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 -98:sc= -1.08 USER MOD Set 1.2: A 87 TYR OH : rot 180:sc= 0.117 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -1.87! 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 -131:sc= -1.42 (180deg=-2.44) 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= -0.672 K(o=-0.67,f=-2.5!) USER MOD Single : A 60 MET CE :methyl 144:sc= -0.969 (180deg=-3.62!) 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 -78:sc= 0.596 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 150:sc= 0 USER MOD Single : A 73 TYR OH : rot 68:sc= 0.0573 USER MOD Single : A 74 LYS NZ :NH3+ -158:sc= 0.57 (180deg=0.301) USER MOD Single : A 75 THR OG1 : rot -24:sc= -0.0886 USER MOD Single : A 88 LYS NZ :NH3+ -138:sc= 0.0386 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -2.41! C(o=-2.4!,f=-2.8!) USER MOD Single : A 94 HIS : no HD1:sc=-0.00182 X(o=-0.0018,f=-0.3) USER MOD Single : A 97 GLN : amide:sc= 0.0454 X(o=0.045,f=0) USER MOD ----------------------------------------------------------------- ATOM 105 N LEU A 11 25.439 -10.495 -0.746 1.00 0.00 N ATOM 106 CA LEU A 11 25.862 -11.409 -1.802 1.00 0.00 C ATOM 107 C LEU A 11 25.048 -12.699 -1.764 1.00 0.00 C ATOM 108 O LEU A 11 24.427 -13.082 -2.756 1.00 0.00 O ATOM 109 CB LEU A 11 27.351 -11.728 -1.660 1.00 0.00 C ATOM 110 CG LEU A 11 27.882 -12.857 -2.544 1.00 0.00 C ATOM 111 CD1 LEU A 11 27.987 -12.399 -3.991 1.00 0.00 C ATOM 112 CD2 LEU A 11 29.233 -13.341 -2.037 1.00 0.00 C ATOM 0 HA LEU A 11 25.691 -10.921 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.919 -10.824 -1.880 1.00 0.00 H new ATOM 0 HB3 LEU A 11 27.550 -11.984 -0.619 1.00 0.00 H new ATOM 0 HG LEU A 11 27.179 -13.689 -2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 11 28.367 -13.216 -4.605 1.00 0.00 H new ATOM 0 HD12 LEU A 11 27.002 -12.102 -4.351 1.00 0.00 H new ATOM 0 HD13 LEU A 11 28.668 -11.550 -4.055 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.596 -14.144 -2.678 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.944 -12.515 -2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.128 -13.710 -1.017 1.00 0.00 H new ATOM 124 N TRP A 12 25.054 -13.362 -0.614 1.00 0.00 N ATOM 125 CA TRP A 12 24.314 -14.608 -0.446 1.00 0.00 C ATOM 126 C TRP A 12 22.950 -14.526 -1.122 1.00 0.00 C ATOM 127 O TRP A 12 22.507 -15.479 -1.762 1.00 0.00 O ATOM 128 CB TRP A 12 24.142 -14.928 1.040 1.00 0.00 C ATOM 129 CG TRP A 12 23.027 -14.164 1.686 1.00 0.00 C ATOM 130 CD1 TRP A 12 23.134 -13.005 2.401 1.00 0.00 C ATOM 131 CD2 TRP A 12 21.637 -14.506 1.679 1.00 0.00 C ATOM 132 NE1 TRP A 12 21.894 -12.606 2.839 1.00 0.00 N ATOM 133 CE2 TRP A 12 20.958 -13.509 2.408 1.00 0.00 C ATOM 134 CE3 TRP A 12 20.899 -15.555 1.125 1.00 0.00 C ATOM 135 CZ2 TRP A 12 19.579 -13.535 2.597 1.00 0.00 C ATOM 136 CZ3 TRP A 12 19.530 -15.579 1.314 1.00 0.00 C ATOM 137 CH2 TRP A 12 18.881 -14.574 2.044 1.00 0.00 C ATOM 0 H TRP A 12 25.563 -13.058 0.216 1.00 0.00 H new ATOM 0 HA TRP A 12 24.886 -15.407 -0.918 1.00 0.00 H new ATOM 0 HB2 TRP A 12 23.956 -15.996 1.155 1.00 0.00 H new ATOM 0 HB3 TRP A 12 25.073 -14.709 1.562 1.00 0.00 H new ATOM 0 HD1 TRP A 12 24.058 -12.479 2.594 1.00 0.00 H new ATOM 0 HE1 TRP A 12 21.702 -11.773 3.395 1.00 0.00 H new ATOM 0 HE3 TRP A 12 21.389 -16.333 0.559 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 19.078 -12.762 3.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 18.950 -16.386 0.892 1.00 0.00 H new ATOM 0 HH2 TRP A 12 17.810 -14.620 2.173 1.00 0.00 H new ATOM 148 N GLU A 13 22.289 -13.382 -0.976 1.00 0.00 N ATOM 149 CA GLU A 13 20.974 -13.178 -1.573 1.00 0.00 C ATOM 150 C GLU A 13 21.066 -13.153 -3.096 1.00 0.00 C ATOM 151 O GLU A 13 20.240 -13.746 -3.789 1.00 0.00 O ATOM 152 CB GLU A 13 20.357 -11.872 -1.066 1.00 0.00 C ATOM 153 CG GLU A 13 19.279 -12.076 -0.015 1.00 0.00 C ATOM 154 CD GLU A 13 18.014 -11.297 -0.318 1.00 0.00 C ATOM 155 OE1 GLU A 13 18.104 -10.062 -0.481 1.00 0.00 O ATOM 156 OE2 GLU A 13 16.935 -11.920 -0.391 1.00 0.00 O ATOM 0 H GLU A 13 22.642 -12.583 -0.450 1.00 0.00 H new ATOM 0 HA GLU A 13 20.336 -14.011 -1.279 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.145 -11.245 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 13 19.932 -11.329 -1.910 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.040 -13.137 0.054 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.664 -11.772 0.959 1.00 0.00 H new ATOM 163 N PHE A 14 22.078 -12.461 -3.610 1.00 0.00 N ATOM 164 CA PHE A 14 22.278 -12.356 -5.051 1.00 0.00 C ATOM 165 C PHE A 14 22.499 -13.733 -5.671 1.00 0.00 C ATOM 166 O PHE A 14 21.756 -14.154 -6.557 1.00 0.00 O ATOM 167 CB PHE A 14 23.471 -11.448 -5.357 1.00 0.00 C ATOM 168 CG PHE A 14 24.147 -11.766 -6.660 1.00 0.00 C ATOM 169 CD1 PHE A 14 25.184 -12.683 -6.713 1.00 0.00 C ATOM 170 CD2 PHE A 14 23.745 -11.146 -7.833 1.00 0.00 C ATOM 171 CE1 PHE A 14 25.807 -12.977 -7.911 1.00 0.00 C ATOM 172 CE2 PHE A 14 24.365 -11.437 -9.033 1.00 0.00 C ATOM 173 CZ PHE A 14 25.398 -12.353 -9.072 1.00 0.00 C ATOM 0 H PHE A 14 22.772 -11.965 -3.050 1.00 0.00 H new ATOM 0 HA PHE A 14 21.379 -11.921 -5.487 1.00 0.00 H new ATOM 0 HB2 PHE A 14 23.134 -10.412 -5.375 1.00 0.00 H new ATOM 0 HB3 PHE A 14 24.198 -11.532 -4.549 1.00 0.00 H new ATOM 0 HD1 PHE A 14 25.509 -13.174 -5.808 1.00 0.00 H new ATOM 0 HD2 PHE A 14 22.939 -10.428 -7.809 1.00 0.00 H new ATOM 0 HE1 PHE A 14 26.614 -13.695 -7.939 1.00 0.00 H new ATOM 0 HE2 PHE A 14 24.042 -10.948 -9.940 1.00 0.00 H new ATOM 0 HZ PHE A 14 25.885 -12.580 -10.009 1.00 0.00 H new ATOM 183 N VAL A 15 23.528 -14.429 -5.198 1.00 0.00 N ATOM 184 CA VAL A 15 23.849 -15.758 -5.705 1.00 0.00 C ATOM 185 C VAL A 15 22.663 -16.704 -5.554 1.00 0.00 C ATOM 186 O VAL A 15 22.524 -17.667 -6.309 1.00 0.00 O ATOM 187 CB VAL A 15 25.065 -16.358 -4.975 1.00 0.00 C ATOM 188 CG1 VAL A 15 24.876 -16.283 -3.468 1.00 0.00 C ATOM 189 CG2 VAL A 15 25.298 -17.794 -5.421 1.00 0.00 C ATOM 0 H VAL A 15 24.153 -14.095 -4.465 1.00 0.00 H new ATOM 0 HA VAL A 15 24.088 -15.645 -6.762 1.00 0.00 H new ATOM 0 HB VAL A 15 25.947 -15.773 -5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 15 25.746 -16.712 -2.970 1.00 0.00 H new ATOM 0 HG12 VAL A 15 24.763 -15.242 -3.167 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.984 -16.842 -3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 15 26.161 -18.203 -4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 15 24.417 -18.393 -5.193 1.00 0.00 H new ATOM 0 HG23 VAL A 15 25.483 -17.816 -6.495 1.00 0.00 H new ATOM 199 N ARG A 16 21.809 -16.423 -4.575 1.00 0.00 N ATOM 200 CA ARG A 16 20.634 -17.250 -4.325 1.00 0.00 C ATOM 201 C ARG A 16 19.536 -16.956 -5.343 1.00 0.00 C ATOM 202 O ARG A 16 19.022 -17.865 -5.995 1.00 0.00 O ATOM 203 CB ARG A 16 20.109 -17.011 -2.908 1.00 0.00 C ATOM 204 CG ARG A 16 18.822 -17.760 -2.601 1.00 0.00 C ATOM 205 CD ARG A 16 17.791 -16.852 -1.949 1.00 0.00 C ATOM 206 NE ARG A 16 17.321 -15.813 -2.861 1.00 0.00 N ATOM 207 CZ ARG A 16 16.402 -14.910 -2.535 1.00 0.00 C ATOM 208 NH1 ARG A 16 15.858 -14.919 -1.326 1.00 0.00 N ATOM 209 NH2 ARG A 16 16.026 -13.996 -3.421 1.00 0.00 N ATOM 0 H ARG A 16 21.909 -15.629 -3.942 1.00 0.00 H new ATOM 0 HA ARG A 16 20.927 -18.295 -4.425 1.00 0.00 H new ATOM 0 HB2 ARG A 16 20.874 -17.310 -2.191 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.941 -15.943 -2.767 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.413 -18.175 -3.522 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.037 -18.600 -1.941 1.00 0.00 H new ATOM 0 HD2 ARG A 16 16.944 -17.449 -1.612 1.00 0.00 H new ATOM 0 HD3 ARG A 16 18.225 -16.388 -1.064 1.00 0.00 H new ATOM 0 HE ARG A 16 17.720 -15.778 -3.799 1.00 0.00 H new ATOM 0 HH11 ARG A 16 16.145 -15.620 -0.643 1.00 0.00 H new ATOM 0 HH12 ARG A 16 15.153 -14.225 -1.079 1.00 0.00 H new ATOM 0 HH21 ARG A 16 16.442 -13.987 -4.352 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.321 -13.303 -3.171 1.00 0.00 H new ATOM 223 N ASP A 17 19.182 -15.683 -5.472 1.00 0.00 N ATOM 224 CA ASP A 17 18.145 -15.269 -6.410 1.00 0.00 C ATOM 225 C ASP A 17 18.387 -15.875 -7.789 1.00 0.00 C ATOM 226 O ASP A 17 17.446 -16.122 -8.544 1.00 0.00 O ATOM 227 CB ASP A 17 18.098 -13.743 -6.511 1.00 0.00 C ATOM 228 CG ASP A 17 16.682 -13.215 -6.634 1.00 0.00 C ATOM 229 OD1 ASP A 17 16.121 -13.275 -7.748 1.00 0.00 O ATOM 230 OD2 ASP A 17 16.136 -12.742 -5.615 1.00 0.00 O ATOM 0 H ASP A 17 19.598 -14.919 -4.939 1.00 0.00 H new ATOM 0 HA ASP A 17 17.187 -15.630 -6.037 1.00 0.00 H new ATOM 0 HB2 ASP A 17 18.569 -13.309 -5.629 1.00 0.00 H new ATOM 0 HB3 ASP A 17 18.679 -13.421 -7.375 1.00 0.00 H new ATOM 235 N LEU A 18 19.654 -16.111 -8.111 1.00 0.00 N ATOM 236 CA LEU A 18 20.021 -16.687 -9.400 1.00 0.00 C ATOM 237 C LEU A 18 19.477 -18.106 -9.537 1.00 0.00 C ATOM 238 O LEU A 18 18.912 -18.468 -10.570 1.00 0.00 O ATOM 239 CB LEU A 18 21.542 -16.694 -9.564 1.00 0.00 C ATOM 240 CG LEU A 18 22.170 -15.390 -10.055 1.00 0.00 C ATOM 241 CD1 LEU A 18 23.612 -15.281 -9.585 1.00 0.00 C ATOM 242 CD2 LEU A 18 22.094 -15.299 -11.572 1.00 0.00 C ATOM 0 H LEU A 18 20.444 -15.912 -7.497 1.00 0.00 H new ATOM 0 HA LEU A 18 19.580 -16.071 -10.184 1.00 0.00 H new ATOM 0 HB2 LEU A 18 21.990 -16.950 -8.604 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.808 -17.488 -10.262 1.00 0.00 H new ATOM 0 HG LEU A 18 21.608 -14.557 -9.632 1.00 0.00 H new ATOM 0 HD11 LEU A 18 24.042 -14.346 -9.944 1.00 0.00 H new ATOM 0 HD12 LEU A 18 23.642 -15.299 -8.496 1.00 0.00 H new ATOM 0 HD13 LEU A 18 24.187 -16.120 -9.978 1.00 0.00 H new ATOM 0 HD21 LEU A 18 22.546 -14.364 -11.904 1.00 0.00 H new ATOM 0 HD22 LEU A 18 22.631 -16.138 -12.014 1.00 0.00 H new ATOM 0 HD23 LEU A 18 21.051 -15.329 -11.887 1.00 0.00 H new ATOM 254 N LEU A 19 19.649 -18.903 -8.489 1.00 0.00 N ATOM 255 CA LEU A 19 19.173 -20.282 -8.491 1.00 0.00 C ATOM 256 C LEU A 19 17.664 -20.337 -8.711 1.00 0.00 C ATOM 257 O LEU A 19 17.157 -21.235 -9.386 1.00 0.00 O ATOM 258 CB LEU A 19 19.532 -20.968 -7.172 1.00 0.00 C ATOM 259 CG LEU A 19 20.993 -21.389 -7.010 1.00 0.00 C ATOM 260 CD1 LEU A 19 21.419 -21.291 -5.554 1.00 0.00 C ATOM 261 CD2 LEU A 19 21.202 -22.802 -7.535 1.00 0.00 C ATOM 0 H LEU A 19 20.114 -18.619 -7.627 1.00 0.00 H new ATOM 0 HA LEU A 19 19.661 -20.808 -9.312 1.00 0.00 H new ATOM 0 HB2 LEU A 19 19.276 -20.295 -6.354 1.00 0.00 H new ATOM 0 HB3 LEU A 19 18.906 -21.853 -7.064 1.00 0.00 H new ATOM 0 HG LEU A 19 21.614 -20.710 -7.595 1.00 0.00 H new ATOM 0 HD11 LEU A 19 22.462 -21.595 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU A 19 21.308 -20.262 -5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 19 20.794 -21.946 -4.947 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.247 -23.085 -7.412 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.571 -23.494 -6.978 1.00 0.00 H new ATOM 0 HD23 LEU A 19 20.938 -22.840 -8.592 1.00 0.00 H new ATOM 273 N LEU A 20 16.953 -19.372 -8.141 1.00 0.00 N ATOM 274 CA LEU A 20 15.502 -19.308 -8.277 1.00 0.00 C ATOM 275 C LEU A 20 15.106 -18.605 -9.571 1.00 0.00 C ATOM 276 O