1.00 0.00 H new ATOM 0 HB THR A 75 25.285 -13.829 10.368 1.00 0.00 H new ATOM 0 HG1 THR A 75 26.823 -15.231 8.479 1.00 0.00 H new ATOM 0 HG21 THR A 75 26.872 -12.090 9.631 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.230 -12.650 11.282 1.00 0.00 H new ATOM 0 HG23 THR A 75 28.225 -13.210 9.917 1.00 0.00 H new ATOM 1228 N GLY A 76 26.382 -17.565 10.005 1.00 0.00 N ATOM 1229 CA GLY A 76 25.595 -18.743 9.690 1.00 0.00 C ATOM 1230 C GLY A 76 24.998 -18.687 8.298 1.00 0.00 C ATOM 1231 O GLY A 76 24.589 -19.710 7.749 1.00 0.00 O ATOM 0 H GLY A 76 27.368 -17.628 9.752 1.00 0.00 H new ATOM 0 HA2 GLY A 76 26.223 -19.630 9.777 1.00 0.00 H new ATOM 0 HA3 GLY A 76 24.794 -18.847 10.422 1.00 0.00 H new ATOM 1235 N ILE A 77 24.948 -17.488 7.725 1.00 0.00 N ATOM 1236 CA ILE A 77 24.397 -17.304 6.388 1.00 0.00 C ATOM 1237 C ILE A 77 24.781 -18.459 5.471 1.00 0.00 C ATOM 1238 O ILE A 77 23.943 -18.992 4.742 1.00 0.00 O ATOM 1239 CB ILE A 77 24.877 -15.982 5.759 1.00 0.00 C ATOM 1240 CG1 ILE A 77 24.284 -14.789 6.511 1.00 0.00 C ATOM 1241 CG2 ILE A 77 24.499 -15.928 4.287 1.00 0.00 C ATOM 1242 CD1 ILE A 77 22.890 -14.420 6.055 1.00 0.00 C ATOM 0 H ILE A 77 25.282 -16.631 8.166 1.00 0.00 H new ATOM 0 HA ILE A 77 23.313 -17.274 6.495 1.00 0.00 H new ATOM 0 HB ILE A 77 25.963 -15.933 5.837 1.00 0.00 H new ATOM 0 HG12 ILE A 77 24.261 -15.017 7.577 1.00 0.00 H new ATOM 0 HG13 ILE A 77 24.939 -13.927 6.384 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.845 -14.988 3.857 1.00 0.00 H new ATOM 0 HG22 ILE A 77 24.965 -16.761 3.761 1.00 0.00 H new ATOM 0 HG23 ILE A 77 23.416 -15.996 4.187 1.00 0.00 H new ATOM 0 HD11 ILE A 77 22.533 -13.566 6.631 1.00 0.00 H new ATOM 0 HD12 ILE A 77 22.910 -14.160 4.997 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.221 -15.267 6.208 1.00 0.00 H new ATOM 1254 N LEU A 78 26.052 -18.844 5.513 1.00 0.00 N ATOM 1255 CA LEU A 78 26.548 -19.939 4.686 1.00 0.00 C ATOM 1256 C LEU A 78 26.983 -21.118 5.549 1.00 0.00 C ATOM 1257 O LEU A 78 27.199 -20.973 6.752 1.00 0.00 O ATOM 1258 CB LEU A 78 27.718 -19.463 3.824 1.00 0.00 C ATOM 1259 CG LEU A 78 27.357 -18.923 2.440 1.00 0.00 C ATOM 1260 CD1 LEU A 78 28.588 -18.358 1.749 1.00 0.00 C ATOM 1261 CD2 LEU A 78 26.720 -20.014 1.591 1.00 0.00 C ATOM 0 H LEU A 78 26.758 -18.414 6.111 1.00 0.00 H new ATOM 0 HA LEU A 78 25.737 -20.268 4.036 1.00 0.00 H new ATOM 0 HB2 LEU A 78 28.250 -18.683 4.368 1.00 0.00 H new ATOM 0 HB3 LEU A 78 28.412 -20.294 3.698 1.00 0.00 H new ATOM 0 HG LEU A 78 26.633 -18.117 2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 78 28.311 -17.979 0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 78 29.001 -17.546 2.348 1.00 0.00 H new ATOM 0 HD13 LEU A 78 29.335 -19.144 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 78 26.470 -19.612 