USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 943 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 105 ASN : amide:sc= -0.278 X(o=-4.8,f=-4.8) USER MOD Set 1.2: A 106 ASN : amide:sc= -4.53! C(o=-4.8!,f=-5.2!) USER MOD Set 2.1: A 8 LYS NZ :NH3+ 179:sc= -0.319 (180deg=-0.322) USER MOD Set 2.2: A 35 THR OG1 : rot -170:sc= 0 USER MOD Set 2.3: A 50 ASN : amide:sc= -3.93! C(o=-4.2!,f=-6.3!) USER MOD Single : A 15 GLN : amide:sc=-0.00271 X(o=-0.0027,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.256 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc=-0.00947 X(o=-0.0095,f=0) USER MOD Single : A 28 GLN : amide:sc= -1.31 X(o=-1.3,f=-1.3) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -1.25 K(o=-1.3,f=-3.9!) USER MOD Single : A 42 GLN : amide:sc= -1.16 K(o=-1.2,f=-10!) USER MOD Single : A 44 MET CE :methyl 145:sc= -0.222 (180deg=-0.52) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 MET CE :methyl 163:sc= -10.4! (180deg=-13.2!) USER MOD Single : A 49 GLN : amide:sc= -0.0878 X(o=-0.088,f=-0.36) USER MOD Single : A 52 HIS : no HE2:sc= -6.73! C(o=-6.7!,f=-6.7!) USER MOD Single : A 53 HIS : no HD1:sc= -0.0643 K(o=-0.064,f=-2.6) USER MOD Single : A 57 SER OG : rot 88:sc= -0.0919! USER MOD Single : A 60 ASN : amide:sc= 0.926 K(o=0.93,f=-0.75) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 MET CE :methyl -169:sc= -0.0237 (180deg=-0.194) USER MOD Single : A 71 GLN : amide:sc= -0.0237 X(o=-0.024,f=-0.11) USER MOD Single : A 76 ASN : amide:sc= -0.376 K(o=-0.38,f=-3.1!) USER MOD Single : A 79 THR OG1 : rot 150:sc= -0.956 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.593! USER MOD Single : A 90 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.1) USER MOD Single : A 97 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.0029) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.119 USER MOD Single : A 116 LYS NZ :NH3+ 146:sc= -0.191 (180deg=-1) USER MOD Single : A 117 MET CE :methyl -110:sc= -0.228 (180deg=-2.41!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 95 N ILE A 7 -2.760 -9.475 -10.141 1.00 0.00 N ATOM 96 CA ILE A 7 -2.684 -8.111 -9.645 1.00 0.00 C ATOM 97 C ILE A 7 -3.851 -7.855 -8.689 1.00 0.00 C ATOM 98 O ILE A 7 -4.999 -8.155 -9.010 1.00 0.00 O ATOM 99 CB ILE A 7 -2.615 -7.121 -10.810 1.00 0.00 C ATOM 100 CG1 ILE A 7 -1.515 -7.513 -11.798 1.00 0.00 C ATOM 101 CG2 ILE A 7 -2.444 -5.688 -10.301 1.00 0.00 C ATOM 102 CD1 ILE A 7 -2.114 -8.022 -13.112 1.00 0.00 C ATOM 0 HA ILE A 7 -1.766 -7.963 -9.076 1.00 0.00 H new ATOM 0 HB ILE A 7 -3.561 -7.161 -11.349 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -0.875 -6.653 -11.995 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.885 -8.286 -11.358 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -2.398 -5.004 -11.148 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -3.290 -5.424 -9.667 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -1.522 -5.614 -9.724 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.311 -8.294 -13.797 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -2.734 -8.896 -12.915 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -2.724 -7.238 -13.561 1.00 0.00 H new ATOM 114 N LYS A 8 -3.515 -7.302 -7.533 1.00 0.00 N ATOM 115 CA LYS A 8 -4.520 -7.003 -6.527 1.00 0.00 C ATOM 116 C LYS A 8 -4.065 -5.800 -5.700 1.00 0.00 C ATOM 117 O LYS A 8 -2.892 -5.694 -5.346 1.00 0.00 O ATOM 118 CB LYS A 8 -4.827 -8.245 -5.688 1.00 0.00 C ATOM 119 CG LYS A 8 -6.241 -8.759 -5.966 1.00 0.00 C ATOM 120 CD LYS A 8 -7.293 -7.818 -5.377 1.00 0.00 C ATOM 121 CE LYS A 8 -7.219 -7.801 -3.849 1.00 0.00 C ATOM 122 NZ LYS A 8 -8.447 -8.383 -3.264 1.00 0.00 N ATOM 0 H LYS A 8 -2.561 -7.053 -7.271 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.462 -6.727 -7.001 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.101 -9.027 -5.911 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -4.724 -8.007 -4.629 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.393 -8.852 -7.041 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.360 -9.755 -5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.142 -6.810 -5.763 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.287 -8.134 -5.693 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -6.348 -8.364 -3.515 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.091 -6.777 -3.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.373 -8.379 -2.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.271 -7.819 -3.