LEU A 20 13.945 -18.640 -9.978 1.00 0.00 O ATOM 277 CB LEU A 20 14.889 -18.580 -7.079 1.00 0.00 C ATOM 278 CG LEU A 20 15.512 -18.885 -5.717 1.00 0.00 C ATOM 279 CD1 LEU A 20 14.764 -18.155 -4.612 1.00 0.00 C ATOM 280 CD2 LEU A 20 15.519 -20.384 -5.458 1.00 0.00 C ATOM 0 H LEU A 20 17.357 -18.622 -7.580 1.00 0.00 H new ATOM 0 HA LEU A 20 15.120 -20.328 -8.309 1.00 0.00 H new ATOM 0 HB2 LEU A 20 14.960 -17.507 -7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.828 -18.826 -7.034 1.00 0.00 H new ATOM 0 HG LEU A 20 16.543 -18.532 -5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 20 15.222 -18.384 -3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.811 -17.081 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.722 -18.476 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 20 15.966 -20.583 -4.484 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.496 -20.760 -5.471 1.00 0.00 H new ATOM 0 HD23 LEU A 20 16.100 -20.884 -6.233 1.00 0.00 H new ATOM 292 N SER A 21 16.080 -17.970 -10.215 1.00 0.00 N ATOM 293 CA SER A 21 15.833 -17.257 -11.463 1.00 0.00 C ATOM 294 C SER A 21 16.659 -17.851 -12.600 1.00 0.00 C ATOM 295 O SER A 21 17.715 -17.336 -12.970 1.00 0.00 O ATOM 296 CB SER A 21 16.162 -15.772 -11.301 1.00 0.00 C ATOM 297 OG SER A 21 15.092 -15.078 -10.682 1.00 0.00 O ATOM 0 H SER A 21 17.047 -17.935 -9.893 1.00 0.00 H new ATOM 0 HA SER A 21 14.777 -17.363 -11.710 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.067 -15.660 -10.704 1.00 0.00 H new ATOM 0 HB3 SER A 21 16.368 -15.333 -12.277 1.00 0.00 H new ATOM 0 HG SER A 21 15.327 -14.131 -10.588 1.00 0.00 H new ATOM 303 N PRO A 22 16.169 -18.963 -13.169 1.00 0.00 N ATOM 304 CA PRO A 22 16.845 -19.652 -14.272 1.00 0.00 C ATOM 305 C PRO A 22 16.801 -18.851 -15.569 1.00 0.00 C ATOM 306 O PRO A 22 17.405 -19.239 -16.568 1.00 0.00 O ATOM 307 CB PRO A 22 16.050 -20.952 -14.419 1.00 0.00 C ATOM 308 CG PRO A 22 14.698 -20.632 -13.881 1.00 0.00 C ATOM 309 CD PRO A 22 14.917 -19.632 -12.778 1.00 0.00 C ATOM 0 HA PRO A 22 17.905 -19.805 -14.068 1.00 0.00 H new ATOM 0 HB2 PRO A 22 15.997 -21.268 -15.461 1.00 0.00 H new ATOM 0 HB3 PRO A 22 16.515 -21.766 -13.862 1.00 0.00 H new ATOM 0 HG2 PRO A 22 14.056 -20.220 -14.659 1.00 0.00 H new ATOM 0 HG3 PRO A 22 14.206 -21.528 -13.503 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.090 -18.926 -12.705 1.00 0.00 H new ATOM 0 HD3 PRO A 22 15.007 -20.118 -11.807 1.00 0.00 H new ATOM 317 N GLU A 23 16.083 -17.733 -15.545 1.00 0.00 N ATOM 318 CA GLU A 23 15.961 -16.879 -16.720 1.00 0.00 C ATOM 319 C GLU A 23 17.135 -15.908 -16.812 1.00 0.00 C ATOM 320 O GLU A 23 17.499 -15.459 -17.898 1.00 0.00 O ATOM 321 CB GLU A 23 14.644 -16.100 -16.678 1.00 0.00 C ATOM 322 CG GLU A 23 13.725 -16.395 -17.852 1.00 0.00 C ATOM 323 CD GLU A 23 12.468 -15.548 -17.836 1.00 0.00 C ATOM 324 OE1 GLU A 23 11.536 -15.884 -17.074 1.00 0.00 O ATOM 325 OE2 GLU A 23 12.415 -14.549 -18.584 1.00 0.00 O ATOM 0 H GLU A 23 15.577 -17.398 -14.725 1.00 0.00 H new ATOM 0 HA GLU A 23 15.970 -17.518 -17.603 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.122 -16.335 -15.751 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.863 -15.032 -16.658 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.264 -16.221 -18.783 1.00 0.00 H new ATOM 0 HG3 GLU A 23 13.448 -17.449 -17.836 1.00 0.00 H new ATOM 332 N GLU A 24 17.722 -15.589 -15.662 1.00 0.00 N ATOM 333 CA GLU A 24 18.854 -14.671 -15.613 1.00 0.00 C ATOM 334 C GLU A 24 20.168 -15.434 -15.473 1.00 0.00 C ATOM 335 O GLU A 24 21.166 -15.094 -16.107 1.00 0.00 O ATOM 336 CB GLU A 24 18.694 -13.691 -14.449 1.00 0.00 C ATOM 337 CG GLU A 24 18.154 -12.333 -14.866 1.00 0.00 C ATOM 338 CD GLU A 24 19.183 -11.228 -14.724 1.00 0.00 C ATOM 339 OE1 GLU A 24 19.815 -11.141 -13.650 1.00 0.00 O ATOM 340 OE2 GLU A 24 19.356 -10.450 -15.685 1.00 0.00 O ATOM 0 H GLU A 24 17.433 -15.952 -14.754 1.00 0.00 H new ATOM 0 HA GLU A 24 18.877 -14.112 -16.549 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.024 -14.127 -13.708 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.661 -13.555 -13.964 1.00 0.00 H new ATOM 0 HG2 GLU A 24 17.819 -12.382 -15.902 1.00 0.00 H new ATOM 0 HG3 GLU A 24 17.281 -12.092 -14.260 1.00 0.00 H new ATOM 347 N ASN A 25 20.159 -16.466 -14.636 1.00 0.00 N ATOM 348 CA ASN A 25 21.350 -17.278 -14.410 1.00 0.00 C ATOM 349 C ASN A 25 21.641 -18.164 -15.617 1.00 0.00 C ATOM 350 O ASN A 25 20.745 -18.822 -16.148 1.00 0.00 O ATOM 351 CB ASN A 25 21.175 -18.141 -13.160 1.00 0.00 C ATOM 352 CG ASN A 25 22.154 -19.299 -13.115 1.00 0.00 C ATOM 353 OD1 ASN A 25 23.154 -19.308 -13.832 1.00 0.00 O ATOM 354 ND2 ASN A 25 21.868 -20.282 -12.269 1.00 0.00 N ATOM 0 H ASN A 25 19.341 -16.760 -14.103 1.00 0.00 H new ATOM 0 HA ASN A 25 22.195 -16.606 -14.263 1.00 0.00 H new ATOM 0 HB2 ASN A 25 21.308 -17.522 -12.273 1.00 0.00 H new ATOM 0 HB3 ASN A 25 20.157 -18.528 -13.129 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.489 -21.087 -12.194 1.00 0.00 H new ATOM 0 HD22 ASN A 25 21.027 -20.231 -11.694 1.00 0.00 H new ATOM 361 N CYS A 26 22.898 -18.177 -16.046 1.00 0.00 N ATOM 362 CA CYS A 26 23.308 -18.982 -17.191 1.00 0.00 C ATOM 363 C CYS A 26 24.308 -20.055 -16.771 1.00 0.00 C ATOM 364 O CYS A 26 25.519 -19.854 -16.850 1.00 0.00 O ATOM 365 CB CYS A 26 23.920 -18.093 -18.274 1.00 0.00 C ATOM 366 SG CYS A 26 23.420 -18.528 -19.956 1.00 0.00 S ATOM 0 H CYS A 26 23.651 -17.639 -15.618 1.00 0.00 H new ATOM 0 HA CYS A 26 22.422 -19.474 -17.593 1.00 0.00 H new ATOM 0 HB2 CYS A 26 23.640 -17.058 -18.080 1.00 0.00 H new ATOM 0 HB3 CYS A 26 25.006 -18.149 -18.204 1.00 0.00 H new ATOM 0 HG CYS A 26 23.987 -17.718 -20.800 1.00 0.00 H new ATOM 372 N GLY A 27 23.792 -21.195 -16.322 1.00 0.00 N ATOM 373 CA GLY A 27 24.654 -22.282 -15.895 1.00 0.00 C ATOM 374 C GLY A 27 25.757 -21.815 -14.966 1.00 0.00 C ATOM 375 O GLY A 27 26.858 -22.366 -14.974 1.00 0.00 O ATOM 0 H GLY A 27 22.793 -21.385 -16.246 1.00 0.00 H new ATOM 0 HA2 GLY A 27 24.055 -23.040 -15.391 1.00 0.00 H new ATOM 0 HA3 GLY A 27 25.097 -22.756 -16.771 1.00 0.00 H new ATOM 379 N ILE A 28 25.463 -20.797 -14.164 1.00 0.00 N ATOM 380 CA ILE A 28 26.439 -20.257 -13.226 1.00 0.00 C ATOM 381 C ILE A 28 26.459 -21.061 -11.930 1.00 0.00 C ATOM 382 O ILE A 28 27.500 -21.194 -11.285 1.00 0.00 O ATOM 383 CB ILE A 28 26.146 -18.782 -12.897 1.00 0.00 C ATOM 384 CG1 ILE A 28 25.992 -17.970 -14.184 1.00 0.00 C ATOM 385 CG2 ILE A 28 27.254 -18.203 -12.029 1.00 0.00 C ATOM 386 CD1 ILE A 28 25.694 -16.507 -13.944 1.00 0.00 C ATOM 0 H ILE A 28 24.557 -20.330 -14.145 1.00 0.00 H new ATOM 0 HA ILE A 28 27.414 -20.327 -13.709 1.00 0.00 H new ATOM 0 HB ILE A 28 25.210 -18.728 -12.342 1.00 0.00 H new ATOM 0 HG12 ILE A 28 26.908 -18.055 -14.769 1.00 0.00 H new ATOM 0 HG13 ILE A 28 25.190 -18.402 -14.783 1.00 0.00 H new ATOM 0 HG21 ILE A 28 27.033 -17.160 -11.805 1.00 0.00 H new ATOM 0 HG22 ILE A 28 27.320 -18.768 -11.099 1.00 0.00 H new ATOM 0 HG23 ILE A 28 28.203 -18.266 -12.561 1.00 0.00 H new ATOM 0 HD11 ILE A 28 25.598 -15.994 -14.901 1.00 0.00 H new ATOM 0 HD12 ILE A 28 24.762 -16.412 -13.386 1.00 0.00 H new ATOM 0 HD13 ILE A 28 26.507 -16.059 -13.372 1.00 0.00 H new ATOM 398 N LEU A 29 25.303 -21.598 -11.556 1.00 0.00 N ATOM 399 CA LEU A 29 25.188 -22.392 -10.337 1.00 0.00 C ATOM 400 C LEU A 29 24.391 -23.667 -10.592 1.00 0.00 C ATOM 401 O LEU A 29 23.798 -23.838 -11.657 1.00 0.00 O ATOM 402 CB LEU A 29 24.521 -21.572 -9.232 1.00 0.00 C ATOM 403 CG LEU A 29 25.108 -20.183 -8.979 1.00 0.00 C ATOM 404 CD1 LEU A 29 24.018 -19.211 -8.555 1.00 0.00 C ATOM 405 CD2 LEU A 29 26.203 -20.252 -7.924 1.00 0.00 C ATOM 0 H LEU A 29 24.433 -21.498 -12.078 1.00 0.00 H new ATOM 0 HA LEU A 29 26.192 -22.671 -10.018 1.00 0.00 H new ATOM 0 HB2 LEU A 29 23.465 -21.459 -9.478 1.00 0.00 H new ATOM 0 HB3 LEU A 29 24.573 -22.141 -8.304 1.00 0.00 H new ATOM 0 HG LEU A 29 25.547 -19.820 -9.908 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.455 -18.228 -8.380 1.00 0.00 H new ATOM 0 HD12 LEU A 29 23.268 -19.139 -9.343 1.00 0.00 H new ATOM 0 HD13 LEU A 29 23.548 -19.568 -7.638 1.00 0.00 H new ATOM 0 HD21 LEU A 29 26.610 -19.255 -7.756 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.787 -20.636 -6.992 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.997 -20.915 -8.267 1.00 0.00 H new ATOM 417 N GLU A 30 24.379 -24.559 -9.606 1.00 0.00 N ATOM 418 CA GLU A 30 23.653 -25.818 -9.723 1.00 0.00 C ATOM 419 C GLU A 30 22.987 -26.188 -8.401 1.00 0.00 C ATOM 420 O GLU A 30 23.506 -25.884 -7.327 1.00 0.00 O ATOM 421 CB GLU A 30 24.598 -26.938 -10.162 1.00 0.00 C ATOM 422 CG GLU A 30 24.513 -27.260 -11.645 1.00 0.00 C ATOM 423 CD GLU A 30 24.747 -28.730 -11.937 1.00 0.00 C ATOM 424 OE1 GLU A 30 25.760 -29.276 -11.452 1.00 0.00 O ATOM 425 OE2 GLU A 30 23.919 -29.333 -12.651 1.00 0.00 O ATOM 0 H GLU A 30 24.864 -24.433 -8.718 1.00 0.00 H new ATOM 0 HA GLU A 30 22.876 -25.691 -10.477 1.00 0.00 H new ATOM 0 HB2 GLU A 30 25.622 -26.654 -9.919 1.00 0.00 H new ATOM 0 HB3 GLU A 30 24.372 -27.838 -9.590 1.00 0.00 H new ATOM 0 HG2 GLU A 30 23.531 -26.971 -12.020 1.00 0.00 H new ATOM 0 HG3 GLU A 30 25.249 -26.664 -12.185 1.00 0.00 H new ATOM 432 N TRP A 31 21.837 -26.845 -8.488 1.00 0.00 N ATOM 433 CA TRP A 31 21.099 -27.256 -7.299 1.00 0.00 C ATOM 434 C TRP A 31 21.491 -28.668 -6.877 1.00 0.00 C ATOM 435 O TRP A 31 20.919 -29.648 -7.353 1.00 0.00 O ATOM 436 CB TRP A 31 19.594 -27.187 -7.558 1.00 0.00 C ATOM 437 CG TRP A 31 18.982 -25.877 -7.161 1.00 0.00 C ATOM 438 CD1 TRP A 31 18.246 -25.043 -7.953 1.00 0.00 C ATOM 439 CD2 TRP A 31 19.057 -25.250 -5.876 1.00 0.00 C ATOM 440 NE1 TRP A 31 17.858 -23.936 -7.238 1.00 0.00 N ATOM 441 CE2 TRP A 31 18.343 -24.039 -5.961 1.00 0.00 C ATOM 442 CE3 TRP A 31 19.656 -25.595 -4.662 1.00 0.00 C ATOM 443 CZ2 TRP A 31 18.214 -23.174 -4.878 1.00 0.00 C ATOM 444 CZ3 TRP A 31 19.528 -24.735 -3.588 1.00 0.00 C ATOM 445 CH2 TRP A 31 18.811 -23.536 -3.701 1.00 0.00 C ATOM 0 H TRP A 31 21.395 -27.105 -9.370 1.00 0.00 H new ATOM 0 HA TRP A 31 21.352 -26.571 -6.490 1.00 0.00 H new ATOM 0 HB2 TRP A 31 19.407 -27.361 -8.618 1.00 0.00 H new ATOM 0 HB3 TRP A 31 19.101 -27.991 -7.011 1.00 0.00 H new ATOM 0 HD1 TRP A 31 18.004 -25.227 -8.989 1.00 0.00 H new ATOM 0 HE1 TRP A 31 17.299 -23.163 -7.599 1.00 0.00 H new ATOM 0 HE3 TRP A 31 20.209 -26.517 -4.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 17.662 -22.250 -4.