0.609 1.00 0.00 H new ATOM 0 HD22 LEU A 78 27.420 -20.841 1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 78 25.813 -20.372 2.079 1.00 0.00 H new ATOM 1273 N GLU A 79 27.111 -22.286 4.926 1.00 0.00 N ATOM 1274 CA GLU A 79 27.522 -23.490 5.638 1.00 0.00 C ATOM 1275 C GLU A 79 28.853 -24.011 5.102 1.00 0.00 C ATOM 1276 O GLU A 79 28.961 -24.382 3.934 1.00 0.00 O ATOM 1277 CB GLU A 79 26.450 -24.574 5.513 1.00 0.00 C ATOM 1278 CG GLU A 79 25.534 -24.666 6.721 1.00 0.00 C ATOM 1279 CD GLU A 79 25.871 -25.839 7.621 1.00 0.00 C ATOM 1280 OE1 GLU A 79 27.036 -25.934 8.061 1.00 0.00 O ATOM 1281 OE2 GLU A 79 24.969 -26.661 7.886 1.00 0.00 O ATOM 0 H GLU A 79 26.936 -22.423 3.931 1.00 0.00 H new ATOM 0 HA GLU A 79 27.649 -23.234 6.690 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.848 -24.378 4.626 1.00 0.00 H new ATOM 0 HB3 GLU A 79 26.936 -25.538 5.362 1.00 0.00 H new ATOM 0 HG2 GLU A 79 25.602 -23.742 7.295 1.00 0.00 H new ATOM 0 HG3 GLU A 79 24.502 -24.757 6.383 1.00 0.00 H new ATOM 1288 N ARG A 80 29.863 -24.035 5.966 1.00 0.00 N ATOM 1289 CA ARG A 80 31.187 -24.508 5.580 1.00 0.00 C ATOM 1290 C ARG A 80 31.093 -25.828 4.822 1.00 0.00 C ATOM 1291 O ARG A 80 30.490 -26.789 5.299 1.00 0.00 O ATOM 1292 CB ARG A 80 32.071 -24.680 6.817 1.00 0.00 C ATOM 1293 CG ARG A 80 33.477 -24.130 6.642 1.00 0.00 C ATOM 1294 CD ARG A 80 33.897 -23.286 7.835 1.00 0.00 C ATOM 1295 NE ARG A 80 35.324 -22.973 7.809 1.00 0.00 N ATOM 1296 CZ ARG A 80 35.888 -22.049 8.578 1.00 0.00 C ATOM 1297 NH1 ARG A 80 35.150 -21.351 9.430 1.00 0.00 N ATOM 1298 NH2 ARG A 80 37.192 -21.822 8.496 1.00 0.00 N ATOM 0 H ARG A 80 29.790 -23.733 6.937 1.00 0.00 H new ATOM 0 HA ARG A 80 31.634 -23.762 4.923 1.00 0.00 H new ATOM 0 HB2 ARG A 80 31.598 -24.182 7.663 1.00 0.00 H new ATOM 0 HB3 ARG A 80 32.133 -25.740 7.065 1.00 0.00 H new ATOM 0 HG2 ARG A 80 34.178 -24.955 6.513 1.00 0.00 H new ATOM 0 HG3 ARG A 80 33.523 -23.528 5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 80 33.323 -22.360 7.844 1.00 0.00 H new ATOM 0 HD3 ARG A 80 33.659 -23.817 8.757 1.00 0.00 H new ATOM 0 HE ARG A 80 35.920 -23.493 7.165 1.00 0.00 H new ATOM 0 HH11 ARG A 80 34.147 -21.523 9.496 1.00 0.00 H new ATOM 0 HH12 ARG A 80 35.585 -20.642 10.020 1.00 0.00 H new ATOM 0 HH21 ARG A 80 37.763 -22.357 7.842 1.00 0.00 H new ATOM 0 HH22 ARG A 80 37.624 -21.112 9.087 1.00 0.00 H new ATOM 1312 N VAL A 81 31.692 -25.867 3.636 1.00 0.00 N ATOM 1313 CA VAL A 81 31.677 -27.069 2.811 1.00 0.00 C ATOM 1314 C VAL A 81 33.090 -27.584 2.562 1.00 0.00 C ATOM 1315 O VAL A 81 34.020 -26.802 2.362 1.00 0.00 O ATOM 1316 CB VAL A 81 30.991 -26.812 1.456 1.00 0.00 C ATOM 1317 CG1 VAL A 81 30.818 -28.113 0.689 1.00 0.00 C ATOM 1318 CG2 VAL A 81 29.650 -26.122 1.661 1.00 0.00 C ATOM 0 H VAL A 81 32.194 -25.080 3.225 1.00 0.00 H new ATOM 0 HA VAL A 81 31.111 -27.821 3.360 1.00 0.00 H new ATOM 0 HB VAL A 81 31.627 -26.153 0.866 1.00 0.00 H new ATOM 0 HG11 VAL A 81 30.332 -27.911 -0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 81 31.795 -28.563 0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 81 30.203 -28.800 1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 81 29.179 -25.948 0.694 1.00 0.00 H new ATOM 0 HG22 VAL A 81 29.005 -26.755 2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 81 29.805 -25.169 2.166 1.00 0.00 H new ATOM 1328 N ASP A 82 33.245 -28.903 2.576 1.00 0.00 N ATOM 1329 CA ASP A 82 34.545 -29.523 2.351 1.00 0.00 C ATOM 1330 C ASP A 82 34.640 -30.089 0.937 1.00 0.00 C ATOM 1331 O ASP A 82 35.300 -31.102 0.706 1.00 0.00 O ATOM 1332 CB ASP A 82 34.789 -30.633 3.374 1.00 0.00 C ATOM 1333 CG ASP A 82 35.156 -30.089 4.741 1.00 0.00 C ATOM 1334 OD1 ASP A 82 35.782 -29.010 4.802 1.00 0.00 O ATOM 1335 OD2 ASP A 82 34.816 -30.742 5.750 1.00 0.00 O ATOM 0 H ASP A 82 32.486 -29.564 2.741 1.00 0.00 H new ATOM 0 HA ASP A 82 35.310 -28.756 2.469 1.00 0.00 H new ATOM 0 HB2 ASP A 82 33.893 -31.248 3.459 1.00 0.00 H new ATOM 0 HB3 ASP A 82 35.589 -31.282 3.018 1.00 0.00 H new ATOM 1340 N ARG A 83 33.975 -29.428 -0.005 1.00 0.00 N ATOM 1341 CA ARG A 83 33.982 -29.866 -1.396 1.00 0.00 C ATOM 1342 C ARG A 83 34.590 -28.797 -2.299 1.00 0.00 C ATOM 1343 O ARG A 83 35.117 -27.792 -1.821 1.00 0.00 O ATOM 1344 CB ARG A 83 32.560 -30.190 -1.858 1.00 0.00 C ATOM 1345 CG ARG A 83 32.230 -31.674 -1.816 1.00 0.00 C ATOM 1346 CD ARG A 83 30.866 -31.924 -1.194 1.00 0.00 C ATOM 1347 NE ARG A 83 30.072 -32.869 -1.975 1.00 0.00 N ATOM 1348 CZ ARG A 83 28.816 -33.188 -1.687 1.00 0.00 C ATOM 1349 NH1 ARG A 83 28.212 -32.640 -0.642 1.00 0.00 N ATOM 1350 NH2 ARG A 83 28.160 -34.057 -2.446 1.00 0.00 N ATOM 0 H ARG A 83 33.425 -28.587 0.170 1.00 0.00 H new ATOM 0 HA ARG A 83 34.593 -30.766 -1.464 1.00 0.00 H new ATOM 0 HB2 ARG A 83 31.851 -29.651 -1.230 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.426 -29.825 -2.876 1.00 0.00 H new ATOM 0 HG2 ARG A 83 32.250 -32.081 -2.827 1.00 0.00 H new ATOM 0 HG3 ARG A 83 32.994 -32.202 -1.245 1.00 0.00 H new ATOM 0 HD2 ARG A 83 30.994 -32.308 -0.182 1.00 0.00 H new ATOM 0 HD3 ARG A 83 30.327 -30.980 -1.111 1.00 0.00 H new ATOM 0 HE ARG A 83 30.507 -33.308 -2.787 1.00 0.00 H new ATOM 0 HH11 ARG A 83 28.712 -31.971 -0.057 1.00 0.00 H new ATOM 0 HH12 ARG A 83 27.247 -32.887 -0.423 1.00 0.00 H new ATOM 0 HH21 ARG A 83 28.621 -34.480 -3.251 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.195 -34.301 -2.224 1.00 0.00 H new ATOM 1364 N ARG A 84 34.514 -29.021 -3.607 1.00 0.00 N ATOM 1365 CA ARG A 84 35.058 -28.079 -4.577 1.00 0.00 C ATOM 1366 C ARG A 84 33.947 -27.244 -5.206 1.00 0.00 C