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.562 -9.361 -3.599 1.00 0.00 H new ATOM 136 N VAL A 9 -5.016 -4.924 -5.414 1.00 0.00 N ATOM 137 CA VAL A 9 -4.728 -3.731 -4.634 1.00 0.00 C ATOM 138 C VAL A 9 -5.661 -3.682 -3.422 1.00 0.00 C ATOM 139 O VAL A 9 -6.867 -3.880 -3.555 1.00 0.00 O ATOM 140 CB VAL A 9 -4.832 -2.489 -5.521 1.00 0.00 C ATOM 141 CG1 VAL A 9 -3.447 -2.010 -5.958 1.00 0.00 C ATOM 142 CG2 VAL A 9 -5.730 -2.752 -6.731 1.00 0.00 C ATOM 0 H VAL A 9 -5.988 -5.016 -5.708 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.706 -3.758 -4.256 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.290 -1.694 -4.932 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.550 -1.126 -6.587 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.853 -1.762 -5.078 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.949 -2.800 -6.520 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.786 -1.853 -7.344 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.315 -3.569 -7.322 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.730 -3.022 -6.390 1.00 0.00 H new ATOM 152 N LEU A 10 -5.065 -3.416 -2.268 1.00 0.00 N ATOM 153 CA LEU A 10 -5.827 -3.337 -1.034 1.00 0.00 C ATOM 154 C LEU A 10 -5.806 -1.897 -0.517 1.00 0.00 C ATOM 155 O LEU A 10 -4.740 -1.344 -0.256 1.00 0.00 O ATOM 156 CB LEU A 10 -5.313 -4.362 -0.021 1.00 0.00 C ATOM 157 CG LEU A 10 -5.235 -3.889 1.432 1.00 0.00 C ATOM 158 CD1 LEU A 10 -3.995 -3.023 1.661 1.00 0.00 C ATOM 159 CD2 LEU A 10 -6.521 -3.168 1.842 1.00 0.00 C ATOM 0 H LEU A 10 -4.064 -3.253 -2.162 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.871 -3.596 -1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.959 -5.239 -0.062 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.319 -4.683 -0.332 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.138 -4.766 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.964 -2.700 2.702 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.100 -3.602 1.434 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.037 -2.149 1.011 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.440 -2.842 2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.673 -2.301 1.199 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -7.367 -3.847 1.740 1.00 0.00 H new ATOM 171 N ILE A 11 -6.997 -1.334 -0.385 1.00 0.00 N ATOM 172 CA ILE A 11 -7.129 0.032 0.096 1.00 0.00 C ATOM 173 C ILE A 11 -7.875 0.027 1.432 1.00 0.00 C ATOM 174 O ILE A 11 -9.101 0.119 1.463 1.00 0.00 O ATOM 175 CB ILE A 11 -7.781 0.915 -0.969 1.00 0.00 C ATOM 176 CG1 ILE A 11 -9.107 0.317 -1.441 1.00 0.00 C ATOM 177 CG2 ILE A 11 -6.820 1.169 -2.133 1.00 0.00 C ATOM 178 CD1 ILE A 11 -8.880 -0.727 -2.536 1.00 0.00 C ATOM 0 H ILE A 11 -7.879 -1.797 -0.602 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.147 0.468 0.280 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.006 1.882 -0.520 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.623 -0.142 -0.598 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -9.754 1.110 -1.818 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.308 1.799 -2.877 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.925 1.670 -1.763 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.542 0.219 -2.589 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -9.839 -1.136 -2.853 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.385 -0.260 -3.387 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.253 -1.530 -2.149 1.00 0.00 H new ATOM 190 N VAL A 12 -7.104 -0.080 2.505 1.00 0.00 N ATOM 191 CA VAL A 12 -7.677 -0.097 3.840 1.00 0.00 C ATOM 192 C VAL A 12 -7.032 1.005 4.681 1.00 0.00 C ATOM 193 O VAL A 12 -5.821 1.212 4.617 1.00 0.00 O ATOM 194 CB VAL A 12 -7.523 -1.489 4.457 1.00 0.00 C ATOM 195 CG1 VAL A 12 -6.086 -1.724 4.927 1.00 0.00 C ATOM 196 CG2 VAL A 12 -8.515 -1.693 5.604 1.00 0.00 C ATOM 0 H VAL A 12 -6.087 -0.156 2.476 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.746 0.110 3.800 1.00 0.00 H new ATOM 0 HB VAL A 12 -7.748 -2.225 3.685 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.004 -2.720 5.361 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -5.407 -1.641 4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.822 -0.978 5.677 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.385 -2.690 6.025 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -8.335 -0.946 6.377 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.533 -1.588 5.228 1.00 0.00 H new ATOM 