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 19.988 -24.991 -2.645 1.00 0.00 H new ATOM 0 HH2 TRP A 31 18.728 -22.885 -2.843 1.00 0.00 H new ATOM 456 N GLU A 32 22.468 -28.764 -5.981 1.00 0.00 N ATOM 457 CA GLU A 32 22.935 -30.058 -5.496 1.00 0.00 C ATOM 458 C GLU A 32 21.901 -30.698 -4.573 1.00 0.00 C ATOM 459 O GLU A 32 21.758 -31.920 -4.538 1.00 0.00 O ATOM 460 CB GLU A 32 24.266 -29.901 -4.758 1.00 0.00 C ATOM 461 CG GLU A 32 25.445 -29.639 -5.679 1.00 0.00 C ATOM 462 CD GLU A 32 26.284 -30.879 -5.920 1.00 0.00 C ATOM 463 OE1 GLU A 32 25.706 -31.983 -5.987 1.00 0.00 O ATOM 464 OE2 GLU A 32 27.520 -30.744 -6.042 1.00 0.00 O ATOM 0 H GLU A 32 22.951 -27.962 -5.576 1.00 0.00 H new ATOM 0 HA GLU A 32 23.081 -30.710 -6.358 1.00 0.00 H new ATOM 0 HB2 GLU A 32 24.182 -29.080 -4.046 1.00 0.00 H new ATOM 0 HB3 GLU A 32 24.461 -30.805 -4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 32 25.079 -29.262 -6.634 1.00 0.00 H new ATOM 0 HG3 GLU A 32 26.072 -28.859 -5.247 1.00 0.00 H new ATOM 471 N ASP A 33 21.184 -29.864 -3.829 1.00 0.00 N ATOM 472 CA ASP A 33 20.164 -30.347 -2.906 1.00 0.00 C ATOM 473 C ASP A 33 19.190 -29.231 -2.539 1.00 0.00 C ATOM 474 O ASP A 33 19.552 -28.282 -1.844 1.00 0.00 O ATOM 475 CB ASP A 33 20.815 -30.909 -1.641 1.00 0.00 C ATOM 476 CG ASP A 33 20.806 -32.425 -1.610 1.00 0.00 C ATOM 477 OD1 ASP A 33 19.707 -33.010 -1.519 1.00 0.00 O ATOM 478 OD2 ASP A 33 21.899 -33.025 -1.676 1.00 0.00 O ATOM 0 H ASP A 33 21.290 -28.850 -3.847 1.00 0.00 H new ATOM 0 HA ASP A 33 19.607 -31.142 -3.403 1.00 0.00 H new ATOM 0 HB2 ASP A 33 21.843 -30.553 -1.576 1.00 0.00 H new ATOM 0 HB3 ASP A 33 20.290 -30.527 -0.765 1.00 0.00 H new ATOM 483 N ARG A 34 17.954 -29.352 -3.013 1.00 0.00 N ATOM 484 CA ARG A 34 16.929 -28.353 -2.737 1.00 0.00 C ATOM 485 C ARG A 34 16.493 -28.411 -1.276 1.00 0.00 C ATOM 486 O ARG A 34 16.316 -27.378 -0.630 1.00 0.00 O ATOM 487 CB ARG A 34 15.721 -28.566 -3.650 1.00 0.00 C ATOM 488 CG ARG A 34 16.027 -28.357 -5.124 1.00 0.00 C ATOM 489 CD ARG A 34 16.197 -26.882 -5.455 1.00 0.00 C ATOM 490 NE ARG A 34 15.012 -26.103 -5.104 1.00 0.00 N ATOM 491 CZ ARG A 34 13.859 -26.184 -5.758 1.00 0.00 C ATOM 492 NH1 ARG A 34 13.736 -27.006 -6.791 1.00 0.00 N ATOM 493 NH2 ARG A 34 12.826 -25.442 -5.379 1.00 0.00 N ATOM 0 H ARG A 34 17.639 -30.132 -3.590 1.00 0.00 H new ATOM 0 HA ARG A 34 17.354 -27.369 -2.932 1.00 0.00 H new ATOM 0 HB2 ARG A 34 15.342 -29.578 -3.506 1.00 0.00 H new ATOM 0 HB3 ARG A 34 14.926 -27.882 -3.352 1.00 0.00 H new ATOM 0 HG2 ARG A 34 16.936 -28.897 -5.388 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.221 -28.776 -5.727 1.00 0.00 H new ATOM 0 HD2 ARG A 34 17.062 -26.488 -4.921 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.402 -26.771 -6.520 1.00 0.00 H new ATOM 0 HE ARG A 34 15.074 -25.462 -4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 34 14.528 -27.578 -7.085 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.849 -27.067 -7.292 1.00 0.00 H new ATOM 0 HH21 ARG A 34 12.917 -24.809 -4.585 1.00 0.00 H new ATOM 0 HH22 ARG A 34 11.941 -25.505 -5.882 1.00 0.00 H new ATOM 507 N GLU A 35 16.321 -29.625 -0.763 1.00 0.00 N ATOM 508 CA GLU A 35 15.904 -29.816 0.622 1.00 0.00 C ATOM 509 C GLU A 35 16.919 -29.207 1.585 1.00 0.00 C ATOM 510 O GLU A 35 16.562 -28.417 2.458 1.00 0.00 O ATOM 511 CB GLU A 35 15.729 -31.306 0.923 1.00 0.00 C ATOM 512 CG GLU A 35 14.394 -31.868 0.464 1.00 0.00 C ATOM 513 CD GLU A 35 13.237 -31.399 1.325 1.00 0.00 C ATOM 514 OE1 GLU A 35 13.298 -31.591 2.557 1.00 0.00 O ATOM 515 OE2 GLU A 35 12.270 -30.840 0.766 1.00 0.00 O ATOM 0 H GLU A 35 16.464 -30.490 -1.284 1.00 0.00 H new ATOM 0 HA GLU A 35 14.949 -29.309 0.761 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.533 -31.862 0.441 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.831 -31.465 1.996 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.216 -31.573 -0.570 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.437 -32.957 0.481 1.00 0.00 H new ATOM 522 N GLN A 36 18.183 -29.581 1.418 1.00 0.00 N ATOM 523 CA GLN A 36 19.249 -29.072 2.273 1.00 0.00 C ATOM 524 C GLN A 36 19.610 -27.639 1.898 1.00 0.00 C ATOM 525 O GLN A 36 19.951 -26.828 2.759 1.00 0.00 O ATOM 526 CB GLN A 36 20.486 -29.966 2.169 1.00 0.00 C ATOM 527 CG GLN A 36 20.172 -31.451 2.254 1.00 0.00 C ATOM 528 CD GLN A 36 21.175 -32.213 3.098 1.00 0.00 C ATOM 529 OE1 GLN A 36 22.089 -32.849 2.573 1.00 0.00 O ATOM 530 NE2 GLN A 36 21.009 -32.152 4.414 1.00 0.00 N ATOM 0 H GLN A 36 18.494 -30.234 0.699 1.00 0.00 H new ATOM 0 HA GLN A 36 18.890 -29.079 3.302 1.00 0.00 H new ATOM 0 HB2 GLN A 36 20.992 -29.764 1.225 1.00 0.00 H new ATOM 0 HB3 GLN A 36 21.182 -29.704 2.966 1.00 0.00 H new ATOM 0 HG2 GLN A 36 19.175 -31.584 2.673 1.00 0.00 H new ATOM 0 HG3 GLN A 36 20.154 -31.873 1.249 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.237 -31.613 4.806 1.00 0.00 H new ATOM 0 HE22 GLN A 36 21.653 -32.644 5.033 1.00 0.00 H new ATOM 539 N GLY A 37 19.533 -27.332 0.607 1.00 0.00 N ATOM 540 CA GLY A 37 19.855 -25.996 0.141 1.00 0.00 C ATOM 541 C GLY A 37 21.289 -25.879 -0.338 1.00 0.00 C ATOM 542 O GLY A 37 21.876 -24.797 -0.301 1.00 0.00 O ATOM 0 H GLY A 37 19.253 -27.985 -0.125 1.00 0.00 H new ATOM 0 HA2 GLY A 37 19.181 -25.726 -0.671 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.685 -25.282 0.947 1.00 0.00 H new ATOM 546 N ILE A 38 21.854 -26.995 -0.787 1.00 0.00 N ATOM 547 CA ILE A 38 23.228 -27.012 -1.274 1.00 0.00 C ATOM 548 C ILE A 38 23.291 -26.653 -2.754 1.00 0.00 C ATOM 549 O ILE A 38 22.471 -27.111 -3.551 1.00 0.00 O ATOM 550 CB ILE A 38 23.882 -28.390 -1.063 1.00 0.00 C ATOM 551 CG1 ILE A 38 23.878 -28.759 0.422 1.00 0.00 C ATOM 552 CG2 ILE A 38 25.302 -28.391 -1.611 1.00 0.00 C ATOM 553 CD1 ILE A 38 23.823 -30.250 0.674 1.00 0.00 C ATOM 0 H ILE A 38 21.382 -27.898 -0.824 1.00 0.00 H new ATOM 0 HA ILE A 38 23.776 -26.266 -0.698 1.00 0.00 H new ATOM 0 HB ILE A 38 23.303 -29.138 -1.605 1.00 0.00 H new ATOM 0 HG12 ILE A 38 24.774 -28.352 0.892 1.00 0.00 H new ATOM 0 HG13 ILE A 38 23.022 -28.285 0.903 1.00 0.00 H new ATOM 0 HG21 ILE A 38 25.752 -29.372 -1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 38 25.281 -28.167 -2.678 1.00 0.00 H new ATOM 0 HG23 ILE A 38 25.892 -27.635 -1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 38 23.823 -30.438 1.748 1.00 0.00 H new ATOM 0 HD12 ILE A 38 22.914 -30.660 0.234 1.00 0.00 H new ATOM 0 HD13 ILE A 38 24.692 -30.728 0.222 1.00 0.00 H new ATOM 565 N PHE A 39 24.270 -25.831 -3.117 1.00 0.00 N ATOM 566 CA PHE A 39 24.441 -25.411 -4.503 1.00 0.00 C ATOM 567 C PHE A 39 25.915 -25.423 -4.897 1.00 0.00 C ATOM 568 O PHE A 39 26.796 -25.267 -4.051 1.00 0.00 O ATOM 569 CB PHE A 39 23.858 -24.011 -4.709 1.00 0.00 C ATOM 570 CG PHE A 39 24.583 -22.941 -3.945 1.00 0.00 C ATOM 571 CD1 PHE A 39 24.331 -22.741 -2.598 1.00 0.00 C ATOM 572 CD2 PHE A 39 25.517 -22.133 -4.575 1.00 0.00 C ATOM 573 CE1 PHE A 39 24.998 -21.757 -1.891 1.00 0.00 C ATOM 574 CE2 PHE A 39 26.186 -21.148 -3.874 1.00 0.00 C ATOM 575 CZ PHE A 39 25.925 -20.959 -2.531 1.00 0.00 C ATOM 0 H PHE A 39 24.957 -25.443 -2.471 1.00 0.00 H new ATOM 0 HA PHE A 39 23.907 -26.117 -5.139 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.884 -23.768 -5.771 1.00 0.00 H new ATOM 0 HB3 PHE A 39 22.810 -24.015 -4.408 1.00 0.00 H new ATOM 0 HD1 PHE A 39 23.605 -23.361 -2.093 1.00 0.00 H new ATOM 0 HD2 PHE A 39 25.724 -22.275 -5.625 1.00 0.00 H new ATOM 0 HE1 PHE A 39 24.794 -21.613 -0.840 1.00 0.00 H new ATOM 0 HE2 PHE A 39 26.913 -20.526 -4.376 1.00 0.00 H new ATOM 0 HZ PHE A 39 26.445 -20.188 -1.982 1.00 0.00 H new ATOM 585 N ARG A 40 26.175 -25.609 -6.187 1.00 0.00 N ATOM 586 CA ARG A 40 27.542 -25.644 -6.693 1.00 0.00 C ATOM 587 C ARG A 40 27.810 -24.457 -7.614 1.00 0.00 C ATOM 588 O ARG A 40 26.926 -24.014 -8.347 1.00 0.00 O ATOM 589 CB ARG A 40 27.798 -26.953 -7.442 1.00 0.00 C ATOM 590 CG ARG A 40 29.111 -26.969 -8.208 1.00 0.00 C ATOM 591 CD ARG A 40 29.294 -28.271 -8.972 1.00 0.00 C ATOM 592 NE ARG A 40 30.387 -28.191 -9.937 1.00 0.00 N ATOM 593 CZ ARG A 40 31.670 -28.266 -9.603 1.00 0.00 C ATOM 594 NH1 ARG A 40 32.020 -28.424 -8.333 1.00 0.00 N ATOM 595 NH2 ARG A 40 32.607 -28.185 -10.539 1.00 0.00 N ATOM 0 H ARG A 40 25.457 -25.738 -6.900 1.00 0.00 H new ATOM 0 HA ARG A 40 28.220 -25.582 -5.842 1.00 0.00 H new ATOM 0 HB2 ARG A 40 27.793 -27.777 -6.729 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.978 -27.130 -8.139 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.138 -26.131 -8.904 1.00 0.00 H new ATOM 0 HG3 ARG A 40 29.940 -26.834 -7.514 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.491 -29.080 -8.268 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.369 -28.519 -9.492 1.00 0.00 H new ATOM 0 HE ARG A 40 30.152 -28.071 -10.922 1.00 0.00 H new ATOM 0 HH11 ARG A 40 31.303 -28.488 -7.611 1.00 0.00 H new ATOM 0 HH12 ARG A 40 33.006 -28.481 -8.079 1.00 0.00 H new ATOM 0 HH21 ARG A 40 32.342 -28.065 -11.517 1.00 0.00 H new ATOM 0 HH22 ARG A 40 33.592 -28.243 -10.281 1.00 0.00 H new ATOM 609 N VAL A 41 29.037 -23.946 -7.571 1.00 0.00 N ATOM 610 CA VAL A 41 29.422 -22.812 -8.402 1.00 0.00 C ATOM 611 C VAL A 41 29.978 -23.276 -9.743 1.00 0.00 C ATOM 612 O VAL A 41 31.192 -23.369 -9.926 1.00 0.00 O ATOM 613 CB VAL A 41 30.474 -21.933 -7.699 1.00 0.00 C ATOM 614 CG1 VAL A 41 30.922 -20.802 -8.612 1.00 0.00 C ATOM 615 CG2 VAL A 41 29.923 -21.387 -6.390 1.00 0.00 C ATOM 0 H VAL A 41 29.781 -24.300 -6.969 1.00 0.00 H new ATOM 0 HA VAL A 41 28.520 -22.223 -8.571 1.00 0.00 H new ATOM 0 HB VAL A 41 31.344 -22.549 -7.472 1.00 0.00 H new ATOM 0 HG11 VAL A 41 31.665 -20.192 -8.098 1.00 0.00 H new ATOM 0 HG12 VAL A 41 31.359 -21.218 -9.519 1.00 0.00 H new ATOM 0 HG13 VAL A 41 30.063 -20.184 -8.874 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.679 -20.768 -5.907 1.00 0.00 H new ATOM 0 HG22 VAL A 41 29.037 -20.786 -6.591 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.658 -22.215 -5.733 1.00 0.00 H new ATOM 625 N VAL A 42 29.082 -23.568 -10.680 1.00 0.00 N ATOM 626 CA VAL A 42 29.482 -24.021 -12.007 1.00 0.00 C ATOM 627 C VAL A 42 30.462 -23.045 -12.649 1.00 0.00 C ATOM 628 O VAL A 42 31.509 -23.444 -13.159 1.00 0.00 O ATOM 629 CB VAL A 42 28.264 -24.193 -12.933 1.00 0.00 C ATOM 630 CG1 VAL A 42 28.698 -24.708 -14.297 1.00 0.00 C ATOM 631 CG2 VAL A 42 27.242 -25.126 -12.301 1.00 0.00 C ATOM 0 H VAL A 42 28.073 -23.499 -10.545 1.00 0.00 H new ATOM 0 HA VAL A 42 29.969 -24.988 -11.878 1.00 0.00 H new ATOM 0 HB VAL A 42 27.795 -23.219 -13.072 1.00 0.00 H new ATOM 0 HG11 VAL A 42 27.824 -24.823 -14.937 1.00 0.00 H new ATOM 0 HG12 VAL A 42 29.389 -23.998 -14.751 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.193 -25.672 -14.181 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.388 -25.236 -12.969 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.697 -26.102 -12.130 1.00 0.00 H new ATOM 0 HG23 VAL A 42 26.908 -24.710 -11.351 1.00 0.00 H new ATOM 641 N LYS A 43 30.115 -21.763 -12.620 1.00 0.00 N ATOM 642 CA LYS A 43 30.964 -20.727 -13.197 1.00 0.00 C ATOM 643 C LYS A 43 31.440 -19.754 -12.124 1.00 0.00 C ATOM 644 O LYS A 43 30.751 -18.788 -11.799 1.00 0.00 O ATOM 645 CB LYS A 43 30.206 -19.969 -14.289 1.00 0.00 C ATOM 646 CG LYS A 43 29.838 -20.830 -15.485 1.00 0.00 C ATOM 647 CD LYS A 43 28.775 -20.166 -16.344 1.00 0.00 C ATOM 648 CE LYS A 43 28.549 -20.930 -17.640 1.00 0.00 C ATOM 649 NZ LYS A 43 29.594 -20.621 -18.655 1.00 0.00 N ATOM 0 H LYS A 43 29.251 -21.416 -12.203 1.00 0.00 H new ATOM 0 HA LYS A 43 31.837 -21.210 -13.637 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.296 -19.548 -13.862 1.00 0.00 H new ATOM 0 HB3 LYS A 43 30.816 -19.132 -14.629 1.00 0.00 H new ATOM 0 HG2 LYS A 43 30.727 -21.019 -16.086 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.476 -21.798 -15.140 1.00 0.00 H new ATOM 0 HD2 LYS A 43 27.840 -20.107 -15.787 1.00 0.00 H new ATOM 0 HD3 LYS A 43 29.076 -19.143 -16.571 1.00 0.00 H new ATOM 0 HE2 LYS A 43 28.547 -22.001 -17.435 1.00 0.00 H new ATOM 0 HE3 LYS A 43 27.567 -20.681 -18.