ATOM 1367 O ARG A 84 33.044 -27.778 -5.852 1.00 0.00 O ATOM 1368 CB ARG A 84 35.829 -28.825 -5.667 1.00 0.00 C ATOM 1369 CG ARG A 84 36.549 -27.906 -6.641 1.00 0.00 C ATOM 1370 CD ARG A 84 37.773 -27.268 -6.003 1.00 0.00 C ATOM 1371 NE ARG A 84 38.088 -25.973 -6.600 1.00 0.00 N ATOM 1372 CZ ARG A 84 39.027 -25.157 -6.132 1.00 0.00 C ATOM 1373 NH1 ARG A 84 39.739 -25.501 -5.068 1.00 0.00 N ATOM 1374 NH2 ARG A 84 39.255 -23.994 -6.730 1.00 0.00 N ATOM 0 H ARG A 84 34.081 -29.847 -4.019 1.00 0.00 H new ATOM 0 HA ARG A 84 35.740 -27.409 -4.053 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.558 -29.486 -5.197 1.00 0.00 H new ATOM 0 HB3 ARG A 84 35.136 -29.458 -6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.850 -28.472 -7.522 1.00 0.00 H new ATOM 0 HG3 ARG A 84 35.866 -27.127 -6.980 1.00 0.00 H new ATOM 0 HD2 ARG A 84 37.601 -27.142 -4.934 1.00 0.00 H new ATOM 0 HD3 ARG A 84 38.628 -27.935 -6.112 1.00 0.00 H new ATOM 0 HE ARG A 84 37.559 -25.679 -7.421 1.00 0.00 H new ATOM 0 HH11 ARG A 84 39.567 -26.394 -4.606 1.00 0.00 H new ATOM 0 HH12 ARG A 84 40.459 -24.873 -4.711 1.00 0.00 H new ATOM 0 HH21 ARG A 84 38.709 -23.726 -7.549 1.00 0.00 H new ATOM 0 HH22 ARG A 84 39.976 -23.368 -6.370 1.00 0.00 H new ATOM 1388 N LEU A 85 34.018 -25.931 -5.013 1.00 0.00 N ATOM 1389 CA LEU A 85 33.018 -25.021 -5.560 1.00 0.00 C ATOM 1390 C LEU A 85 31.613 -25.437 -5.137 1.00 0.00 C ATOM 1391 O LEU A 85 30.638 -25.174 -5.840 1.00 0.00 O ATOM 1392 CB LEU A 85 33.114 -24.986 -7.087 1.00 0.00 C ATOM 1393 CG LEU A 85 33.933 -23.841 -7.682 1.00 0.00 C ATOM 1394 CD1 LEU A 85 35.170 -23.574 -6.837 1.00 0.00 C ATOM 1395 CD2 LEU A 85 34.325 -24.155 -9.119 1.00 0.00 C ATOM 0 H LEU A 85 34.758 -25.473 -4.481 1.00 0.00 H new ATOM 0 HA LEU A 85 33.215 -24.024 -5.166 1.00 0.00 H new ATOM 0 HB2 LEU A 85 33.545 -25.928 -7.426 1.00 0.00 H new ATOM 0 HB3 LEU A 85 32.104 -24.933 -7.493 1.00 0.00 H new ATOM 0 HG LEU A 85 33.317 -22.942 -7.683 1.00 0.00 H new ATOM 0 HD11 LEU A 85 35.741 -22.756 -7.276 1.00 0.00 H new ATOM 0 HD12 LEU A 85 34.868 -23.304 -5.825 1.00 0.00 H new ATOM 0 HD13 LEU A 85 35.789 -24.471 -6.804 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.908 -23.329 -9.526 1.00 0.00 H new ATOM 0 HD22 LEU A 85 34.923 -25.066 -9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 85 33.426 -24.295 -9.719 1.00 0.00 H new ATOM 1407 N VAL A 86 31.517 -26.088 -3.981 1.00 0.00 N ATOM 1408 CA VAL A 86 30.231 -26.537 -3.462 1.00 0.00 C ATOM 1409 C VAL A 86 29.889 -25.831 -2.155 1.00 0.00 C ATOM 1410 O VAL A 86 30.486 -26.106 -1.114 1.00 0.00 O ATOM 1411 CB VAL A 86 30.222 -28.060 -3.227 1.00 0.00 C ATOM 1412 CG1 VAL A 86 28.979 -28.473 -2.455 1.00 0.00 C ATOM 1413 CG2 VAL A 86 30.309 -28.803 -4.551 1.00 0.00 C ATOM 0 H VAL A 86 32.314 -26.316 -3.387 