206 N ASP A 13 -7.869 1.685 5.452 1.00 0.00 N ATOM 207 CA ASP A 13 -7.395 2.760 6.305 1.00 0.00 C ATOM 208 C ASP A 13 -8.242 2.807 7.578 1.00 0.00 C ATOM 209 O ASP A 13 -9.247 2.105 7.686 1.00 0.00 O ATOM 210 CB ASP A 13 -7.520 4.115 5.605 1.00 0.00 C ATOM 211 CG ASP A 13 -6.956 4.162 4.183 1.00 0.00 C ATOM 212 OD1 ASP A 13 -7.285 3.236 3.411 1.00 0.00 O ATOM 213 OD2 ASP A 13 -6.210 5.124 3.901 1.00 0.00 O ATOM 0 H ASP A 13 -8.873 1.511 5.503 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.347 2.569 6.537 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.573 4.394 5.572 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -7.010 4.867 6.207 1.00 0.00 H new ATOM 218 N ASP A 14 -7.805 3.639 8.512 1.00 0.00 N ATOM 219 CA ASP A 14 -8.510 3.786 9.773 1.00 0.00 C ATOM 220 C ASP A 14 -9.728 4.690 9.570 1.00 0.00 C ATOM 221 O ASP A 14 -10.634 4.713 10.402 1.00 0.00 O ATOM 222 CB ASP A 14 -7.615 4.430 10.833 1.00 0.00 C ATOM 223 CG ASP A 14 -7.862 3.953 12.266 1.00 0.00 C ATOM 224 OD1 ASP A 14 -9.014 4.108 12.725 1.00 0.00 O ATOM 225 OD2 ASP A 14 -6.893 3.445 12.870 1.00 0.00 O ATOM 0 H ASP A 14 -6.971 4.219 8.420 1.00 0.00 H new ATOM 0 HA ASP A 14 -8.810 2.793 10.109 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -6.574 4.234 10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -7.755 5.510 10.797 1.00 0.00 H new ATOM 230 N GLN A 15 -9.709 5.412 8.459 1.00 0.00 N ATOM 231 CA GLN A 15 -10.801 6.315 8.136 1.00 0.00 C ATOM 232 C GLN A 15 -11.113 6.257 6.638 1.00 0.00 C ATOM 233 O GLN A 15 -10.207 6.331 5.810 1.00 0.00 O ATOM 234 CB GLN A 15 -10.477 7.745 8.573 1.00 0.00 C ATOM 235 CG GLN A 15 -11.728 8.455 9.095 1.00 0.00 C ATOM 236 CD GLN A 15 -11.373 9.444 10.207 1.00 0.00 C ATOM 237 OE1 GLN A 15 -10.923 9.076 11.280 1.00 0.00 O ATOM 238 NE2 GLN A 15 -11.600 10.716 9.892 1.00 0.00 N ATOM 0 H GLN A 15 -8.956 5.390 7.772 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.686 5.994 8.685 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -9.713 7.727 9.351 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.063 8.301 7.732 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.219 8.983 8.277 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.438 7.719 9.471 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -11.978 10.955 8.975 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -11.396 11.453 10.567 1.00 0.00 H new ATOM 247 N VAL A 16 -12.396 6.125 6.338 1.00 0.00 N ATOM 248 CA VAL A 16 -12.838 6.056 4.956 1.00 0.00 C ATOM 249 C VAL A 16 -12.242 7.230 4.175 1.00 0.00 C ATOM 250 O VAL A 16 -11.634 7.035 3.124 1.00 0.00 O ATOM 251 CB VAL A 16 -14.366 6.013 4.896 1.00 0.00 C ATOM 252 CG1 VAL A 16 -14.876 4.571 4.916 1.00 0.00 C ATOM 253 CG2 VAL A 16 -14.982 6.828 6.036 1.00 0.00 C ATOM 0 H VAL A 16 -13.144 6.064 7.029 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.482 5.139 4.487 1.00 0.00 H new ATOM 0 HB VAL A 16 -14.677 6.465 3.954 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -15.965 4.570 4.872 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -14.478 4.032 4.056 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -14.549 4.082 5.834 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -16.069 6.781 5.971 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -14.658 6.418 6.993 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -14.658 7.866 5.958 1.00 0.00 H new ATOM 263 N THR A 17 -12.438 8.421 4.720 1.00 0.00 N ATOM 264 CA THR A 17 -11.928 9.626 4.088 1.00 0.00 C ATOM 265 C THR A 17 -10.527 9.380 3.524 1.00 0.00 C ATOM 266 O THR A 17 -10.271 9.646 2.350 1.00 0.00 O ATOM 267 CB THR A 17 -11.978 10.758 5.117 1.00 0.00 C ATOM 268 OG1 THR A 17 -11.101 10.324 6.154 1.00 0.00 O ATOM 269 CG2 THR A 17 -13.342 10.866 5.802 1.00 0.00 C ATOM 0 H THR A 17 -12.943 8.578 5.592 1.00 0.00 H new ATOM 0 HA THR A 17 -12.542 9.915 3.235 1.00 0.00 H new ATOM 0 HB THR A 17 -11.741 11.703 4.629 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.072 11.000 6.863 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.324 11.684 6.522 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.111 11.058 5.054 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.564 9.933 6.319 1.00 0.00 H new ATOM 277 N SER A 18 -9.657 8.875 4.386 1.00 0.00 N ATOM 278 CA SER A 18 -8.289 8.590 3.988 1.00 0.00 C ATOM 279 C SER A 18 -8.272 7.501 2.913 1.00 0.00 C ATOM 280 O SER A 18 -7.673 7.677 1.854 1.00 0.00 O ATOM 281 CB SER A 18 -7.443 8.162 5.190 1.00 0.00 C ATOM 