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 29.405 -21.161 -19.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 29.579 -19.604 -18.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.529 -20.882 -18.282 1.00 0.00 H new ATOM 663 N SER A 44 32.624 -20.014 -11.579 1.00 0.00 N ATOM 664 CA SER A 44 33.192 -19.162 -10.541 1.00 0.00 C ATOM 665 C SER A 44 33.566 -17.794 -11.105 1.00 0.00 C ATOM 666 O SER A 44 33.811 -16.849 -10.356 1.00 0.00 O ATOM 667 CB SER A 44 34.424 -19.826 -9.923 1.00 0.00 C ATOM 668 OG SER A 44 35.538 -19.744 -10.795 1.00 0.00 O ATOM 0 H SER A 44 33.209 -20.808 -11.839 1.00 0.00 H new ATOM 0 HA SER A 44 32.437 -19.023 -9.767 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.664 -19.344 -8.975 1.00 0.00 H new ATOM 0 HB3 SER A 44 34.206 -20.871 -9.703 1.00 0.00 H new ATOM 0 HG SER A 44 36.313 -20.174 -10.377 1.00 0.00 H new ATOM 674 N GLU A 45 33.607 -17.699 -12.430 1.00 0.00 N ATOM 675 CA GLU A 45 33.952 -16.448 -13.095 1.00 0.00 C ATOM 676 C GLU A 45 32.711 -15.584 -13.307 1.00 0.00 C ATOM 677 O GLU A 45 32.720 -14.386 -13.026 1.00 0.00 O ATOM 678 CB GLU A 45 34.627 -16.728 -14.439 1.00 0.00 C ATOM 679 CG GLU A 45 33.716 -17.403 -15.450 1.00 0.00 C ATOM 680 CD GLU A 45 34.485 -18.129 -16.536 1.00 0.00 C ATOM 681 OE1 GLU A 45 35.021 -17.451 -17.438 1.00 0.00 O ATOM 682 OE2 GLU A 45 34.551 -19.375 -16.484 1.00 0.00 O ATOM 0 H GLU A 45 33.406 -18.473 -13.064 1.00 0.00 H new ATOM 0 HA GLU A 45 34.647 -15.905 -12.454 1.00 0.00 H new ATOM 0 HB2 GLU A 45 34.987 -15.788 -14.858 1.00 0.00 H new ATOM 0 HB3 GLU A 45 35.501 -17.358 -14.273 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.068 -18.111 -14.933 1.00 0.00 H new ATOM 0 HG3 GLU A 45 33.069 -16.654 -15.907 1.00 0.00 H new ATOM 689 N ALA A 46 31.646 -16.203 -13.805 1.00 0.00 N ATOM 690 CA ALA A 46 30.397 -15.493 -14.054 1.00 0.00 C ATOM 691 C ALA A 46 29.743 -15.057 -12.747 1.00 0.00 C ATOM 692 O ALA A 46 29.155 -13.978 -12.664 1.00 0.00 O ATOM 693 CB ALA A 46 29.445 -16.365 -14.858 1.00 0.00 C ATOM 0 H ALA A 46 31.623 -17.194 -14.044 1.00 0.00 H new ATOM 0 HA ALA A 46 30.626 -14.597 -14.631 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.517 -15.822 -15.036 1.00 0.00 H new ATOM 0 HB2 ALA A 46 29.905 -16.621 -15.813 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.230 -17.278 -14.302 1.00 0.00 H new ATOM 699 N LEU A 47 29.849 -15.903 -11.728 1.00 0.00 N ATOM 700 CA LEU A 47 29.267 -15.606 -10.424 1.00 0.00 C ATOM 701 C LEU A 47 29.780 -14.273 -9.889 1.00 0.00 C ATOM 702 O LEU A 47 28.999 -13.421 -9.466 1.00 0.00 O ATOM 703 CB LEU A 47 29.591 -16.725 -9.432 1.00 0.00 C ATOM 704 CG LEU A 47 29.248 -16.444 -7.968 1.00 0.00 C ATOM 705 CD1 LEU A 47 27.765 -16.148 -7.814 1.00 0.00 C ATOM 706 CD2 LEU A 47 29.653 -17.620 -7.091 1.00 0.00 C ATOM 0 H LEU A 47 30.332 -16.800 -11.780 1.00 0.00 H new ATOM 0 HA LEU A 47 28.186 -15.536 -10.544 1.00 0.00 H new ATOM 0 HB2 LEU A 47 29.059 -17.624 -9.743 1.00 0.00 H new ATOM 0 HB3 LEU A 47 30.656 -16.946 -9.499 1.00 0.00 H new ATOM 0 HG LEU A 47 29.807 -15.566 -7.646 1.00 0.00 H new ATOM 0 HD11 LEU A 47 27.540 -15.951 -6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 47 27.504 -15.275 -8.412 1.00 0.00 H new ATOM 0 HD13 LEU A 47 27.185 -17.006 -8.154 1.00 0.00 H new ATOM 0 HD21 LEU A 47 29.402 -17.403 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 47 29.121 -18.515 -7.414 1.00 0.00 H new ATOM 0 HD23 LEU A 47 30.727 -17.786 -7.177 1.00 0.00 H new ATOM 718 N ALA A 48 31.097 -14.099 -9.914 1.00 0.00 N ATOM 719 CA ALA A 48 31.714 -12.868 -9.436 1.00 0.00 C ATOM 720 C ALA A 48 31.464 -11.717 -10.404 1.00 0.00 C ATOM 721 O ALA A 48 31.017 -10.641 -10.004 1.00 0.00 O ATOM 722 CB ALA A 48 33.207 -13.072 -9.229 1.00 0.00 C ATOM 0 H ALA A 48 31.757 -14.795 -10.260 1.00 0.00 H new ATOM 0 HA ALA A 48 31.258 -12.609 -8.480 1.00 0.00 H new ATOM 0 HB1 ALA A 48 33.655 -12.145 -8.872 1.00 0.00 H new ATOM 0 HB2 ALA A 48 33.368 -13.860 -8.493 1.00 0.00 H new ATOM 0 HB3 ALA A 48 33.670 -13.358 -10.174 1.00 0.00 H new ATOM 728 N LYS A 49 31.755 -11.949 -11.679 1.00 0.00 N ATOM 729 CA LYS A 49 31.562 -10.932 -12.706 1.00 0.00 C ATOM 730 C LYS A 49 30.180 -10.297 -12.590 1.00 0.00 C ATOM 731 O LYS A 49 30.043 -9.075 -12.623 1.00 0.00 O ATOM 732 CB LYS A 49 31.739 -11.543 -14.098 1.00 0.00 C ATOM 733 CG LYS A 49 33.171 -11.502 -14.602 1.00 0.00 C ATOM 734 CD LYS A 49 33.391 -12.487 -15.739 1.00 0.00 C ATOM 735 CE LYS A 49 34.693 -12.209 -16.473 1.00 0.00 C ATOM 736 NZ LYS A 49 35.809 -13.051 -15.961 1.00 0.00 N ATOM 0 H LYS A 49 32.126 -12.833 -12.026 1.00 0.00 H new ATOM 0 HA LYS A 49 32.313 -10.156 -12.559 1.00 0.00 H new ATOM 0 HB2 LYS A 49 31.400 -12.579 -14.077 1.00 0.00 H new ATOM 0 HB3 LYS A 49 31.099 -11.012 -14.803 1.00 0.00 H new ATOM 0 HG2 LYS A 49 33.409 -10.494 -14.941 1.00 0.00 H new ATOM 0 HG3 LYS A 49 33.853 -11.732 -13.783 1.00 0.00 H new ATOM 0 HD2 LYS A 49 33.404 -13.503 -15.344 1.00 0.00 H new ATOM 0 HD3 LYS A 49 32.558 -12.428 -16.439 1.00 0.00 H new ATOM 0 HE2 LYS A 49 34.556 -12.396 -17.538 1.00 0.00 H new ATOM 0 HE3 LYS A 49 34.953 -11.156 -16.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 36.679 -12.832 -16.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 35.957 -12.855 -14.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 35.572 -14.056 -16.087 1.00 0.00 H new ATOM 750 N MET A 50 29.158 -11.136 -12.453 1.00 0.00 N ATOM 751 CA MET A 50 27.787 -10.656 -12.329 1.00 0.00 C ATOM 752 C MET A 50 27.592 -9.900 -11.019 1.00 0.00 C ATOM 753 O MET A 50 27.048 -8.796 -11.004 1.00 0.00 O ATOM 754 CB MET A 50 26.805 -11.827 -12.407 1.00 0.00 C ATOM 755 CG MET A 50 26.335 -12.133 -13.819 1.00 0.00 C ATOM 756 SD MET A 50 24.691 -11.477 -14.162 1.00 0.00 S ATOM 757 CE MET A 50 23.703 -12.415 -13.000 1.00 0.00 C ATOM 0 H MET A 50 29.254 -12.151 -12.425 1.00 0.00 H new ATOM 0 HA MET A 50 27.592 -9.972 -13.155 1.00 0.00 H new ATOM 0 HB2 MET A 50 27.278 -12.716 -11.990 1.00 0.00 H new ATOM 0 HB3 MET A 50 25.938 -11.606 -11.784 1.00 0.00 H new ATOM 0 HG2 MET A 50 27.045 -11.715 -14.533 1.00 0.00 H new ATOM 0 HG3 MET A 50 26.330 -13.212 -13.970 1.00 0.00 H new ATOM 0 HE1 MET A 50 22.840 -12.838 -13.514 1.00 0.00 H new ATOM 0 HE2 MET A 50 24.304 -13.220 -12.578 1.00 0.00 H new ATOM 0 HE3 MET A 50 23.362 -11.759 -12.199 1.00 0.00 H new ATOM 767 N TRP A 51 28.038 -10.501 -9.922 1.00 0.00 N ATOM 768 CA TRP A 51 27.912 -9.884 -8.607 1.00 0.00 C ATOM 769 C TRP A 51 28.436 -8.452 -8.625 1.00 0.00 C ATOM 770 O TRP A 51 27.727 -7.516 -8.259 1.00 0.00 O ATOM 771 CB TRP A 51 28.669 -10.704 -7.561 1.00 0.00 C ATOM 772 CG TRP A 51 28.740 -10.037 -6.220 1.00 0.00 C ATOM 773 CD1 TRP A 51 29.856 -9.853 -5.454 1.00 0.00 C ATOM 774 CD2 TRP A 51 27.650 -9.467 -5.488 1.00 0.00 C ATOM 775 NE1 TRP A 51 29.525 -9.204 -4.290 1.00 0.00 N ATOM 776 CE2 TRP A 51 28.178 -8.954 -4.287 1.00 0.00 C ATOM 777 CE3 TRP A 51 26.280 -9.337 -5.731 1.00 0.00 C ATOM 778 CZ2 TRP A 51 27.382 -8.325 -3.333 1.00 0.00 C ATOM 779 CZ3 TRP A 51 25.492 -8.712 -4.783 1.00 0.00 C ATOM 780 CH2 TRP A 51 26.044 -8.212 -3.596 1.00 0.00 C ATOM 0 H TRP A 51 28.490 -11.415 -9.917 1.00 0.00 H new ATOM 0 HA TRP A 51 26.854 -9.861 -8.344 1.00 0.00 H new ATOM 0 HB2 TRP A 51 28.185 -11.674 -7.451 1.00 0.00 H new ATOM 0 HB3 TRP A 51 29.681 -10.891 -7.920 1.00 0.00 H new ATOM 0 HD1 TRP A 51 30.852 -10.171 -5.724 1.00 0.00 H new ATOM 0 HE1 TRP A 51 30.177 -8.949 -3.548 1.00 0.00 H new ATOM 0 HE3 TRP A 51 25.845 -9.718 -6.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 27.806 -7.940 -2.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 24.432 -8.607 -4.960 1.00 0.00 H new ATOM 0 HH2 TRP A 51 25.401 -7.728 -2.875 1.00 0.00 H new ATOM 791 N GLY A 52 29.684 -8.289 -9.054 1.00 0.00 N ATOM 792 CA GLY A 52 30.282 -6.967 -9.112 1.00 0.00 C ATOM 793 C GLY A 52 29.389 -5.957 -9.804 1.00 0.00 C ATOM 794 O GLY A 52 29.185 -4.852 -9.301 1.00 0.00 O ATOM 0 H GLY A 52 30.292 -9.048 -9.362 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.497 -6.624 -8.100 1.00 0.00 H new ATOM 0 HA3 GLY A 52 31.235 -7.025 -9.638 1.00 0.00 H new ATOM 798 N GLN A 53 28.856 -6.335 -10.961 1.00 0.00 N ATOM 799 CA GLN A 53 27.982 -5.452 -11.725 1.00 0.00 C ATOM 800 C GLN A 53 26.903 -4.849 -10.831 1.00 0.00 C ATOM 801 O GLN A 53 26.516 -3.693 -11.003 1.00 0.00 O ATOM 802 CB GLN A 53 27.335 -6.216 -12.881 1.00 0.00 C ATOM 803 CG GLN A 53 28.235 -6.356 -14.097 1.00 0.00 C ATOM 804 CD GLN A 53 27.979 -5.286 -15.140 1.00 0.00 C ATOM 805 OE1 GLN A 53 28.740 -4.326 -15.261 1.00 0.00 O ATOM 806 NE2 GLN A 53 26.902 -5.447 -15.901 1.00 0.00 N ATOM 0 H GLN A 53 29.014 -7.247 -11.390 1.00 0.00 H new ATOM 0 HA GLN A 53 28.589 -4.642 -12.129 1.00 0.00 H new ATOM 0 HB2 GLN A 53 27.050 -7.209 -12.534 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.418 -5.705 -13.175 1.00 0.00 H new ATOM 0 HG2 GLN A 53 29.277 -6.307 -13.780 1.00 0.00 H new ATOM 0 HG3 GLN A 53 28.084 -7.338 -14.545 1.00 0.00 H new ATOM 0 HE21 GLN A 53 26.299 -6.258 -15.766 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.678 -4.759 -16.620 1.00 0.00 H new ATOM 815 N ARG A 54 26.422 -5.639 -9.877 1.00 0.00 N ATOM 816 CA ARG A 54 25.387 -5.183 -8.957 1.00 0.00 C ATOM 817 C ARG A 54 25.933 -4.122 -8.007 1.00 0.00 C ATOM 818 O ARG A 54 25.233 -3.175 -7.646 1.00 0.00 O ATOM 819 CB ARG A 54 24.830 -6.362 -8.157 1.00 0.00 C ATOM 820 CG ARG A 54 24.678 -7.635 -8.974 1.00 0.00 C ATOM 821 CD ARG A 54 23.871 -7.391 -10.240 1.00 0.00 C ATOM 822 NE ARG A 54 22.436 -7.528 -10.010 1.00 0.00 N ATOM 823 CZ ARG A 54 21.536 -7.572 -10.986 1.00 0.00 C ATOM 824 NH1 ARG A 54 21.921 -7.490 -12.252 1.00 0.00 N ATOM 825 NH2 ARG A 54 20.247 -7.698 -10.696 1.00 0.00 N ATOM 0 H ARG A 54 26.732 -6.598 -9.721 1.00 0.00 H new ATOM 0 HA ARG A 54 24.583 -4.740 -9.545 1.00 0.00 H new ATOM 0 HB2 ARG A 54 25.489 -6.560 -7.311 1.00 0.00 H new ATOM 0 HB3 ARG A 54 23.859 -6.085 -7.747 1.00 0.00 H new ATOM 0 HG2 ARG A 54 25.663 -8.019 -9.238 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.189 -8.400 -8.371 1.00 0.00 H new ATOM 0 HD2 ARG A 54 24.083 -6.391 -10.618 1.00 0.00 H new ATOM 0 HD3 ARG A 54 24.183 -8.096 -11.010 1.00 0.00 H new ATOM 0 HE ARG A 54 22.106 -7.594 -9.047 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.911 -7.393 -12.479 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.227 -7.524 -12.999 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.947 -7.761 -9.723 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.556 -7.732 -11.446 1.00 0.00 H new ATOM 839 N LYS A 55 27.188 -4.287 -7.603 1.00 0.00 N ATOM 840 CA LYS A 55 27.830 -3.344 -6.694 1.00 0.00 C ATOM 841 C LYS A 55 28.526 -2.230 -7.469 1.00 0.00 C ATOM 842 O LYS A 55 29.084 -1.304 -6.880 1.00 0.00 O ATOM 843 CB LYS A 55 28.842 -4.070 -5.805 1.00 0.00 C ATOM 844 CG LYS A 55 28.203 -5.011 -4.799 1.00 0.00 C ATOM 845 CD LYS A 55 28.343 -4.488 -3.379 1.00 0.00 C ATOM 846 CE LYS A 55 27.199 -3.555 -3.013 1.00 0.00 C ATOM 847 NZ LYS A 55 27.599 -2.123 -3.110 1.00 0.00 N ATOM 0 H LYS A 55 27.781 -5.065 -7.891 1.00 0.00 H new ATOM 0 HA LYS A 55 27.058 -2.899 -6.067 1.00 0.00 H new ATOM 0 HB2 LYS A 55 29.526 -4.637 -6.436 1.00 0.00 H new ATOM 0 HB3 LYS A 55 29.439 -3.331 -5.270 1.00 0.00 H new ATOM 0 HG2 LYS A 55 27.147 -5.138 -5.038 1.00 0.00 H new ATOM 0 HG3 LYS A 55 28.668 -5.994 -4.873 1.00 0.00 H new ATOM 0 HD2 LYS A 55 28.367 -5.326 -2.682 1.00 0.00 H new ATOM 0 HD3 LYS A 55 29.291 -3.960 -3.276 1.00 0.00 H new ATOM 0 HE2 LYS A 55 26.353 -3.741 -3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 55 26.865 -3.771 -1.