1.00 0.00 H new ATOM 0 HA VAL A 86 29.482 -26.288 -4.213 1.00 0.00 H new ATOM 0 HB VAL A 86 31.095 -28.324 -2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.990 -29.552 -2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 86 28.965 -27.966 -1.490 1.00 0.00 H new ATOM 0 HG13 VAL A 86 28.090 -28.198 -3.022 1.00 0.00 H new ATOM 0 HG21 VAL A 86 30.301 -29.877 -4.367 1.00 0.00 H new ATOM 0 HG22 VAL A 86 29.456 -28.536 -5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.232 -28.529 -5.062 1.00 0.00 H new ATOM 1423 N TYR A 87 28.925 -24.919 -2.217 1.00 0.00 N ATOM 1424 CA TYR A 87 28.504 -24.170 -1.039 1.00 0.00 C ATOM 1425 C TYR A 87 27.077 -24.535 -0.643 1.00 0.00 C ATOM 1426 O TYR A 87 26.366 -25.210 -1.388 1.00 0.00 O ATOM 1427 CB TYR A 87 28.604 -22.667 -1.301 1.00 0.00 C ATOM 1428 CG TYR A 87 29.994 -22.210 -1.683 1.00 0.00 C ATOM 1429 CD1 TYR A 87 30.490 -22.424 -2.963 1.00 0.00 C ATOM 1430 CD2 TYR A 87 30.812 -21.565 -0.763 1.00 0.00 C ATOM 1431 CE1 TYR A 87 31.759 -22.009 -3.316 1.00 0.00 C ATOM 1432 CE2 TYR A 87 32.082 -21.146 -1.108 1.00 0.00 C ATOM 1433 CZ TYR A 87 32.551 -21.370 -2.385 1.00 0.00 C ATOM 1434 OH TYR A 87 33.817 -20.954 -2.732 1.00 0.00 O ATOM 0 H TYR A 87 28.420 -24.681 -3.071 1.00 0.00 H new ATOM 0 HA TYR A 87 29.169 -24.433 -0.216 1.00 0.00 H new ATOM 0 HB2 TYR A 87 27.911 -22.399 -2.098 1.00 0.00 H new ATOM 0 HB3 TYR A 87 28.286 -22.129 -0.408 1.00 0.00 H new ATOM 0 HD1 TYR A 87 29.872 -22.924 -3.695 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.448 -21.388 0.239 1.00 0.00 H new ATOM 0 HE1 TYR A 87 32.129 -22.184 -4.315 1.00 0.00 H new ATOM 0 HE2 TYR A 87 32.705 -20.645 -0.381 1.00 0.00 H new ATOM 0 HH TYR A 87 33.844 -20.753 -3.691 1.00 0.00 H new ATOM 1444 N LYS A 88 26.663 -24.082 0.536 1.00 0.00 N ATOM 1445 CA LYS A 88 25.320 -24.358 1.033 1.00 0.00 C ATOM 1446 C LYS A 88 24.848 -23.249 1.968 1.00 0.00 C ATOM 1447 O LYS A 88 25.594 -22.799 2.839 1.00 0.00 O ATOM 1448 CB LYS A 88 25.289 -25.703 1.762 1.00 0.00 C ATOM 1449 CG LYS A 88 23.969 -25.988 2.457 1.00 0.00 C ATOM 1450 CD LYS A 88 24.179 -26.714 3.776 1.00 0.00 C ATOM 1451 CE LYS A 88 22.883 -27.323 4.289 1.00 0.00 C ATOM 1452 NZ LYS A 88 22.124 -26.370 5.145 1.00 0.00 N ATOM 0 H LYS A 88 27.238 -23.522 1.165 1.00 0.00 H new ATOM 0 HA LYS A 88 24.645 -24.401 0.178 1.00 0.00 H new ATOM 0 HB2 LYS A 88 25.492 -26.499 1.046 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.091 -25.725 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 88 23.441 -25.051 2.636 1.00 0.00 H new ATOM 0 HG3 LYS A 88 23.336 -26.591 1.805 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.925 -27.498 3.646 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.574 -26.018 4.517 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.264 -27.625 3.444 1.00 0.00 H new ATOM 0 HE3 LYS A 88 23.106 -28.225 4.