282 OG SER A 18 -7.053 9.274 5.991 1.00 0.00 O ATOM 0 H SER A 18 -9.873 8.656 5.359 1.00 0.00 H new ATOM 0 HA SER A 18 -7.855 9.502 3.579 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.009 7.457 5.799 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.554 7.638 4.839 1.00 0.00 H new ATOM 0 HG SER A 18 -6.516 8.959 6.748 1.00 0.00 H new ATOM 288 N ARG A 19 -8.939 6.398 3.223 1.00 0.00 N ATOM 289 CA ARG A 19 -9.008 5.281 2.297 1.00 0.00 C ATOM 290 C ARG A 19 -9.767 5.687 1.031 1.00 0.00 C ATOM 291 O ARG A 19 -9.167 5.852 -0.030 1.00 0.00 O ATOM 292 CB ARG A 19 -9.705 4.077 2.936 1.00 0.00 C ATOM 293 CG ARG A 19 -9.543 2.826 2.070 1.00 0.00 C ATOM 294 CD ARG A 19 -10.852 2.477 1.361 1.00 0.00 C ATOM 295 NE ARG A 19 -11.949 2.365 2.349 1.00 0.00 N ATOM 296 CZ ARG A 19 -12.042 1.389 3.262 1.00 0.00 C ATOM 297 NH1 ARG A 19 -11.105 0.433 3.317 1.00 0.00 N ATOM 298 NH2 ARG A 19 -13.072 1.368 4.118 1.00 0.00 N ATOM 0 H ARG A 19 -9.436 6.255 4.102 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.987 5.001 2.039 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.288 3.894 3.926 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -10.764 4.295 3.071 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -8.758 2.990 1.332 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -9.227 1.988 2.691 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -11.092 3.244 0.624 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -10.742 1.538 0.819 1.00 0.00 H new ATOM 0 HE ARG A 19 -12.680 3.076 2.334 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -10.322 0.449 2.664 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -11.175 -0.310 4.012 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -13.786 2.095 4.075 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -13.142 0.625 4.813 1.00 0.00 H new ATOM 312 N LEU A 20 -11.074 5.837 1.185 1.00 0.00 N ATOM 313 CA LEU A 20 -11.920 6.220 0.068 1.00 0.00 C ATOM 314 C LEU A 20 -11.186 7.251 -0.792 1.00 0.00 C ATOM 315 O LEU A 20 -11.382 7.304 -2.006 1.00 0.00 O ATOM 316 CB LEU A 20 -13.285 6.698 0.568 1.00 0.00 C ATOM 317 CG LEU A 20 -13.657 8.142 0.227 1.00 0.00 C ATOM 318 CD1 LEU A 20 -15.058 8.483 0.739 1.00 0.00 C ATOM 319 CD2 LEU A 20 -12.601 9.119 0.750 1.00 0.00 C ATOM 0 H LEU A 20 -11.568 5.700 2.067 1.00 0.00 H new ATOM 0 HA LEU A 20 -12.123 5.359 -0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -14.051 6.040 0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -13.313 6.583 1.652 1.00 0.00 H new ATOM 0 HG LEU A 20 -13.678 8.242 -0.858 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -15.298 9.515 0.483 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.786 7.816 0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.089 8.361 1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -12.890 10.138 0.494 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -12.523 9.025 1.833 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -11.637 8.890 0.296 1.00 0.00 H new ATOM 331 N LEU A 21 -10.356 8.043 -0.130 1.00 0.00 N ATOM 332 CA LEU A 21 -9.591 9.068 -0.819 1.00 0.00 C ATOM 333 C LEU A 21 -8.546 8.403 -1.716 1.00 0.00 C ATOM 334 O LEU A 21 -8.452 8.714 -2.903 1.00 0.00 O ATOM 335 CB LEU A 21 -8.998 10.060 0.185 1.00 0.00 C ATOM 336 CG LEU A 21 -9.882 11.256 0.547 1.00 0.00 C ATOM 337 CD1 LEU A 21 -9.407 11.913 1.845 1.00 0.00 C ATOM 338 CD2 LEU A 21 -9.955 12.255 -0.608 1.00 0.00 C ATOM 0 H LEU A 21 -10.196 7.996 0.876 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.240 9.656 -1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.758 9.520 1.101 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.058 10.437 -0.218 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.895 10.893 0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -10.051 12.760 2.081 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -9.450 11.187 2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.381 12.260 1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -10.589 13.094 -0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.954 12.619 -0.838 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.374 11.765 -1.487 1.00 0.00 H new ATOM 350 N LEU A 22 -7.785 7.500 -1.115 1.00 0.00 N ATOM 351 CA LEU A 22 -6.750 6.788 -1.845 1.00 0.00 C ATOM 352 C LEU A 22 -7.402 5.810 -2.824 1.00 0.00 C ATOM 353 O LEU A 22 -7.037 5.762 -3.997 1.00 0.00 O ATOM 354 CB LEU A 22 -5.770 6.125 -0.875 1.00 0.00 C ATOM 355 CG LEU A 22 -6.347 