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 26.792 -1.519 -2.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 28.390 -1.939 -2.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 27.894 -1.910 -4.084 1.00 0.00 H new ATOM 861 N LYS A 56 28.488 -2.324 -8.794 1.00 0.00 N ATOM 862 CA LYS A 56 29.112 -1.322 -9.651 1.00 0.00 C ATOM 863 C LYS A 56 30.575 -1.117 -9.271 1.00 0.00 C ATOM 864 O LYS A 56 31.107 -0.014 -9.389 1.00 0.00 O ATOM 865 CB LYS A 56 28.357 0.005 -9.552 1.00 0.00 C ATOM 866 CG LYS A 56 27.701 0.430 -10.854 1.00 0.00 C ATOM 867 CD LYS A 56 28.495 1.525 -11.547 1.00 0.00 C ATOM 868 CE LYS A 56 28.305 2.870 -10.862 1.00 0.00 C ATOM 869 NZ LYS A 56 27.987 3.949 -11.837 1.00 0.00 N ATOM 0 H LYS A 56 28.031 -3.084 -9.298 1.00 0.00 H new ATOM 0 HA LYS A 56 29.069 -1.681 -10.679 1.00 0.00 H new ATOM 0 HB2 LYS A 56 27.592 -0.079 -8.780 1.00 0.00 H new ATOM 0 HB3 LYS A 56 29.049 0.784 -9.232 1.00 0.00 H new ATOM 0 HG2 LYS A 56 27.613 -0.431 -11.516 1.00 0.00 H new ATOM 0 HG3 LYS A 56 26.689 0.784 -10.654 1.00 0.00 H new ATOM 0 HD2 LYS A 56 29.553 1.263 -11.549 1.00 0.00 H new ATOM 0 HD3 LYS A 56 28.183 1.599 -12.589 1.00 0.00 H new ATOM 0 HE2 LYS A 56 27.501 2.794 -10.129 1.00 0.00 H new ATOM 0 HE3 LYS A 56 29.211 3.130 -10.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 27.865 4.849 -11.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 28.765 4.039 -12.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 27.108 3.713 -12.341 1.00 0.00 H new ATOM 883 N ASN A 57 31.219 -2.186 -8.816 1.00 0.00 N ATOM 884 CA ASN A 57 32.621 -2.123 -8.420 1.00 0.00 C ATOM 885 C ASN A 57 33.535 -2.180 -9.640 1.00 0.00 C ATOM 886 O ASN A 57 34.453 -1.372 -9.780 1.00 0.00 O ATOM 887 CB ASN A 57 32.956 -3.270 -7.465 1.00 0.00 C ATOM 888 CG ASN A 57 34.413 -3.269 -7.046 1.00 0.00 C ATOM 889 OD1 ASN A 57 35.158 -2.338 -7.355 1.00 0.00 O ATOM 890 ND2 ASN A 57 34.827 -4.314 -6.340 1.00 0.00 N ATOM 0 H ASN A 57 30.793 -3.107 -8.712 1.00 0.00 H new ATOM 0 HA ASN A 57 32.785 -1.174 -7.909 1.00 0.00 H new ATOM 0 HB2 ASN A 57 32.326 -3.196 -6.578 1.00 0.00 H new ATOM 0 HB3 ASN A 57 32.720 -4.219 -7.946 1.00 0.00 H new ATOM 0 HD21 ASN A 57 35.797 -4.368 -6.031 1.00 0.00 H new ATOM 0 HD22 ASN A 57 34.175 -5.063 -6.107 1.00 0.00 H new ATOM 897 N ASP A 58 33.275 -3.139 -10.522 1.00 0.00 N ATOM 898 CA ASP A 58 34.072 -3.302 -11.732 1.00 0.00 C ATOM 899 C ASP A 58 35.334 -4.110 -11.447 1.00 0.00 C ATOM 900 O ASP A 58 35.921 -4.703 -12.353 1.00 0.00 O ATOM 901 CB ASP A 58 34.446 -1.935 -12.309 1.00 0.00 C ATOM 902 CG ASP A 58 34.498 -1.941 -13.824 1.00 0.00 C ATOM 903 OD1 ASP A 58 34.982 -2.940 -14.398 1.00 0.00 O ATOM 904 OD2 ASP A 58 34.053 -0.948 -14.436 1.00 0.00 O ATOM 0 H ASP A 58 32.518 -3.815 -10.421 1.00 0.00 H new ATOM 0 HA ASP A 58 33.472 -3.845 -12.462 1.00 0.00 H new ATOM 0 HB2 ASP A 58 33.721 -1.193 -11.976 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.416 -1.631 -11.916 1.00 0.00 H new ATOM 909 N ARG A 59 35.747 -4.128 -10.184 1.00 0.00 N ATOM 910 CA ARG A 59 36.941 -4.862 -9.781 1.00 0.00 C ATOM 911 C ARG A 59 36.569 -6.103 -8.975 1.00 0.00 C ATOM 912 O ARG A 59 37.334 -6.553 -8.122 1.00 0.00 O ATOM 913 CB ARG A 59 37.863 -3.962 -8.956 1.00 0.00 C ATOM 914 CG ARG A 59 38.851 -3.169 -9.796 1.00 0.00 C ATOM 915 CD ARG A 59 40.034 -4.025 -10.221 1.00 0.00 C ATOM 916 NE ARG A 59 41.040 -3.249 -10.942 1.00 0.00 N ATOM 917 CZ ARG A 59 41.978 -2.525 -10.343 1.00 0.00 C ATOM 918 NH1 ARG A 59 42.040 -2.479 -9.019 1.00 0.00 N ATOM 919 NH2 ARG A 59 42.858 -1.847 -11.068 1.00 0.00 N ATOM 0 H ARG A 59 35.273 -3.643 -9.422 1.00 0.00 H new ATOM 0 HA ARG A 59 37.465 -5.179 -10.683 1.00 0.00 H new ATOM 0 HB2 ARG A 59 37.255 -3.269 -8.375 1.00 0.00 H new ATOM 0 HB3 ARG A 59 38.415 -4.576 -8.244 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.347 -2.778 -10.680 1.00 0.00 H new ATOM 0 HG3 ARG A 59 39.208 -2.311 -9.227 1.00 0.00 H new ATOM 0 HD2 ARG A 59 40.489 -4.478 -9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 59 39.683 -4.840 -10.854 1.00 0.00 H new ATOM 0 HE ARG A 59 41.021 -3.264 -11.962 1.00 0.00 H new ATOM 0 HH11 ARG A 59 41.366 -3.001 -8.458 1.00 0.00 H new ATOM 0 HH12 ARG A 59 42.762 -1.922 -8.561 1.00 0.00 H new ATOM 0 HH21 ARG A 59 42.814 -1.882 -12.086 1.00 0.00 H new ATOM 0 HH22 ARG A 59 43.578 -1.291 -10.607 1.00 0.00 H new ATOM 933 N MET A 60 35.390 -6.651 -9.251 1.00 0.00 N ATOM 934 CA MET A 60 34.918 -7.840 -8.552 1.00 0.00 C ATOM 935 C MET A 60 35.531 -9.102 -9.151 1.00 0.00 C ATOM 936 O MET A 60 35.655 -9.227 -10.370 1.00 0.00 O ATOM 937 CB MET A 60 33.392 -7.922 -8.614 1.00 0.00 C ATOM 938 CG MET A 60 32.824 -9.182 -7.980 1.00 0.00 C ATOM 939 SD MET A 60 33.258 -9.339 -6.237 1.00 0.00 S ATOM 940 CE MET A 60 32.395 -7.930 -5.546 1.00 0.00 C ATOM 0 H MET A 60 34.744 -6.291 -9.954 1.00 0.00 H new ATOM 0 HA MET A 60 35.229 -7.766 -7.510 1.00 0.00 H new ATOM 0 HB2 MET A 60 32.969 -7.051 -8.113 1.00 0.00 H new ATOM 0 HB3 MET A 60 33.076 -7.875 -9.656 1.00 0.00 H new ATOM 0 HG2 MET A 60 31.739 -9.177 -8.081 1.00 0.00 H new ATOM 0 HG3 MET A 60 33.191 -10.054 -8.522 1.00 0.00 H new ATOM 0 HE1 MET A 60 32.012 -8.187 -4.558 1.00 0.00 H new ATOM 0 HE2 MET A 60 33.082 -7.088 -5.461 1.00 0.00 H new ATOM 0 HE3 MET A 60 31.565 -7.657 -6.197 1.00 0.00 H new ATOM 950 N THR A 61 35.915 -10.036 -8.287 1.00 0.00 N ATOM 951 CA THR A 61 36.516 -11.288 -8.730 1.00 0.00 C ATOM 952 C THR A 61 36.354 -12.379 -7.679 1.00 0.00 C ATOM 953 O THR A 61 36.527 -12.134 -6.484 1.00 0.00 O ATOM 954 CB THR A 61 38.014 -11.111 -9.044 1.00 0.00 C ATOM 955 OG1 THR A 61 38.570 -12.351 -9.496 1.00 0.00 O ATOM 956 CG2 THR A 61 38.771 -10.628 -7.816 1.00 0.00 C ATOM 0 H THR A 61 35.820 -9.949 -7.275 1.00 0.00 H new ATOM 0 HA THR A 61 35.994 -11.585 -9.640 1.00 0.00 H new ATOM 0 HB THR A 61 38.112 -10.362 -9.830 1.00 0.00 H new ATOM 0 HG1 THR A 61 39.522 -12.229 -9.695 1.00 0.00 H new ATOM 0 HG21 THR A 61 39.826 -10.510 -8.062 1.00 0.00 H new ATOM 0 HG22 THR A 61 38.365 -9.670 -7.492 1.00 0.00 H new ATOM 0 HG23 THR A 61 38.665 -11.357 -7.013 1.00 0.00 H new ATOM 964 N TYR A 62 36.023 -13.584 -8.129 1.00 0.00 N ATOM 965 CA TYR A 62 35.836 -14.713 -7.226 1.00 0.00 C ATOM 966 C TYR A 62 36.814 -14.643 -6.057 1.00 0.00 C ATOM 967 O TYR A 62 36.449 -14.906 -4.912 1.00 0.00 O ATOM 968 CB TYR A 62 36.018 -16.031 -7.980 1.00 0.00 C ATOM 969 CG TYR A 62 35.347 -17.209 -7.309 1.00 0.00 C ATOM 970 CD1 TYR A 62 34.030 -17.129 -6.876 1.00 0.00 C ATOM 971 CD2 TYR A 62 36.031 -18.402 -7.109 1.00 0.00 C ATOM 972 CE1 TYR A 62 33.413 -18.203 -6.262 1.00 0.00 C ATOM 973 CE2 TYR A 62 35.423 -19.481 -6.498 1.00 0.00 C ATOM 974 CZ TYR A 62 34.114 -19.376 -6.076 1.00 0.00 C ATOM 975 OH TYR A 62 33.504 -20.448 -5.465 1.00 0.00 O ATOM 0 H TYR A 62 35.879 -13.804 -9.114 1.00 0.00 H new ATOM 0 HA TYR A 62 34.821 -14.666 -6.830 1.00 0.00 H new ATOM 0 HB2 TYR A 62 35.618 -15.922 -8.988 1.00 0.00 H new ATOM 0 HB3 TYR A 62 37.083 -16.239 -8.080 1.00 0.00 H new ATOM 0 HD1 TYR A 62 33.478 -16.212 -7.021 1.00 0.00 H new ATOM 0 HD2 TYR A 62 37.056 -18.487 -7.437 1.00 0.00 H new ATOM 0 HE1 TYR A 62 32.388 -18.124 -5.930 1.00 0.00 H new ATOM 0 HE2 TYR A 62 35.969 -20.401 -6.352 1.00 0.00 H new ATOM 0 HH TYR A 62 33.751 -20.468 -4.517 1.00 0.00 H new ATOM 985 N GLU A 63 38.059 -14.286 -6.357 1.00 0.00 N ATOM 986 CA GLU A 63 39.091 -14.182 -5.331 1.00 0.00 C ATOM 987 C GLU A 63 38.633 -13.282 -4.188 1.00 0.00 C ATOM 988 O GLU A 63 38.767 -13.631 -3.015 1.00 0.00 O ATOM 989 CB GLU A 63 40.388 -13.639 -5.935 1.00 0.00 C ATOM 990 CG GLU A 63 41.485 -14.682 -6.060 1.00 0.00 C ATOM 991 CD GLU A 63 42.821 -14.190 -5.537 1.00 0.00 C ATOM 992 OE1 GLU A 63 42.996 -12.958 -5.426 1.00 0.00 O ATOM 993 OE2 GLU A 63 43.690 -15.035 -5.239 1.00 0.00 O ATOM 0 H GLU A 63 38.377 -14.064 -7.300 1.00 0.00 H new ATOM 0 HA GLU A 63 39.274 -15.180 -4.933 1.00 0.00 H new ATOM 0 HB2 GLU A 63 40.175 -13.228 -6.922 1.00 0.00 H new ATOM 0 HB3 GLU A 63 40.749 -12.816 -5.318 1.00 0.00 H new ATOM 0 HG2 GLU A 63 41.193 -15.578 -5.513 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.592 -14.968 -7.106 1.00 0.00 H new ATOM 1000 N LYS A 64 38.091 -12.120 -4.538 1.00 0.00 N ATOM 1001 CA LYS A 64 37.611 -11.168 -3.543 1.00 0.00 C ATOM 1002 C LYS A 64 36.236 -11.573 -3.021 1.00 0.00 C ATOM 1003 O LYS A 64 35.976 -11.514 -1.819 1.00 0.00 O ATOM 1004 CB LYS A 64 37.547 -9.762 -4.143 1.00 0.00 C ATOM 1005 CG LYS A 64 38.871 -9.281 -4.711 1.00 0.00 C ATOM 1006 CD LYS A 64 38.722 -7.946 -5.421 1.00 0.00 C ATOM 1007 CE LYS A 64 39.994 -7.564 -6.162 1.00 0.00 C ATOM 1008 NZ LYS A 64 40.851 -6.650 -5.359 1.00 0.00 N ATOM 0 H LYS A 64 37.973 -11.815 -5.504 1.00 0.00 H new ATOM 0 HA LYS A 64 38.311 -11.169 -2.708 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.796 -9.747 -4.933 1.00 0.00 H new ATOM 0 HB3 LYS A 64 37.216 -9.063 -3.375 1.00 0.00 H new ATOM 0 HG2 LYS A 64 39.600 -9.187 -3.906 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.260 -10.023 -5.408 1.00 0.00 H new ATOM 0 HD2 LYS A 64 37.891 -7.998 -6.125 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.476 -7.172 -4.694 1.00 0.00 H new ATOM 0 HE2 LYS A 64 40.555 -8.465 -6.408 1.00 0.00 H new ATOM 0 HE3 LYS A 64 39.734 -7.083 -7.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 41.708 -6.413 -5.