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 21.132 -26.676 5.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 22.543 -26.349 6.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 22.166 -25.419 4.727 1.00 0.00 H new ATOM 1466 N PHE A 89 23.606 -22.814 1.784 1.00 0.00 N ATOM 1467 CA PHE A 89 23.035 -21.759 2.613 1.00 0.00 C ATOM 1468 C PHE A 89 22.660 -22.293 3.992 1.00 0.00 C ATOM 1469 O PHE A 89 21.999 -23.323 4.112 1.00 0.00 O ATOM 1470 CB PHE A 89 21.803 -21.158 1.933 1.00 0.00 C ATOM 1471 CG PHE A 89 22.108 -20.479 0.629 1.00 0.00 C ATOM 1472 CD1 PHE A 89 22.622 -19.192 0.607 1.00 0.00 C ATOM 1473 CD2 PHE A 89 21.882 -21.127 -0.575 1.00 0.00 C ATOM 1474 CE1 PHE A 89 22.904 -18.565 -0.592 1.00 0.00 C ATOM 1475 CE2 PHE A 89 22.162 -20.505 -1.777 1.00 0.00 C ATOM 1476 CZ PHE A 89 22.675 -19.222 -1.785 1.00 0.00 C ATOM 0 H PHE A 89 22.976 -23.176 1.068 1.00 0.00 H new ATOM 0 HA PHE A 89 23.788 -20.981 2.738 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.072 -21.948 1.760 1.00 0.00 H new ATOM 0 HB3 PHE A 89 21.340 -20.438 2.608 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.804 -18.674 1.537 1.00 0.00 H new ATOM 0 HD2 PHE A 89 21.482 -22.130 -0.574 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.303 -17.562 -0.596 1.00 0.00 H new ATOM 0 HE2 PHE A 89 21.980 -21.021 -2.708 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.896 -18.734 -2.723 1.00 0.00 H new ATOM 1486 N GLY A 90 23.088 -21.583 5.032 1.00 0.00 N ATOM 1487 CA GLY A 90 22.789 -22.000 6.389 1.00 0.00 C ATOM 1488 C GLY A 90 21.360 -21.688 6.790 1.00 0.00 C ATOM 1489 O GLY A 90 20.472 -21.611 5.941 1.00 0.00 O ATOM 0 H GLY A 90 23.637 -20.726 4.958 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.964 -23.072 6.483 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.473 -21.504 7.077 1.00 0.00 H new ATOM 1493 N LYS A 91 21.137 -21.510 8.087 1.00 0.00 N ATOM 1494 CA LYS A 91 19.807 -21.205 8.601 1.00 0.00 C ATOM 1495 C LYS A 91 19.557 -19.700 8.604 1.00 0.00 C ATOM 1496 O LYS A 91 18.415 -19.251 8.514 1.00 0.00 O ATOM 1497 CB LYS A 91 19.644 -21.763 10.016 1.00 0.00 C ATOM 1498 CG LYS A 91 20.700 -21.269 10.990 1.00 0.00 C ATOM 1499 CD LYS A 91 21.329 -22.419 11.760 1.00 0.00 C ATOM 1500 CE LYS A 91 20.545 -22.738 13.023 1.00 0.00 C ATOM 1501 NZ LYS A 91 21.148 -23.871 13.779 1.00 0.00 N ATOM 0 H LYS A 91 21.861 -21.572 8.803 1.00 0.00 H new ATOM 0 HA LYS A 91 19.075 -21.676 7.945 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.658 -21.491 10.393 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.681 -22.852 9.975 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.474 -20.728 10.446 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.250 -20.564 11.689 1.00 0.00 H new ATOM 0 HD2 LYS A 91 21.372 -23.303 11.124 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.356 -22.164 12.022 1.00 0.00 H new ATOM 0 HE2 LYS A 91 20.508 -21.855 13.661 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.516 -22.984 12.