5.017 0.009 1.00 0.00 C ATOM 356 CD1 LEU A 22 -6.271 3.660 -0.693 1.00 0.00 C ATOM 357 CD2 LEU A 22 -5.661 4.994 1.376 1.00 0.00 C ATOM 0 H LEU A 22 -7.865 7.245 -0.131 1.00 0.00 H new ATOM 0 HA LEU A 22 -6.156 7.483 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.944 5.709 -1.452 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.351 6.897 -0.229 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.402 5.232 0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.687 2.890 -0.043 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.841 3.698 -1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.231 3.423 -0.915 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.089 4.198 1.985 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.594 4.816 1.245 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.810 5.952 1.874 1.00 0.00 H new ATOM 369 N GLY A 23 -8.359 5.053 -2.305 1.00 0.00 N ATOM 370 CA GLY A 23 -9.066 4.078 -3.118 1.00 0.00 C ATOM 371 C GLY A 23 -9.650 4.732 -4.372 1.00 0.00 C ATOM 372 O GLY A 23 -9.736 4.099 -5.424 1.00 0.00 O ATOM 0 H GLY A 23 -8.661 5.096 -1.332 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.386 3.276 -3.405 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.866 3.624 -2.534 1.00 0.00 H new ATOM 376 N ASP A 24 -10.035 5.991 -4.221 1.00 0.00 N ATOM 377 CA ASP A 24 -10.609 6.736 -5.328 1.00 0.00 C ATOM 378 C ASP A 24 -9.493 7.143 -6.294 1.00 0.00 C ATOM 379 O ASP A 24 -9.627 6.980 -7.506 1.00 0.00 O ATOM 380 CB ASP A 24 -11.296 8.012 -4.836 1.00 0.00 C ATOM 381 CG ASP A 24 -12.800 7.880 -4.586 1.00 0.00 C ATOM 382 OD1 ASP A 24 -13.339 6.804 -4.925 1.00 0.00 O ATOM 383 OD2 ASP A 24 -13.376 8.857 -4.061 1.00 0.00 O ATOM 0 H ASP A 24 -9.960 6.514 -3.348 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.343 6.098 -5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -10.816 8.332 -3.911 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -11.133 8.801 -5.570 1.00 0.00 H new ATOM 388 N ALA A 25 -8.420 7.667 -5.722 1.00 0.00 N ATOM 389 CA ALA A 25 -7.282 8.098 -6.517 1.00 0.00 C ATOM 390 C ALA A 25 -6.616 6.876 -7.151 1.00 0.00 C ATOM 391 O ALA A 25 -6.312 6.878 -8.342 1.00 0.00 O ATOM 392 CB ALA A 25 -6.319 8.897 -5.637 1.00 0.00 C ATOM 0 H ALA A 25 -8.314 7.803 -4.717 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.605 8.753 -7.326 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.465 9.221 -6.232 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.833 9.770 -5.235 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.972 8.270 -4.816 1.00 0.00 H new ATOM 398 N LEU A 26 -6.409 5.860 -6.326 1.00 0.00 N ATOM 399 CA LEU A 26 -5.783 4.634 -6.791 1.00 0.00 C ATOM 400 C LEU A 26 -6.570 4.086 -7.983 1.00 0.00 C ATOM 401 O LEU A 26 -5.997 3.814 -9.037 1.00 0.00 O ATOM 402 CB LEU A 26 -5.637 3.636 -5.639 1.00 0.00 C ATOM 403 CG LEU A 26 -4.406 3.815 -4.749 1.00 0.00 C ATOM 404 CD1 LEU A 26 -3.150 4.054 -5.591 1.00 0.00 C ATOM 405 CD2 LEU A 26 -4.628 4.927 -3.723 1.00 0.00 C ATOM 0 H LEU A 26 -6.664 5.861 -5.338 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.770 4.832 -7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.526 3.702 -5.012 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.615 2.630 -6.057 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.250 2.891 -4.193 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.289 4.178 -4.934 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.985 3.200 -6.248 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.280 4.954 -6.192 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.738 5.033 -3.103 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.824 5.866 -4.241 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.481 4.675 -3.093 1.00 0.00 H new ATOM 417 N GLN A 27 -7.870 3.940 -7.776 1.00 0.00 N ATOM 418 CA GLN A 27 -8.742 3.429 -8.821 1.00 0.00 C ATOM 419 C GLN A 27 -8.673 4.329 -10.056 1.00 0.00 C ATOM 420 O GLN A 27 -8.802 3.854 -11.183 1.00 0.00 O ATOM 421 CB GLN A 27 -10.181 3.296 -8.319 1.00 0.00 C ATOM 422 CG GLN A 27 -10.829 4.671 -8.143 1.00 0.00 C ATOM 423 CD GLN A 27 -12.356 4.561 -8.154 1.00 0.00 C ATOM 424 OE1 GLN A 27 -12.967 3.955 -7.290 1.00 0.00 O ATOM 425 NE2 GLN A 27 -12.934 5.182 -9.178 1.00 0.00 N ATOM 0 H GLN A 27 -8.341 4.166 -6.900 1.00 0.00 H new ATOM 0 HA GLN A 27 -8.397 2.434 -9.101 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -10.763 2.703 -9.025 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -10.191 