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 40.325 -5.779 -5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 41.120 -7.118 -4.470 1.00 0.00 H new ATOM 1022 N LEU A 65 35.361 -11.985 -3.931 1.00 0.00 N ATOM 1023 CA LEU A 65 34.013 -12.402 -3.562 1.00 0.00 C ATOM 1024 C LEU A 65 34.051 -13.464 -2.468 1.00 0.00 C ATOM 1025 O LEU A 65 33.356 -13.354 -1.458 1.00 0.00 O ATOM 1026 CB LEU A 65 33.272 -12.942 -4.787 1.00 0.00 C ATOM 1027 CG LEU A 65 31.866 -13.490 -4.533 1.00 0.00 C ATOM 1028 CD1 LEU A 65 30.937 -13.125 -5.680 1.00 0.00 C ATOM 1029 CD2 LEU A 65 31.909 -14.998 -4.338 1.00 0.00 C ATOM 0 H LEU A 65 35.561 -12.039 -4.930 1.00 0.00 H new ATOM 0 HA LEU A 65 33.482 -11.531 -3.178 1.00 0.00 H new ATOM 0 HB2 LEU A 65 33.201 -12.143 -5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 65 33.874 -13.734 -5.231 1.00 0.00 H new ATOM 0 HG LEU A 65 31.479 -13.037 -3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 65 29.942 -13.523 -5.483 1.00 0.00 H new ATOM 0 HD12 LEU A 65 30.883 -12.040 -5.773 1.00 0.00 H new ATOM 0 HD13 LEU A 65 31.320 -13.550 -6.608 1.00 0.00 H new ATOM 0 HD21 LEU A 65 30.900 -15.371 -4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 65 32.316 -15.469 -5.233 1.00 0.00 H new ATOM 0 HD23 LEU A 65 32.541 -15.236 -3.483 1.00 0.00 H new ATOM 1041 N SER A 66 34.870 -14.490 -2.674 1.00 0.00 N ATOM 1042 CA SER A 66 34.999 -15.572 -1.706 1.00 0.00 C ATOM 1043 C SER A 66 35.113 -15.022 -0.288 1.00 0.00 C ATOM 1044 O SER A 66 34.600 -15.613 0.663 1.00 0.00 O ATOM 1045 CB SER A 66 36.221 -16.433 -2.031 1.00 0.00 C ATOM 1046 OG SER A 66 37.419 -15.784 -1.643 1.00 0.00 O ATOM 0 H SER A 66 35.455 -14.595 -3.503 1.00 0.00 H new ATOM 0 HA SER A 66 34.102 -16.189 -1.767 1.00 0.00 H new ATOM 0 HB2 SER A 66 36.141 -17.392 -1.519 1.00 0.00 H new ATOM 0 HB3 SER A 66 36.248 -16.644 -3.100 1.00 0.00 H new ATOM 0 HG SER A 66 37.652 -15.102 -2.307 1.00 0.00 H new ATOM 1052 N ARG A 67 35.789 -13.885 -0.154 1.00 0.00 N ATOM 1053 CA ARG A 67 35.972 -13.254 1.148 1.00 0.00 C ATOM 1054 C ARG A 67 34.667 -13.247 1.937 1.00 0.00 C ATOM 1055 O ARG A 67 34.654 -13.518 3.137 1.00 0.00 O ATOM 1056 CB ARG A 67 36.486 -11.823 0.977 1.00 0.00 C ATOM 1057 CG ARG A 67 35.378 -10.788 0.870 1.00 0.00 C ATOM 1058 CD ARG A 67 35.941 -9.385 0.701 1.00 0.00 C ATOM 1059 NE ARG A 67 35.274 -8.419 1.571 1.00 0.00 N ATOM 1060 CZ ARG A 67 35.487 -8.339 2.879 1.00 0.00 C ATOM 1061 NH1 ARG A 67 36.344 -9.162 3.467 1.00 0.00 N ATOM 1062 NH2 ARG A 67 34.842 -7.433 3.603 1.00 0.00 N ATOM 0 H ARG A 67 36.219 -13.382 -0.931 1.00 0.00 H new ATOM 0 HA ARG A 67 36.709 -13.833 1.704 1.00 0.00 H new ATOM 0 HB2 ARG A 67 37.126 -11.572 1.823 1.00 0.00 H new ATOM 0 HB3 ARG A 67 37.106 -11.773 0.082 1.00 0.00 H new ATOM 0 HG2 ARG A 67 34.735 -11.028 0.023 1.00 0.00 H new ATOM 0 HG3 ARG A 67 34.755 -10.826 1.764 1.00 0.00 H new ATOM 0 HD2 ARG A 67 37.009 -9.394 0.921 1.00 0.00 H new ATOM 0 HD3 ARG A 67 35.832 -9.073 -0.338 1.00 0.00 H new ATOM 0 HE ARG A 67 34.608 -7.771 1.150 1.00 0.00 H new ATOM 0 HH11 ARG A 67 36.842 -9.860 2.914 1.00 0.00 H new ATOM 0 HH12 ARG A 67 36.505 -9.098 4.472 1.00 0.00 H new ATOM 0 HH21 ARG A 67 34.182 -6.798 3.155 1.00 0.00 H new ATOM 0 HH22 ARG A 67 35.006 -7.372 4.608 1.00 0.00 H new ATOM 1076 N ALA A 68 33.570 -12.934 1.254 1.00 0.00 N ATOM 1077 CA ALA A 68 32.260 -12.893 1.891 1.00 0.00 C ATOM 1078 C ALA A 68 31.719 -14.299 2.127 1.00 0.00 C ATOM 1079 O ALA A 68 31.060 -14.561 3.135 1.00 0.00 O ATOM 1080 CB ALA A 68 31.286 -12.087 1.043 1.00 0.00 C ATOM 0 H ALA A 68 33.563 -12.705 0.260 1.00 0.00 H new ATOM 0 HA ALA A 68 32.370 -12.407 2.860 1.00 0.00 H new ATOM 0 HB1 ALA A 68 30.311 -12.065 1.531 1.00 0.00 H new ATOM 0 HB2 ALA A 68 31.659 -11.069 0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 68 31.190 -12.550 0.061 1.00 0.00 H new ATOM 1086 N LEU A 69 32.002 -15.201 1.194 1.00 0.00 N ATOM 1087 CA LEU A 69 31.543 -16.582 1.300 1.00 0.00 C ATOM 1088 C LEU A 69 32.121 -17.253 2.542 1.00 0.00 C ATOM 1089 O LEU A 69 31.424 -17.984 3.245 1.00 0.00 O ATOM 1090 CB LEU A 69 31.938 -17.369 0.050 1.00 0.00 C ATOM 1091 CG LEU A 69 31.445 -16.804 -1.283 1.00 0.00 C ATOM 1092 CD1 LEU A 69 31.905 -17.681 -2.437 1.00 0.00 C ATOM 1093 CD2 LEU A 69 29.929 -16.676 -1.280 1.00 0.00 C ATOM 0 H LEU A 69 32.547 -15.001 0.355 1.00 0.00 H new ATOM 0 HA LEU A 69 30.456 -16.573 1.387 1.00 0.00 H new ATOM 0 HB2 LEU A 69 33.026 -17.434 0.014 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.561 -18.387 0.152 1.00 0.00 H new ATOM 0 HG LEU A 69 31.873 -15.810 -1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.545 -17.263 -3.377 1.00 0.00 H new ATOM 0 HD12 LEU A 69 32.994 -17.722 -2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.506 -18.687 -2.311 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.596 -16.272 -2.236 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.481 -17.658 -1.125 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.622 -16.006 -0.477 1.00 0.00 H new ATOM 1105 N ARG A 70 33.398 -16.999 2.805 1.00 0.00 N ATOM 1106 CA ARG A 70 34.070 -17.578 3.963 1.00 0.00 C ATOM 1107 C ARG A 70 33.763 -16.778 5.225 1.00 0.00 C ATOM 1108 O ARG A 70 33.932 -17.271 6.341 1.00 0.00 O ATOM 1109 CB ARG A 70 35.581 -17.626 3.731 1.00 0.00 C ATOM 1110 CG ARG A 70 35.982 -18.398 2.484 1.00 0.00 C ATOM 1111 CD ARG A 70 36.366 -19.832 2.817 1.00 0.00 C ATOM 1112 NE ARG A 70 37.445 -20.321 1.962 1.00 0.00 N ATOM 1113 CZ ARG A 70 38.674 -19.818 1.969 1.00 0.00 C ATOM 1114 NH1 ARG A 70 38.979 -18.816 2.782 1.00 0.00 N ATOM 1115 NH2 ARG A 70 39.601 -20.317 1.161 1.00 0.00 N ATOM 0 H ARG A 70 33.989 -16.396 2.232 1.00 0.00 H new ATOM 0 HA ARG A 70 33.698 -18.594 4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 70 35.961 -16.607 3.655 1.00 0.00 H new ATOM 0 HB3 ARG A 70 36.059 -18.081 4.599 1.00 0.00 H new ATOM 0 HG2 ARG A 70 35.156 -18.397 1.773 1.00 0.00 H new ATOM 0 HG3 ARG A 70 36.821 -17.899 1.999 1.00 0.00 H new ATOM 0 HD2 ARG A 70 36.675 -19.892 3.861 1.00 0.00 H new ATOM 0 HD3 ARG A 70 35.494 -20.476 2.705 1.00 0.00 H new ATOM 0 HE ARG A 70 37.243 -21.091 1.325 1.00 0.00 H new ATOM 0 HH11 ARG A 70 38.269 -18.430 3.404 1.00 0.00 H new ATOM 0 HH12 ARG A 70 39.924 -18.431 2.785 1.00 0.00 H new ATOM 0 HH21 ARG A 70 39.370 -21.087 0.534 1.00 0.00 H new ATOM 0 HH22 ARG A 70 40.545 -19.930 1.167 1.00 0.00 H new ATOM 1129 N TYR A 71 33.312 -15.543 5.042 1.00 0.00 N ATOM 1130 CA TYR A 71 32.985 -14.674 6.166 1.00 0.00 C ATOM 1131 C TYR A 71 31.535 -14.868 6.601 1.00 0.00 C ATOM 1132 O TYR A 71 31.136 -14.435 7.682 1.00 0.00 O ATOM 1133 CB TYR A 71 33.225 -13.210 5.793 1.00 0.00 C ATOM 1134 CG TYR A 71 32.864 -12.237 6.893 1.00 0.00 C ATOM 1135 CD1 TYR A 71 31.557 -11.791 7.051 1.00 0.00 C ATOM 1136 CD2 TYR A 71 33.828 -11.765 7.774 1.00 0.00 C ATOM 1137 CE1 TYR A 71 31.223 -10.902 8.054 1.00 0.00 C ATOM 1138 CE2 TYR A 71 33.503 -10.877 8.781 1.00 0.00 C ATOM 1139 CZ TYR A 71 32.199 -10.448 8.917 1.00 0.00 C ATOM 1140 OH TYR A 71 31.869 -9.564 9.918 1.00 0.00 O ATOM 0 H TYR A 71 33.164 -15.120 4.125 1.00 0.00 H new ATOM 0 HA TYR A 71 33.635 -14.941 6.999 1.00 0.00 H new ATOM 0 HB2 TYR A 71 34.275 -13.078 5.533 1.00 0.00 H new ATOM 0 HB3 TYR A 71 32.643 -12.971 4.903 1.00 0.00 H new ATOM 0 HD1 TYR A 71 30.790 -12.145 6.378 1.00 0.00 H new ATOM 0 HD2 TYR A 71 34.850 -12.098 7.670 1.00 0.00 H new ATOM 0 HE1 TYR A 71 30.203 -10.564 8.162 1.00 0.00 H new ATOM 0 HE2 TYR A 71 34.265 -10.521 9.458 1.00 0.00 H new ATOM 0 HH TYR A 71 32.670 -9.344 10.438 1.00 0.00 H new ATOM 1150 N TYR A 72 30.752 -15.522 5.750 1.00 0.00 N ATOM 1151 CA TYR A 72 29.346 -15.773 6.044 1.00 0.00 C ATOM 1152 C TYR A 72 29.194 -16.921 7.038 1.00 0.00 C ATOM 1153 O TYR A 72 28.174 -17.037 7.718 1.00 0.00 O ATOM 1154 CB TYR A 72 28.584 -16.094 4.757 1.00 0.00 C ATOM 1155 CG TYR A 72 28.034 -14.871 4.059 1.00 0.00 C ATOM 1156 CD1 TYR A 72 27.315 -13.911 4.761 1.00 0.00 C ATOM 1157 CD2 TYR A 72 28.230 -14.676 2.697 1.00 0.00 C ATOM 1158 CE1 TYR A 72 26.810 -12.792 4.127 1.00 0.00 C ATOM 1159 CE2 TYR A 72 27.730 -13.560 2.056 1.00 0.00 C ATOM 1160 CZ TYR A 72 27.020 -12.621 2.775 1.00 0.00 C ATOM 1161 OH TYR A 72 26.518 -11.509 2.139 1.00 0.00 O ATOM 0 H TYR A 72 31.067 -15.888 4.851 1.00 0.00 H new ATOM 0 HA TYR A 72 28.928 -14.871 6.491 1.00 0.00 H new ATOM 0 HB2 TYR A 72 29.248 -16.624 4.074 1.00 0.00 H new ATOM 0 HB3 TYR A 72 27.761 -16.770 4.991 1.00 0.00 H new ATOM 0 HD1 TYR A 72 27.148 -14.042 5.820 1.00 0.00 H new ATOM 0 HD2 TYR A 72 28.783 -15.410 2.130 1.00 0.00 H new ATOM 0 HE1 TYR A 72 26.254 -12.055 4.687 1.00 0.00 H new ATOM 0 HE2 TYR A 72 27.894 -13.423 0.997 1.00 0.00 H new ATOM 0 HH TYR A 72 27.098 -11.274 1.385 1.00 0.00 H new ATOM 1171 N TYR A 73 30.216 -17.765 7.117 1.00 0.00 N ATOM 1172 CA TYR A 73 30.197 -18.905 8.026 1.00 0.00 C ATOM 1173 C TYR A 73 30.105 -18.443 9.478 1.00 0.00 C ATOM 1174 O TYR A 73 29.711 -19.205 10.361 1.00 0.00 O ATOM 1175 CB TYR A 73 31.448 -19.762 7.830 1.00 0.00 C ATOM 1176 CG TYR A 73 31.587 -20.320 6.432 1.00 0.00 C ATOM 1177 CD1 TYR A 73 30.498 -20.877 5.774 1.00 0.00 C ATOM 1178 CD2 TYR A 73 32.808 -20.290 5.769 1.00 0.00 C ATOM 1179 CE1 TYR A 73 30.620 -21.389 4.496 1.00 0.00 C ATOM 1180 CE2 TYR A 73 32.939 -20.798 4.491 1.00 0.00 C ATOM 1181 CZ TYR A 73 31.842 -21.346 3.859 1.00 0.00 C ATOM 1182 OH TYR A 73 31.969 -21.854 2.586 1.00 0.00 O ATOM 0 H TYR A 73 31.068 -17.682 6.563 1.00 0.00 H new ATOM 0 HA TYR A 73 29.315 -19.504 7.798 1.00 0.00 H new ATOM 0 HB2 TYR A 73 32.329 -19.163 8.062 1.00 0.00 H new ATOM 0 HB3 TYR A 73 31.428 -20.588 8.541 1.00 0.00 H new ATOM 0 HD1 TYR A 73 29.539 -20.911 6.270 1.00 0.00 H new ATOM 0 HD2 TYR A 73 33.669 -19.862 6.261 1.00 0.00 H new ATOM 0 HE1 TYR A 73 29.763 -21.820 3.999 1.00 0.00 H new ATOM 0 HE2 TYR A 73 33.895 -20.766 3.989 1.00 0.00 H new ATOM 0 HH TYR A 73 31.462 -21.297 1.959 1.00 0.00 H new ATOM 1192 N LYS A 74 30.471 -17.189 9.716 1.00 0.00 N ATOM 1193 CA LYS A 74 30.430 -16.621 11.059 1.00 0.00 C ATOM 1194 C LYS A 74 29.007 -16.223 11.437 1.00 0.00 C ATOM 1195 O LYS A 74 28.555 -16.481 12.553 1.00 0.00 O ATOM 1196 CB LYS A 74 31.353 -15.404 11.149 1.00 0.00 C ATOM 1197 CG LYS A 74 32.617 -15.536 10.317 1.00 0.00 C ATOM 1198 CD LYS A 74 33.749 -14.698 10.886 1.00 0.00 C ATOM 1199 CE LYS A 74 35.087 -15.074 10.267 1.00 0.00 C ATOM 1200 NZ LYS A 74 35.704 -13.930 9.541 1.00 0.00 N ATOM 0 H LYS A 74 30.800 -16.545 8.996 1.00 0.00 H new ATOM 0 HA LYS A 74 30.774 -17.382 11.759 1.00 0.00 H new ATOM 0 HB2 LYS A 74 30.806 -14.519 10.825 1.00 0.00 H new ATOM 0 HB3 LYS A 74 31.629 -15.244 12.191 1.00 0.00 H new ATOM 0 HG2 LYS A 74 32.921 -16.582 10.279 1.00 0.00 H new ATOM 0 HG3 LYS A 74 32.413 -15.226 9.292 1.00 0.00 H new ATOM 0 HD2 LYS A 74 33.547 -13.642 10.706 1.00 0.00 H new ATOM 0 HD3 LYS A 74 33.796 -14.834 11.967 1.00 0.00 H new ATOM 0 HE2 LYS A 74 35.765 -15.416 11.049 1.00 0.00 H new ATOM 0 HE3 LYS A 74 34.947 -15.908 9.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 36.386 -14.289 8.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 34.963 -13.388 9.