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 20.585 -24.057 14.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.160 -24.721 13.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 22.121 -23.627 14.053 1.00 0.00 H new ATOM 1515 N ASN A 92 20.632 -18.926 8.707 1.00 0.00 N ATOM 1516 CA ASN A 92 20.529 -17.471 8.721 1.00 0.00 C ATOM 1517 C ASN A 92 19.913 -16.958 7.423 1.00 0.00 C ATOM 1518 O ASN A 92 19.217 -15.943 7.413 1.00 0.00 O ATOM 1519 CB ASN A 92 21.908 -16.843 8.928 1.00 0.00 C ATOM 1520 CG ASN A 92 22.130 -16.396 10.360 1.00 0.00 C ATOM 1521 OD1 ASN A 92 22.330 -15.211 10.629 1.00 0.00 O ATOM 1522 ND2 ASN A 92 22.097 -17.346 11.288 1.00 0.00 N ATOM 0 H ASN A 92 21.585 -19.282 8.782 1.00 0.00 H new ATOM 0 HA ASN A 92 19.880 -17.185 9.549 1.00 0.00 H new ATOM 0 HB2 ASN A 92 22.678 -17.564 8.652 1.00 0.00 H new ATOM 0 HB3 ASN A 92 22.018 -15.987 8.262 1.00 0.00 H new ATOM 0 HD21 ASN A 92 22.241 -17.106 12.269 1.00 0.00 H new ATOM 0 HD22 ASN A 92 21.928 -18.315 11.020 1.00 0.00 H new ATOM 1529 N ALA A 93 20.176 -17.666 6.329 1.00 0.00 N ATOM 1530 CA ALA A 93 19.646 -17.283 5.026 1.00 0.00 C ATOM 1531 C ALA A 93 18.141 -17.518 4.955 1.00 0.00 C ATOM 1532 O ALA A 93 17.542 -18.061 5.884 1.00 0.00 O ATOM 1533 CB ALA A 93 20.354 -18.054 3.922 1.00 0.00 C ATOM 0 H ALA A 93 20.753 -18.507 6.319 1.00 0.00 H new ATOM 0 HA ALA A 93 19.828 -16.218 4.886 1.00 0.00 H new ATOM 0 HB1 ALA A 93 19.949 -17.758 2.954 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.421 -17.834 3.951 1.00 0.00 H new ATOM 0 HB3 ALA A 93 20.200 -19.123 4.069 1.00 0.00 H new ATOM 1539 N HIS A 94 17.533 -17.103 3.848 1.00 0.00 N ATOM 1540 CA HIS A 94 16.097 -17.268 3.656 1.00 0.00 C ATOM 1541 C HIS A 94 15.720 -17.089 2.189 1.00 0.00 C ATOM 1542 O HIS A 94 16.523 -16.617 1.385 1.00 0.00 O ATOM 1543 CB HIS A 94 15.328 -16.266 4.518 1.00 0.00 C ATOM 1544 CG HIS A 94 15.802 -14.854 4.361 1.00 0.00 C ATOM 1545 ND1 HIS A 94 15.680 -14.144 3.185 1.00 0.00 N ATOM 1546 CD2 HIS A 94 16.400 -14.018 5.243 1.00 0.00 C ATOM 1547 CE1 HIS A 94 16.185 -12.934 3.349 1.00 0.00 C ATOM 1548 NE2 HIS A 94 16.628 -12.832 4.589 1.00 0.00 N ATOM 0 H HIS A 94 18.013 -16.650 3.070 1.00 0.00 H new ATOM 0 HA HIS A 94 15.829 -18.280 3.960 1.00 0.00 H new ATOM 0 HB2 HIS A 94 14.270 -16.316 4.262 1.00 0.00 H new ATOM 0 HB3 HIS A 94 15.417 -16.556 5.565 1.00 0.00 H new ATOM 0 HD2 HIS A 94 16.651 -14.242 6.269 1.00 0.00 H new ATOM 0 HE1 HIS A 94 16.228 -12.160 2.597 1.00 0.00 H new ATOM 0 HE2 HIS A 94 17.068 -12.006 4.995 1.00 