2.761 -7.369 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -10.499 5.115 -7.204 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -10.503 5.336 -8.942 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -12.362 5.671 -9.866 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -13.949 5.169 -9.275 1.00 0.00 H new ATOM 434 N GLN A 28 -8.472 5.614 -9.802 1.00 0.00 N ATOM 435 CA GLN A 28 -8.385 6.586 -10.879 1.00 0.00 C ATOM 436 C GLN A 28 -7.012 6.513 -11.550 1.00 0.00 C ATOM 437 O GLN A 28 -6.806 7.095 -12.615 1.00 0.00 O ATOM 438 CB GLN A 28 -8.670 7.999 -10.368 1.00 0.00 C ATOM 439 CG GLN A 28 -9.436 8.816 -11.411 1.00 0.00 C ATOM 440 CD GLN A 28 -8.510 9.266 -12.542 1.00 0.00 C ATOM 441 OE1 GLN A 28 -7.558 10.004 -12.343 1.00 0.00 O ATOM 442 NE2 GLN A 28 -8.840 8.785 -13.737 1.00 0.00 N ATOM 0 H GLN A 28 -8.367 6.005 -8.866 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.145 6.344 -11.622 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.249 7.946 -9.446 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -7.732 8.499 -10.127 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -10.251 8.219 -11.819 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -9.887 9.688 -10.936 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -9.649 8.172 -13.834 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -8.284 9.029 -14.556 1.00 0.00 H new ATOM 451 N LEU A 29 -6.109 5.794 -10.900 1.00 0.00 N ATOM 452 CA LEU A 29 -4.761 5.638 -11.421 1.00 0.00 C ATOM 453 C LEU A 29 -4.764 4.573 -12.521 1.00 0.00 C ATOM 454 O LEU A 29 -4.240 4.799 -13.610 1.00 0.00 O ATOM 455 CB LEU A 29 -3.778 5.347 -10.286 1.00 0.00 C ATOM 456 CG LEU A 29 -3.391 3.878 -10.093 1.00 0.00 C ATOM 457 CD1 LEU A 29 -2.381 3.434 -11.152 1.00 0.00 C ATOM 458 CD2 LEU A 29 -2.881 3.627 -8.673 1.00 0.00 C ATOM 0 H LEU A 29 -6.284 5.313 -10.018 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.419 6.567 -11.877 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.869 5.921 -10.463 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -4.210 5.714 -9.355 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.285 3.269 -10.226 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.123 2.387 -10.992 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.818 3.553 -12.144 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.482 4.045 -11.076 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.613 2.576 -8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.004 4.246 -8.487 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.662 3.879 -7.956 1.00 0.00 H new ATOM 470 N GLY A 30 -5.360 3.436 -12.196 1.00 0.00 N ATOM 471 CA GLY A 30 -5.437 2.335 -13.143 1.00 0.00 C ATOM 472 C GLY A 30 -5.128 1.002 -12.460 1.00 0.00 C ATOM 473 O GLY A 30 -4.315 0.222 -12.953 1.00 0.00 O ATOM 0 H GLY A 30 -5.794 3.252 -11.291 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.433 2.299 -13.584 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.733 2.502 -13.958 1.00 0.00 H new ATOM 477 N PHE A 31 -5.794 0.780 -11.336 1.00 0.00 N ATOM 478 CA PHE A 31 -5.600 -0.445 -10.580 1.00 0.00 C ATOM 479 C PHE A 31 -6.340 -1.615 -11.232 1.00 0.00 C ATOM 480 O PHE A 31 -7.276 -1.409 -12.004 1.00 0.00 O ATOM 481 CB PHE A 31 -6.178 -0.206 -9.184 1.00 0.00 C ATOM 482 CG PHE A 31 -5.138 0.217 -8.144 1.00 0.00 C ATOM 483 CD1 PHE A 31 -3.892 0.590 -8.541 1.00 0.00 C ATOM 484 CD2 PHE A 31 -5.461 0.219 -6.823 1.00 0.00 C ATOM 485 CE1 PHE A 31 -2.927 0.983 -7.576 1.00 0.00 C ATOM 486 CE2 PHE A 31 -4.496 0.612 -5.858 1.00 0.00 C ATOM 487 CZ PHE A 31 -3.250 0.986 -6.255 1.00 0.00 C ATOM 0 H PHE A 31 -6.469 1.429 -10.931 1.00 0.00 H new ATOM 0 HA PHE A 31 -4.540 -0.695 -10.544 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.947 0.564 -9.247 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.667 -1.119 -8.843 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -3.636 0.587 -9.590 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.450 -0.078 -6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.937 1.279 -7.891 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -4.752 0.614 -4.809 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.517 1.286 -5.521 1.00 0.00 H new ATOM 497 N LYS A 32 -5.894 -2.817 -10.899 1.00 0.00 N ATOM 498 CA LYS A 32 -6.502 -4.019 -11.443 1.00 0.00 C ATOM 499 C LYS A 32 -7.773 -4.343 -10.655 1.00 0.00 C ATOM 500 O LYS A 32 -8.874 -4.307 -11.203 1.00 0.00 O ATOM 501 CB LYS A 32 -5.489 -5.165 -11.475 1.00 0.00 C ATOM 502 CG LYS A 32 -5.034 -5.455 -12.907 1.00 0.00 C ATOM 503 CD LYS A 32 -4.102 -4.356 -13.418 1.00 0.00 C ATOM 504 CE LYS A 32 -2.826 -4.953 -14.016 1.00 0.00 C ATOM 505 NZ LYS A 32 -2.046 -3.910 -14.719 1.00 0.00 N ATOM 0 H LYS A 32 -5.118 -2.984 -10.259 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.800 -3.860 -12.479 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -4.626 -4.910 -10.860 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.934 -6.061 -11.043 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.522 -6.417 -12.942 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.903 -5.533 -13.560 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.616 -3.759 -14.171 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.844 -3.683 -12.600 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.221 -5.398 -13.226 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.082 -5.753 -14.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.184 -4.332 -15.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.620 -3.504 -15.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.785 -3.160 -14.048 1.00 0.00 H new ATOM 519 N GLN A 33 -7.579 -4.653 -9.382 1.00 0.00 N ATOM 520 CA GLN A 33 -8.696 -4.982 -8.513 1.00 0.00 C ATOM 521 C GLN A 33 -8.537 -4.289 -7.158 1.00 0.00 C ATOM 522 O GLN A 33 -7.638 -4.621 -6.388 1.00 0.00 O ATOM 523 CB GLN A 33 -8.828 -6.497 -8.342 1.00 0.00 C ATOM 524 CG GLN A 33 -10.258 -6.959 -8.630 1.00 0.00 C ATOM 525 CD GLN A 33 -10.575 -6.859 -10.123 1.00 0.00 C ATOM 526 OE1 GLN A 33 -10.812 -5.791 -10.664 1.00 0.00 O ATOM 527 NE2 GLN A 33 -10.567 -8.028 -10.758 1.00 0.00 N ATOM 0 H GLN A 33 -6.665 -4.683 -8.931 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.613 -4.620 -8.978 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.136 -7.004 -9.014 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -8.549 -6.778 -7.326 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.386 -7.988 -8.295 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.962 -6.350 -8.063 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -10.361 -8.885 -10.245 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.767 -8.067 -11.757 1.00 0.00 H new ATOM 536 N ILE A 34 -9.427 -3.339 -6.908 1.00 0.00 N ATOM 537 CA ILE A 34 -9.397 -2.596 -5.660 1.00 0.00 C ATOM 538 C ILE A 34 -10.160 -3.377 -4.588 1.00 0.00 C ATOM 539 O ILE A 34 -11.252 -3.884 -4.845 1.00 0.00 O ATOM 540 CB ILE A 34 -9.916 -1.173 -5.871 1.00 0.00 C ATOM 541 CG1 ILE A 34 -8.759 -0.181 -6.004 1.00 0.00 C ATOM 542 CG2 ILE A 34 -10.888 -0.773 -4.759 1.00 0.00 C ATOM 543 CD1 ILE A 34 -9.241 1.256 -5.792 1.00 0.00 C ATOM 0 H ILE A 34 -10.173 -3.067 -7.549 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.372 -2.487 -5.306 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.471 -1.148 -6.809 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.985 -0.420 -5.275 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.307 -0.275 -6.991 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -11.242 0.243 -4.933 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -11.737 -1.457 -4.754 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -10.379 -0.820 -3.796 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.399 1.941 -5.892 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -9.997 1.500 -6.538 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.671 1.352 -4.795 1.00 0.00 H new ATOM 555 N THR A 35 -9.557 -3.451 -3.411 1.00 0.00 N ATOM 556 CA THR A 35 -10.166 -4.161 -2.300 1.00 0.00 C ATOM 557 C THR A 35 -9.992 -3.371 -1.002 1.00 0.00 C ATOM 558 O THR A 35 -8.874 -3.221 -0.508 1.00 0.00 O ATOM 559 CB THR A 35 -9.558 -5.564 -2.245 1.00 0.00 C ATOM 560 OG1 THR A 35 -10.674 -6.417 -2.005 1.00 0.00 O ATOM 561 CG2 THR A 35 -8.663 -5.766 -1.021 1.00 0.00 C ATOM 0 H THR A 35 -8.652 -3.030 -3.203 1.00 0.00 H new ATOM 0 HA THR A 35 -11.242 -4.263 -2.438 1.00 0.00 H new ATOM 0 HB THR A 35 -8.980 -5.745 -3.151 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.356 -7.321 -1.798 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.257 -6.778 -1.030 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.845 -5.046 -1.046 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.249 -5.618 -0.114 1.00 0.00 H new ATOM 569 N ALA A 36 -11.112 -2.887 -0.486 1.00 0.00 N ATOM 570 CA ALA A 36 -11.097 -2.117 0.747 1.00 0.00 C ATOM 571 C ALA A 36 -11.427 -3.037 1.923 1.00 0.00 C ATOM 572 O