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 36.195 -13.313 10.219 1.00 0.00 H new ATOM 1214 N THR A 75 28.304 -15.594 10.501 1.00 0.00 N ATOM 1215 CA THR A 75 26.933 -15.160 10.736 1.00 0.00 C ATOM 1216 C THR A 75 25.950 -16.307 10.528 1.00 0.00 C ATOM 1217 O THR A 75 24.797 -16.233 10.948 1.00 0.00 O ATOM 1218 CB THR A 75 26.546 -13.993 9.809 1.00 0.00 C ATOM 1219 OG1 THR A 75 26.474 -14.448 8.453 1.00 0.00 O ATOM 1220 CG2 THR A 75 27.554 -12.859 9.916 1.00 0.00 C ATOM 0 H THR A 75 28.662 -15.374 9.572 1.00 0.00 H new ATOM 0 HA THR A 75 26.881 -14.824 11.772 1.00 0.00 H new ATOM 0 HB THR A 75 25.570 -13.620 10.119 1.00 0.00 H new ATOM 0 HG1 THR A 75 27.035 -15.244 8.345 1.00 0.00 H new ATOM 0 HG21 THR A 75 27.259 -12.046 9.252 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.585 -12.495 10.943 1.00 0.00 H new ATOM 0 HG23 THR A 75 28.541 -13.222 9.630 1.00 0.00 H new ATOM 1228 N GLY A 76 26.416 -17.369 9.876 1.00 0.00 N ATOM 1229 CA GLY A 76 25.565 -18.517 9.624 1.00 0.00 C ATOM 1230 C GLY A 76 24.929 -18.476 8.248 1.00 0.00 C ATOM 1231 O GLY A 76 24.388 -19.477 7.778 1.00 0.00 O ATOM 0 H GLY A 76 27.367 -17.454 9.518 1.00 0.00 H new ATOM 0 HA2 GLY A 76 26.153 -19.430 9.722 1.00 0.00 H new ATOM 0 HA3 GLY A 76 24.782 -18.559 10.382 1.00 0.00 H new ATOM 1235 N ILE A 77 24.993 -17.317 7.603 1.00 0.00 N ATOM 1236 CA ILE A 77 24.419 -17.151 6.273 1.00 0.00 C ATOM 1237 C ILE A 77 24.781 -18.323 5.368 1.00 0.00 C ATOM 1238 O ILE A 77 23.928 -18.863 4.662 1.00 0.00 O ATOM 1239 CB ILE A 77 24.894 -15.842 5.614 1.00 0.00 C ATOM 1240 CG1 ILE A 77 24.286 -14.635 6.332 1.00 0.00 C ATOM 1241 CG2 ILE A 77 24.525 -15.828 4.138 1.00 0.00 C ATOM 1242 CD1 ILE A 77 22.858 -14.347 5.927 1.00 0.00 C ATOM 0 H ILE A 77 25.436 -16.479 7.979 1.00 0.00 H new ATOM 0 HA ILE A 77 23.337 -17.113 6.399 1.00 0.00 H new ATOM 0 HB ILE A 77 25.979 -15.783 5.698 1.00 0.00 H new ATOM 0 HG12 ILE A 77 24.322 -14.806 7.408 1.00 0.00 H new ATOM 0 HG13 ILE A 77 24.897 -13.756 6.128 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.867 -14.897 3.686 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.000 -16.671 3.636 1.00 0.00 H new ATOM 0 HG23 ILE A 77 23.443 -15.906 4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 77 22.492 -13.479 6.476 1.00 0.00 H new ATOM 0 HD12 ILE A 77 22.817 -14.144 4.857 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.234 -15.211 6.156 1.00 0.00 H new ATOM 1254 N LEU A 78 26.050 -18.714 5.394 1.00 0.00 N ATOM 1255 CA LEU A 78 26.526 -19.824 4.576 1.00 0.00 C ATOM 1256 C LEU A 78 27.023 -20.971 5.451 1.00 0.00 C ATOM 1257 O LEU A 78 27.307 -20.783 6.634 1.00 0.00 O ATOM 1258 CB LEU A 78 27.646 -19.355 3.646 1.00 0.00 C ATOM 1259 CG LEU A 78 27.207 -18.829 2.279 1.00 0.00 C ATOM 1260 CD1 LEU A 78 28.406 -18.326 1.490 1.00 0.00 C ATOM 1261 CD2 LEU A 78 26.471 -19.911 1.502 1.00 0.00 C ATOM 0 H LEU A 78 26.768 -18.279 5.973 1.00 0.00 H new ATOM 0 HA LEU A 78 25.691 -20.185 3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 78 28.206 -18.569 4.152 1.00 0.00 H new ATOM 0 HB3 LEU A 78 28.333 -20.186 3.490 1.00 0.00 H new ATOM 0 HG LEU A 78 26.524 -17.994 2.435 1.00 0.00 H new ATOM 0 HD11 LEU A 78 28.074 -17.956 0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 78 28.891 -17.519 2.040 1.00 0.00 H new ATOM 0 HD13 LEU A 78 29.114 -19.142 1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 78 26.166 -19.519 0.532 1.00 0.00 H new ATOM 0 HD22 LEU A 78 27.130 -20.767 1.356 1.00 0.00 H new ATOM 0 HD23 LEU A 78 25.589 -20.224 2.060 1.00 0.00 H new ATOM 1273 N GLU A 79 27.127 -22.157 4.860 1.00 0.00 N ATOM 1274 CA GLU A 79 27.591 -23.333 5.587 1.00 0.00 C ATOM 1275 C GLU A 79 28.896 -23.858 4.995 1.00 0.00 C ATOM 1276 O GLU A 79 28.965 -24.185 3.810 1.00 0.00 O ATOM 1277 CB GLU A 79 26.527 -24.432 5.557 1.00 0.00 C ATOM 1278 CG GLU A 79 25.842 -24.652 6.895 1.00 0.00 C ATOM 1279 CD GLU A 79 25.714 -26.121 7.250 1.00 0.00 C ATOM 1280 OE1 GLU A 79 26.746 -26.824 7.251 1.00 0.00 O ATOM 1281 OE2 GLU A 79 24.581 -26.567 7.527 1.00 0.00 O ATOM 0 H GLU A 79 26.897 -22.329 3.881 1.00 0.00 H new ATOM 0 HA GLU A 79 27.772 -23.041 6.621 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.775 -24.177 4.811 1.00 0.00 H new ATOM 0 HB3 GLU A 79 26.990 -25.366 5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 79 26.405 -24.141 7.676 1.00 0.00 H new ATOM 0 HG3 GLU A 79 24.850 -24.200 6.870 1.00 0.00 H new ATOM 1288 N ARG A 80 29.929 -23.935 5.828 1.00 0.00 N ATOM 1289 CA ARG A 80 31.232 -24.418 5.388 1.00 0.00 C ATOM 1290 C ARG A 80 31.128 -25.837 4.837 1.00 0.00 C ATOM 1291 O ARG A 80 30.750 -26.766 5.553 1.00 0.00 O ATOM 1292 CB ARG A 80 32.231 -24.380 6.545 1.00 0.00 C ATOM 1293 CG ARG A 80 33.682 -24.474 6.101 1.00 0.00 C ATOM 1294 CD ARG A 80 34.492 -23.283 6.586 1.00 0.00 C ATOM 1295 NE ARG A 80 35.719 -23.104 5.815 1.00 0.00 N ATOM 1296 CZ ARG A 80 36.813 -23.836 5.994 1.00 0.00 C ATOM 1297 NH1 ARG A 80 36.832 -24.791 6.913 1.00 0.00 N ATOM 1298 NH2 ARG A 80 37.891 -23.613 5.252 1.00 0.00 N ATOM 0 H ARG A 80 29.888 -23.669 6.812 1.00 0.00 H new ATOM 0 HA ARG A 80 31.585 -23.763 4.592 1.00 0.00 H new ATOM 0 HB2 ARG A 80 32.090 -23.455 7.105 1.00 0.00 H new ATOM 0 HB3 ARG A 80 32.015 -25.202 7.228 1.00 0.00 H new ATOM 0 HG2 ARG A 80 34.122 -25.395 6.484 1.00 0.00 H new ATOM 0 HG3 ARG A 80 33.728 -24.528 5.013 1.00 0.00 H new ATOM 0 HD2 ARG A 80 33.886 -22.380 6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 80 34.742 -23.419 7.638 1.00 0.00 H new ATOM 0 HE ARG A 80 35.737 -22.377 5.100 1.00 0.00 H new ATOM 0 HH11 ARG A 80 36.005 -24.965 7.485 1.00 0.00 H new ATOM 0 HH12 ARG A 80 37.673 -25.352 7.049 1.00 0.00 H new ATOM 0 HH21 ARG A 80 37.880 -22.879 4.544 1.00 0.00 H new ATOM 0 HH22 ARG A 80 38.731 -24.176 5.390 1.00 0.00 H new ATOM 1312 N VAL A 81 31.465 -25.998 3.562 1.00 0.00 N ATOM 1313 CA VAL A 81 31.411 -27.304 2.915 1.00 0.00 C ATOM 1314 C VAL A 81 32.810 -27.820 2.601 1.00 0.00 C ATOM 1315 O VAL A 81 33.705 -27.048 2.256 1.00 0.00 O ATOM 1316 CB VAL A 81 30.590 -27.252 1.613 1.00 0.00 C ATOM 1317 CG1 VAL A 81 30.455 -28.642 1.011 1.00 0.00 C ATOM 1318 CG2 VAL A 81 29.222 -26.638 1.870 1.00 0.00 C ATOM 0 H VAL A 81 31.779 -25.240 2.956 1.00 0.00 H new ATOM 0 HA VAL A 81 30.925 -27.984 3.615 1.00 0.00 H new ATOM 0 HB VAL A 81 31.117 -26.622 0.897 1.00 0.00 H new ATOM 0 HG11 VAL A 81 29.872 -28.585 0.092 1.00 0.00 H new ATOM 0 HG12 VAL A 81 31.445 -29.040 0.789 1.00 0.00 H new ATOM 0 HG13 VAL A 81 29.951 -29.298 1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 81 28.655 -26.609 0.939 1.00 0.00 H new ATOM 0 HG22 VAL A 81 28.685 -27.240 2.603 1.00 0.00 H new ATOM 0 HG23 VAL A 81 29.344 -25.624 2.252 1.00 0.00 H new ATOM 1328 N ASP A 82 32.992 -29.131 2.721 1.00 0.00 N ATOM 1329 CA ASP A 82 34.283 -29.752 2.448 1.00 0.00 C ATOM 1330 C ASP A 82 34.305 -30.369 1.054 1.00 0.00 C ATOM 1331 O ASP A 82 34.884 -31.435 0.845 1.00 0.00 O ATOM 1332 CB ASP A 82 34.591 -30.821 3.498 1.00 0.00 C ATOM 1333 CG ASP A 82 35.910 -30.577 4.204 1.00 0.00 C ATOM 1334 OD1 ASP A 82 36.874 -30.156 3.530 1.00 0.00 O ATOM 1335 OD2 ASP A 82 35.979 -30.807 5.430 1.00 0.00 O ATOM 0 H ASP A 82 32.262 -29.784 3.005 1.00 0.00 H new ATOM 0 HA ASP A 82 35.048 -28.977 2.495 1.00 0.00 H new ATOM 0 HB2 ASP A 82 33.787 -30.845 4.234 1.00 0.00 H new ATOM 0 HB3 ASP A 82 34.614 -31.800 3.019 1.00 0.00 H new ATOM 1340 N ARG A 83 33.671 -29.691 0.102 1.00 0.00 N ATOM 1341 CA ARG A 83 33.616 -30.174 -1.272 1.00 0.00 C ATOM 1342 C ARG A 83 34.350 -29.223 -2.213 1.00 0.00 C ATOM 1343 O ARG A 83 35.038 -28.303 -1.769 1.00 0.00 O ATOM 1344 CB ARG A 83 32.162 -30.332 -1.722 1.00 0.00 C ATOM 1345 CG ARG A 83 31.686 -31.776 -1.748 1.00 0.00 C ATOM 1346 CD ARG A 83 30.169 -31.863 -1.696 1.00 0.00 C ATOM 1347 NE ARG A 83 29.650 -32.902 -2.582 1.00 0.00 N ATOM 1348 CZ ARG A 83 28.354 -33.121 -2.777 1.00 0.00 C ATOM 1349 NH1 ARG A 83 27.451 -32.377 -2.153 1.00 0.00 N ATOM 1350 NH2 ARG A 83 27.960 -34.086 -3.598 1.00 0.00 N ATOM 0 H ARG A 83 33.189 -28.806 0.258 1.00 0.00 H new ATOM 0 HA ARG A 83 34.108 -31.146 -1.309 1.00 0.00 H new ATOM 0 HB2 ARG A 83 31.519 -29.758 -1.054 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.050 -29.903 -2.718 1.00 0.00 H new ATOM 0 HG2 ARG A 83 32.049 -32.264 -2.653 1.00 0.00 H new ATOM 0 HG3 ARG A 83 32.112 -32.316 -0.902 1.00 0.00 H new ATOM 0 HD2 ARG A 83 29.852 -32.067 -0.673 1.00 0.00 H new ATOM 0 HD3 ARG A 83 29.741 -30.901 -1.976 1.00 0.00 H new ATOM 0 HE ARG A 83 30.319 -33.491 -3.078 1.00 0.00 H new ATOM 0 HH11 ARG A 83 27.751 -31.634 -1.521 1.00 0.00 H new ATOM 0 HH12 ARG A 83 26.457 -32.547 -2.305 1.00 0.00 H new ATOM 0 HH21 ARG A 83 28.652 -34.660 -4.080 1.00 0.00 H new ATOM 0 HH22 ARG A 83 26.965 -34.254 -3.747 1.00 0.00 H new ATOM 1364 N ARG A 84 34.199 -29.451 -3.513 1.00 0.00 N ATOM 1365 CA ARG A 84 34.849 -28.615 -4.516 1.00 0.00 C ATOM 1366 C ARG A 84 33.866 -27.606 -5.102 1.00 0.00 C ATOM 1367 O ARG A 84 32.868 -27.982 -5.719 1.00 0.00 O ATOM 1368 CB ARG A 84 35.433 -29.483 -5.633 1.00 0.00 C ATOM 1369 CG ARG A 84 35.969 -28.682 -6.808 1.00 0.00 C ATOM 1370 CD ARG A 84 37.415 -28.268 -6.586 1.00 0.00 C ATOM 1371 NE ARG A 84 38.267 -28.626 -7.717 1.00 0.00 N ATOM 1372 CZ ARG A 84 39.581 -28.430 -7.739 1.00 0.00 C ATOM 1373 NH1 ARG A 84 40.190 -27.881 -6.696 1.00 0.00 N ATOM 1374 NH2 ARG A 84 40.288 -28.782 -8.805 1.00 0.00 N ATOM 0 H ARG A 84 33.633 -30.207 -3.897 1.00 0.00 H new ATOM 0 HA ARG A 84 35.657 -28.069 -4.030 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.237 -30.095 -5.224 1.00 0.00 H new ATOM 0 HB3 ARG A 84 34.663 -30.167 -5.991 1.00 0.00 H new ATOM 0 HG2 ARG A 84 35.895 -29.276 -7.719 1.00 0.00 H new ATOM 0 HG3 ARG A 84 35.354 -27.794 -6.956 1.00 0.00 H new ATOM 0 HD2 ARG A 84 37.463 -27.191 -6.423 1.00 0.00 H new ATOM 0 HD3 ARG A 84 37.794 -28.745 -5.682 1.00 0.00 H new ATOM 0 HE ARG A 84 37.829 -29.050 -8.535 1.00 0.00 H new ATOM 0 HH11 ARG A 84 39.649 -27.608 -5.875 1.00 0.00 H new ATOM 0 HH12 ARG A 84 41.199 -27.731 -6.715 1.00 0.00 H new ATOM 0 HH21 ARG A 84 39.823 -29.204 -9.609 1.00 0.00 H new ATOM 0 HH22 ARG A 84 41.297 -28.631 -8.821 1.00 0.00 H new ATOM 1388 N LEU A 85 34.154 -26.325 -4.906 1.00 0.00 N ATOM 1389 CA LEU A 85 33.295 -25.261 -5.415 1.00 0.00 C ATOM 1390 C LEU A 85 31.828 -25.560 -5.126 1.00 0.00 C ATOM 1391 O LEU A 85 30.962 -25.355 -5.976 1.00 0.00 O ATOM 1392 CB LEU A 85 33.505 -25.085 -6.920 1.00 0.00 C ATOM 1393 CG LEU A 85 34.653 -24.164 -7.334 1.00 0.00 C ATOM 1394 CD1 LEU A 85 34.232 -22.706 -7.228 1.00 0.00 C ATOM 1395 CD2 LEU A 85 35.885 -24.429 -6.481 1.00 0.00 C ATOM 0 H LEU A 85 34.976 -25.997 -4.398 1.00 0.00 H new ATOM 0 HA LEU A 85 33.565 -24.336 -4.906 1.00 0.00 H new ATOM 0 HB2 LEU A 85 33.677 -26.067 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 85 32.582 -24.699 -7.353 1.00 0.00 H new ATOM 0 HG LEU A 85 34.905 -24.374 -8.374 1.00 0.00 H new ATOM 0 HD11 LEU A 85 35.062 -22.065 -7.527 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.380 -22.525 -7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 85 33.953 -22.482 -6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 85 36.692 -23.764 -6.790 1.00 0.00 H new ATOM 0 HD22 LEU A 85 35.647 -24.248 -5.433 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.200 -25.465 -6.608 1.00 0.00 H new ATOM 1407 N VAL A 86 31.555 -26.045 -3.918 1.00 0.00 N ATOM 1408 CA VAL A 86 30.191 -26.369 -3.515 1.00 0.00 C ATOM 1409 C VAL A 86 29.848 -25.730 -2.174 1.00 0.00 C ATOM 1410 O VAL A 86 30.413 -26.088 -1.141 1.00 0.00 O ATOM 1411 CB VAL A 86 29.983 -27.892 -3.414 1.00 0.00 C ATOM 1412 CG1 VAL A 86 28.662 -28.206 -2.729 1.00 0.00 C ATOM 1413 CG2 VAL A 86 30.043 -28.530 -4.793 1.00 0.00 C ATOM 0 H VAL A 86 32.260 -26.222 -3.202 1.00 0.00 H new ATOM 0 HA VAL A 86 29.530 -25.970 -4.284 1.00 0.00 H new ATOM 0 HB VAL A 