0.00 H new ATOM 1556 N GLY A 95 14.494 -17.472 1.846 1.00 0.00 N ATOM 1557 CA GLY A 95 14.033 -17.347 0.476 1.00 0.00 C ATOM 1558 C GLY A 95 14.051 -18.669 -0.265 1.00 0.00 C ATOM 1559 O GLY A 95 13.120 -18.985 -1.006 1.00 0.00 O ATOM 0 H GLY A 95 13.812 -17.867 2.493 1.00 0.00 H new ATOM 0 HA2 GLY A 95 13.020 -16.946 0.472 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.662 -16.630 -0.052 1.00 0.00 H new ATOM 1563 N TRP A 96 15.112 -19.442 -0.066 1.00 0.00 N ATOM 1564 CA TRP A 96 15.248 -20.737 -0.723 1.00 0.00 C ATOM 1565 C TRP A 96 14.488 -21.817 0.040 1.00 0.00 C ATOM 1566 O TRP A 96 13.859 -22.687 -0.561 1.00 0.00 O ATOM 1567 CB TRP A 96 16.724 -21.121 -0.840 1.00 0.00 C ATOM 1568 CG TRP A 96 17.371 -21.402 0.483 1.00 0.00 C ATOM 1569 CD1 TRP A 96 17.952 -20.494 1.320 1.00 0.00 C ATOM 1570 CD2 TRP A 96 17.504 -22.678 1.117 1.00 0.00 C ATOM 1571 NE1 TRP A 96 18.439 -21.128 2.438 1.00 0.00 N ATOM 1572 CE2 TRP A 96 18.175 -22.469 2.338 1.00 0.00 C ATOM 1573 CE3 TRP A 96 17.119 -23.977 0.775 1.00 0.00 C ATOM 1574 CZ2 TRP A 96 18.470 -23.511 3.213 1.00 0.00 C ATOM 1575 CZ3 TRP A 96 17.413 -25.010 1.645 1.00 0.00 C ATOM 1576 CH2 TRP A 96 18.082 -24.772 2.853 1.00 0.00 C ATOM 0 H TRP A 96 15.891 -19.195 0.545 1.00 0.00 H new ATOM 0 HA TRP A 96 14.821 -20.656 -1.723 1.00 0.00 H new ATOM 0 HB2 TRP A 96 16.814 -22.003 -1.475 1.00 0.00 H new ATOM 0 HB3 TRP A 96 17.264 -20.315 -1.336 1.00 0.00 H new ATOM 0 HD1 TRP A 96 18.019 -19.433 1.131 1.00 0.00 H new ATOM 0 HE1 TRP A 96 18.919 -20.674 3.215 1.00 0.00 H new ATOM 0 HE3 TRP A 96 16.601 -24.170 -0.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 18.987 -23.330 4.144 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 17.122 -26.018 1.389 1.00 0.00 H new ATOM 0 HH2 TRP A 96 18.295 -25.600 3.512 1.00 0.00 H new ATOM 1587 N GLN A 97 14.551 -21.753 1.366 1.00 0.00 N ATOM 1588 CA GLN A 97 13.869 -22.727 2.210 1.00 0.00 C ATOM 1589 C GLN A 97 12.377 -22.770 1.895 1.00 0.00 C ATOM 1590 O GLN A 97 11.835 -21.848 1.287 1.00 0.00 O ATOM 1591 CB GLN A 97 14.080 -22.390 3.688 1.00 0.00 C ATOM 1592 CG GLN A 97 15.030 -23.341 4.398 1.00 0.00 C ATOM 1593 CD GLN A 97 15.518 -22.795 5.726 1.00 0.00 C ATOM 1594 OE1 GLN A 97 15.277 -23.385 6.779 1.00 0.00 O ATOM 1595 NE2 GLN A 97 16.207 -21.661 5.682 1.00 0.00 N ATOM 0 H GLN A 97 15.067 -21.038 1.879 1.00 0.00 H new ATOM 0 HA GLN A 97 14.294 -23.709 2.004 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.468 -21.374 3.769 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.116 -22.405 4.197 1.00 0.00 H new ATOM 0 HG2 GLN A 97 14.527 -24.294 4.564 1.00 0.00 H new ATOM 0 HG3 GLN A 97 15.887 -23.540 3.754 1.00 0.00 H new ATOM 0 HE21 GLN A 97 16.383 -21.206 4.786 1.00 0.00 H new ATOM 0 HE22 GLN A 97 16.560 -21.245 6.544 1.00 0.00 H new