86 30.787 -28.312 -2.809 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.532 -29.286 -2.667 1.00 0.00 H new ATOM 0 HG12 VAL A 86 28.663 -27.782 -1.725 1.00 0.00 H new ATOM 0 HG13 VAL A 86 27.842 -27.775 -3.304 1.00 0.00 H new ATOM 0 HG21 VAL A 86 29.894 -29.606 -4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 86 29.261 -28.107 -5.424 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.017 -28.335 -5.242 1.00 0.00 H new ATOM 1423 N TYR A 87 28.918 -24.782 -2.198 1.00 0.00 N ATOM 1424 CA TYR A 87 28.500 -24.090 -0.984 1.00 0.00 C ATOM 1425 C TYR A 87 27.056 -24.434 -0.631 1.00 0.00 C ATOM 1426 O TYR A 87 26.333 -25.026 -1.432 1.00 0.00 O ATOM 1427 CB TYR A 87 28.649 -22.578 -1.157 1.00 0.00 C ATOM 1428 CG TYR A 87 30.060 -22.140 -1.479 1.00 0.00 C ATOM 1429 CD1 TYR A 87 30.649 -22.466 -2.694 1.00 0.00 C ATOM 1430 CD2 TYR A 87 30.803 -21.400 -0.568 1.00 0.00 C ATOM 1431 CE1 TYR A 87 31.938 -22.069 -2.992 1.00 0.00 C ATOM 1432 CE2 TYR A 87 32.093 -20.998 -0.858 1.00 0.00 C ATOM 1433 CZ TYR A 87 32.656 -21.335 -2.071 1.00 0.00 C ATOM 1434 OH TYR A 87 33.940 -20.937 -2.364 1.00 0.00 O ATOM 0 H TYR A 87 28.439 -24.475 -3.045 1.00 0.00 H new ATOM 0 HA TYR A 87 29.143 -24.420 -0.168 1.00 0.00 H new ATOM 0 HB2 TYR A 87 27.984 -22.245 -1.954 1.00 0.00 H new ATOM 0 HB3 TYR A 87 28.324 -22.083 -0.242 1.00 0.00 H new ATOM 0 HD1 TYR A 87 30.090 -23.040 -3.418 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.365 -21.134 0.383 1.00 0.00 H new ATOM 0 HE1 TYR A 87 32.381 -22.332 -3.941 1.00 0.00 H new ATOM 0 HE2 TYR A 87 32.657 -20.423 -0.139 1.00 0.00 H new ATOM 0 HH TYR A 87 34.305 -20.428 -1.610 1.00 0.00 H new ATOM 1444 N LYS A 88 26.643 -24.057 0.574 1.00 0.00 N ATOM 1445 CA LYS A 88 25.286 -24.322 1.036 1.00 0.00 C ATOM 1446 C LYS A 88 24.799 -23.211 1.960 1.00 0.00 C ATOM 1447 O LYS A 88 25.509 -22.796 2.876 1.00 0.00 O ATOM 1448 CB LYS A 88 25.226 -25.668 1.762 1.00 0.00 C ATOM 1449 CG LYS A 88 23.887 -25.941 2.426 1.00 0.00 C ATOM 1450 CD LYS A 88 24.047 -26.796 3.672 1.00 0.00 C ATOM 1451 CE LYS A 88 22.853 -27.716 3.874 1.00 0.00 C ATOM 1452 NZ LYS A 88 22.483 -27.838 5.311 1.00 0.00 N ATOM 0 H LYS A 88 27.229 -23.566 1.249 1.00 0.00 H new ATOM 0 HA LYS A 88 24.633 -24.357 0.164 1.00 0.00 H new ATOM 0 HB2 LYS A 88 25.438 -26.465 1.050 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.010 -25.699 2.518 1.00 0.00 H new ATOM 0 HG2 LYS A 88 23.412 -24.996 2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 88 23.226 -26.444 1.721 1.00 0.00 H new ATOM 0 HD2 LYS A 88 24.957 -27.391 3.592 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.163 -26.152 4.544 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.001 -27.334 3.311 1.00 0.00 H new ATOM 0 HE3 LYS A 88 23.083 -28.703 3.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 22.258 -28.830 5.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 23.280 -27.526 5.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 21.652 -27.244 5.507 1.00 0.00 H new ATOM 1466 N PHE A 89 23.583 -22.734 1.715 1.00 0.00 N ATOM 1467 CA PHE A 89 23.001 -21.671 2.526 1.00 0.00 C ATOM 1468 C PHE A 89 22.634 -22.186 3.915 1.00 0.00 C ATOM 1469 O PHE A 89 21.973 -23.214 4.054 1.00 0.00 O ATOM 1470 CB PHE A 89 21.760 -21.097 1.839 1.00 0.00 C ATOM 1471 CG PHE A 89 22.054 -20.444 0.519 1.00 0.00 C ATOM 1472 CD1 PHE A 89 22.604 -19.173 0.467 1.00 0.00 C ATOM 1473 CD2 PHE A 89 21.781 -21.100 -0.671 1.00 0.00 C ATOM 1474 CE1 PHE A 89 22.875 -18.569 -0.746 1.00 0.00 C ATOM 1475 CE2 PHE A 89 22.051 -20.502 -1.887 1.00 0.00 C ATOM 1476 CZ PHE A 89 22.599 -19.235 -1.925 1.00 0.00 C ATOM 0 H PHE A 89 22.982 -23.067 0.961 1.00 0.00 H new ATOM 0 HA PHE A 89 23.745 -20.882 2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.036 -21.897 1.686 1.00 0.00 H new ATOM 0 HB3 PHE A 89 21.293 -20.367 2.500 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.823 -18.648 1.385 1.00 0.00 H new ATOM 0 HD2 PHE A 89 21.352 -22.091 -0.648 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.302 -17.577 -0.773 1.00 0.00 H new ATOM 0 HE2 PHE A 89 21.834 -21.025 -2.807 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.811 -18.766 -2.874 1.00 0.00 H new ATOM 1486 N GLY A 90 23.070 -21.462 4.942 1.00 0.00 N ATOM 1487 CA GLY A 90 22.780 -21.860 6.307 1.00 0.00 C ATOM 1488 C GLY A 90 21.345 -21.573 6.701 1.00 0.00 C ATOM 1489 O GLY A 90 20.453 -21.543 5.853 1.00 0.00 O ATOM 0 H GLY A 90 23.619 -20.607 4.853 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.979 -22.926 6.422 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.452 -21.335 6.986 1.00 0.00 H new ATOM 1493 N LYS A 91 21.119 -21.363 7.994 1.00 0.00 N ATOM 1494 CA LYS A 91 19.783 -21.077 8.501 1.00 0.00 C ATOM 1495 C LYS A 91 19.540 -19.573 8.578 1.00 0.00 C ATOM 1496 O LYS A 91 18.400 -19.124 8.689 1.00 0.00 O ATOM 1497 CB LYS A 91 19.594 -21.706 9.883 1.00 0.00 C ATOM 1498 CG LYS A 91 20.312 -20.960 10.995 1.00 0.00 C ATOM 1499 CD LYS A 91 21.048 -21.913 11.921 1.00 0.00 C ATOM 1500 CE LYS A 91 21.134 -21.360 13.336 1.00 0.00 C ATOM 1501 NZ LYS A 91 22.121 -20.250 13.438 1.00 0.00 N ATOM 0 H LYS A 91 21.845 -21.386 8.710 1.00 0.00 H new ATOM 0 HA LYS A 91 19.060 -21.509 7.810 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.529 -21.746 10.112 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.953 -22.735 9.857 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.020 -20.253 10.562 1.00 0.00 H new ATOM 0 HG3 LYS A 91 19.591 -20.378 11.569 1.00 0.00 H new ATOM 0 HD2 LYS A 91 20.536 -22.875 11.936 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.052 -22.092 11.537 1.00 0.00 H new ATOM 0 HE2 LYS A 91 20.152 -21.003 13.647 1.00 0.00 H new ATOM 0 HE3 LYS A 91 21.414 -22.159 14.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.150 -19.900 14.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 23.063 -20.597 13.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.840 -19.476 12.802 1.00 0.00 H new ATOM 1515 N ASN A 92 20.620 -18.800 8.518 1.00 0.00 N ATOM 1516 CA ASN A 92 20.523 -17.346 8.580 1.00 0.00 C ATOM 1517 C ASN A 92 19.890 -16.788 7.309 1.00 0.00 C ATOM 1518 O ASN A 92 19.296 -15.711 7.321 1.00 0.00 O ATOM 1519 CB ASN A 92 21.909 -16.731 8.786 1.00 0.00 C ATOM 1520 CG ASN A 92 22.247 -16.546 10.252 1.00 0.00 C ATOM 1521 OD1 ASN A 92 22.392 -15.421 10.731 1.00 0.00 O ATOM 1522 ND2 ASN A 92 22.376 -17.653 10.974 1.00 0.00 N ATOM 0 H ASN A 92 21.571 -19.156 8.427 1.00 0.00 H new ATOM 0 HA ASN A 92 19.887 -17.084 9.426 1.00 0.00 H new ATOM 0 HB2 ASN A 92 22.660 -17.370 8.321 1.00 0.00 H new ATOM 0 HB3 ASN A 92 21.954 -15.766 8.281 1.00 0.00 H new ATOM 0 HD21 ASN A 92 22.604 -17.591 11.966 1.00 0.00 H new ATOM 0 HD22 ASN A 92 22.247 -18.565 10.536 1.00 0.00 H new ATOM 1529 N ALA A 93 20.023 -17.529 6.214 1.00 0.00 N ATOM 1530 CA ALA A 93 19.462 -17.111 4.935 1.00 0.00 C ATOM 1531 C ALA A 93 17.998 -17.519 4.818 1.00 0.00 C ATOM 1532 O ALA A 93 17.629 -18.647 5.148 1.00 0.00 O ATOM 1533 CB ALA A 93 20.269 -17.698 3.787 1.00 0.00 C ATOM 0 H ALA A 93 20.515 -18.422 6.187 1.00 0.00 H new ATOM 0 HA ALA A 93 19.514 -16.024 4.882 1.00 0.00 H new ATOM 0 HB1 ALA A 93 19.838 -17.377 2.838 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.300 -17.352 3.853 1.00 0.00 H new ATOM 0 HB3 ALA A 93 20.247 -18.786 3.846 1.00 0.00 H new ATOM 1539 N HIS A 94 17.166 -16.595 4.346 1.00 0.00 N ATOM 1540 CA HIS A 94 15.741 -16.860 4.186 1.00 0.00 C ATOM 1541 C HIS A 94 15.306 -16.635 2.741 1.00 0.00 C ATOM 1542 O HIS A 94 15.789 -15.722 2.072 1.00 0.00 O ATOM 1543 CB HIS A 94 14.926 -15.966 5.121 1.00 0.00 C ATOM 1544 CG HIS A 94 15.290 -14.516 5.031 1.00 0.00 C ATOM 1545 ND1 HIS A 94 14.822 -13.683 4.037 1.00 0.00 N ATOM 1546 CD2 HIS A 94 16.081 -13.751 5.820 1.00 0.00 C ATOM 1547 CE1 HIS A 94 15.311 -12.468 4.218 1.00 0.00 C ATOM 1548 NE2 HIS A 94 16.077 -12.483 5.293 1.00 0.00 N ATOM 0 H HIS A 94 17.454 -15.657 4.068 1.00 0.00 H new ATOM 0 HA HIS A 94 15.559 -17.903 4.444 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.867 -16.081 4.889 1.00 0.00 H new ATOM 0 HB3 HIS A 94 15.066 -16.304 6.148 1.00 0.00 H new ATOM 0 HD2 HIS A 94 16.615 -14.077 6.700 1.00 0.00 H new ATOM 0 HE1 HIS A 94 15.117 -11.609 3.593 1.00 0.00 H new ATOM 0 HE2 HIS A 94 16.584 -11.682 5.671 1.00 0.00 H new ATOM 1556 N GLY A 95 14.390 -17.474 2.266 1.00 0.00 N ATOM 1557 CA GLY A 95 13.907 -17.350 0.903 1.00 0.00 C ATOM 1558 C GLY A 95 14.065 -18.633 0.113 1.00 0.00 C ATOM 1559 O GLY A 95 13.186 -19.003 -0.666 1.00 0.00 O ATOM 0 H GLY A 95 13.974 -18.237 2.800 1.00 0.00 H new ATOM 0 HA2 GLY A 95 12.855 -17.064 0.918 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.448 -16.549 0.400 1.00 0.00 H new ATOM 1563 N TRP A 96 15.187 -19.314 0.312 1.00 0.00 N ATOM 1564 CA TRP A 96 15.458 -20.564 -0.391 1.00 0.00 C ATOM 1565 C TRP A 96 14.777 -21.737 0.305 1.00 0.00 C ATOM 1566 O TRP A 96 14.193 -22.601 -0.348 1.00 0.00 O ATOM 1567 CB TRP A 96 16.966 -20.809 -0.475 1.00 0.00 C ATOM 1568 CG TRP A 96 17.578 -21.198 0.837 1.00 0.00 C ATOM 1569 CD1 TRP A 96 18.194 -20.371 1.731 1.00 0.00 C ATOM 1570 CD2 TRP A 96 17.634 -22.514 1.400 1.00 0.00 C ATOM 1571 NE1 TRP A 96 18.631 -21.092 2.816 1.00 0.00 N ATOM 1572 CE2 TRP A 96 18.298 -22.409 2.638 1.00 0.00 C ATOM 1573 CE3 TRP A 96 17.186 -23.769 0.980 1.00 0.00 C ATOM 1574 CZ2 TRP A 96 18.525 -23.512 3.456 1.00 0.00 C ATOM 1575 CZ3 TRP A 96 17.412 -24.863 1.793 1.00 0.00 C ATOM 1576 CH2 TRP A 96 18.076 -24.729 3.020 1.00 0.00 C ATOM 0 H TRP A 96 15.924 -19.023 0.954 1.00 0.00 H new ATOM 0 HA TRP A 96 15.055 -20.480 -1.400 1.00 0.00 H new ATOM 0 HB2 TRP A 96 17.159 -21.595 -1.205 1.00 0.00 H new ATOM 0 HB3 TRP A 96 17.454 -19.906 -0.842 1.00 0.00 H new ATOM 0 HD1 TRP A 96 18.320 -19.306 1.604 1.00 0.00 H new ATOM 0 HE1 TRP A 96 19.123 -20.709 3.623 1.00 0.00 H new ATOM 0 HE3 TRP A 96 16.672 -23.882 0.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 19.037 -23.411 4.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 17.071 -25.838 1.478 1.00 0.00 H new ATOM 0 HH2 TRP A 96 18.236 -25.603 3.633 1.00 0.00 H new ATOM 1587 N GLN A 97 14.858 -21.761 1.631 1.00 0.00 N ATOM 1588 CA GLN A 97 14.249 -22.830 2.414 1.00 0.00 C ATOM 1589 C GLN A 97 12.813 -23.082 1.966 1.00 0.00 C ATOM 1590 O GLN A 97 12.213 -22.256 1.280 1.00 0.00 O ATOM 1591 CB GLN A 97 14.277 -22.481 3.903 1.00 0.00 C ATOM 1592 CG GLN A 97 15.300 -23.279 4.695 1.00 0.00 C ATOM 1593 CD GLN A 97 15.791 -22.540 5.925 1.00 0.00 C ATOM 1594 OE1 GLN A 97 15.323 -22.783 7.037 1.00 0.00 O ATOM 1595 NE2 GLN A 97 16.741 -21.633 5.730 1.00 0.00 N ATOM 0 H GLN A 97 15.339 -21.053 2.186 1.00 0.00 H new ATOM 0 HA GLN A 97 14.827 -23.740 2.251 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.492 -21.418 4.015 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.287 -22.652 4.327 1.00 0.00 H new ATOM 0 HG2 GLN A 97 14.859 -24.229 4.998 1.00 0.00 H new ATOM 0 HG3 GLN A 97 16.149 -23.513 4.053 1.00 0.00 H new ATOM 0 HE21 GLN A 97 17.100 -21.464 4.790 1.00 0.00 H new ATOM 0 HE22 GLN A 97 17.112 -21.105 6.520 1.00 0.00 H new