ALA A 36 -12.131 -4.032 1.758 1.00 0.00 O ATOM 573 CB ALA A 36 -12.074 -0.946 0.629 1.00 0.00 C ATOM 0 H ALA A 36 -12.036 -3.013 -0.899 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.107 -1.698 0.926 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.063 -0.368 1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -11.777 -0.306 -0.202 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -13.079 -1.328 0.452 1.00 0.00 H new ATOM 579 N ALA A 37 -10.903 -2.672 3.084 1.00 0.00 N ATOM 580 CA ALA A 37 -11.133 -3.454 4.288 1.00 0.00 C ATOM 581 C ALA A 37 -11.379 -2.508 5.464 1.00 0.00 C ATOM 582 O ALA A 37 -11.397 -1.290 5.293 1.00 0.00 O ATOM 583 CB ALA A 37 -9.945 -4.386 4.527 1.00 0.00 C ATOM 0 H ALA A 37 -10.320 -1.846 3.217 1.00 0.00 H new ATOM 0 HA ALA A 37 -12.019 -4.079 4.177 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -10.118 -4.972 5.430 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.832 -5.057 3.675 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.037 -3.795 4.647 1.00 0.00 H new ATOM 589 N GLY A 38 -11.563 -3.104 6.633 1.00 0.00 N ATOM 590 CA GLY A 38 -11.806 -2.329 7.838 1.00 0.00 C ATOM 591 C GLY A 38 -10.624 -1.409 8.148 1.00 0.00 C ATOM 592 O GLY A 38 -10.789 -0.195 8.258 1.00 0.00 O ATOM 0 H GLY A 38 -11.549 -4.114 6.771 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -12.711 -1.734 7.715 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -11.978 -3.002 8.678 1.00 0.00 H new ATOM 596 N ASP A 39 -9.457 -2.022 8.278 1.00 0.00 N ATOM 597 CA ASP A 39 -8.246 -1.274 8.572 1.00 0.00 C ATOM 598 C ASP A 39 -7.075 -2.245 8.723 1.00 0.00 C ATOM 599 O ASP A 39 -7.273 -3.457 8.790 1.00 0.00 O ATOM 600 CB ASP A 39 -8.386 -0.494 9.882 1.00 0.00 C ATOM 601 CG ASP A 39 -9.451 -1.027 10.842 1.00 0.00 C ATOM 602 OD1 ASP A 39 -9.088 -1.887 11.672 1.00 0.00 O ATOM 603 OD2 ASP A 39 -10.605 -0.562 10.723 1.00 0.00 O ATOM 0 H ASP A 39 -9.324 -3.029 8.185 1.00 0.00 H new ATOM 0 HA ASP A 39 -8.073 -0.576 7.753 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -7.423 -0.497 10.393 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.618 0.544 9.646 1.00 0.00 H new ATOM 608 N GLY A 40 -5.879 -1.677 8.771 1.00 0.00 N ATOM 609 CA GLY A 40 -4.675 -2.478 8.913 1.00 0.00 C ATOM 610 C GLY A 40 -4.947 -3.943 8.567 1.00 0.00 C ATOM 611 O GLY A 40 -5.190 -4.276 7.409 1.00 0.00 O ATOM 0 H GLY A 40 -5.718 -0.671 8.714 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.894 -2.086 8.262 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.304 -2.405 9.935 1.00 0.00 H new ATOM 615 N GLU A 41 -4.897 -4.780 9.594 1.00 0.00 N ATOM 616 CA GLU A 41 -5.136 -6.202 9.413 1.00 0.00 C ATOM 617 C GLU A 41 -6.452 -6.428 8.666 1.00 0.00 C ATOM 618 O GLU A 41 -6.483 -7.130 7.656 1.00 0.00 O ATOM 619 CB GLU A 41 -5.135 -6.932 10.757 1.00 0.00 C ATOM 620 CG GLU A 41 -6.467 -6.741 11.486 1.00 0.00 C ATOM 621 CD GLU A 41 -6.476 -7.494 12.818 1.00 0.00 C ATOM 622 OE1 GLU A 41 -5.463 -8.172 13.094 1.00 0.00 O ATOM 623 OE2 GLU A 41 -7.496 -7.373 13.531 1.00 0.00 O ATOM 0 H GLU A 41 -4.695 -4.500 10.554 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.325 -6.614 8.812 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.953 -7.995 10.597 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.320 -6.558 11.377 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.640 -5.679 11.663 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -7.284 -7.096 10.858 1.00 0.00 H new ATOM 630 N GLN A 42 -7.505 -5.820 9.190 1.00 0.00 N ATOM 631 CA GLN A 42 -8.821 -5.946 8.586 1.00 0.00 C ATOM 632 C GLN A 42 -8.705 -5.950 7.059 1.00 0.00 C ATOM 633 O GLN A 42 -9.531 -6.550 6.373 1.00 0.00 O ATOM 634 CB GLN A 42 -9.754 -4.832 9.063 1.00 0.00 C ATOM 635 CG GLN A 42 -10.828 -5.381 10.004 1.00 0.00 C ATOM 636 CD GLN A 42 -12.072 -5.812 9.223 1.00 0.00 C ATOM 637 OE1 GLN A 42 -12.569 -5.107 8.360 1.00 0.00 O ATOM 638 NE2 GLN A 42 -12.543 -7.004 9.575 1.00 0.00 N ATOM 0 H GLN A 42 -7.474 -5.238 10.027 1.00 0.00 H new ATOM 0 HA GLN A 42 -9.255 -6.895 8.901 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -9.176 -4.063 9.575 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -10.227 -4.356 8.204 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -10.430 -6.230 10.560 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -11.099 -4.620 10.736 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -12.077 -7.541 10.306 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -13.371 -7.382 9.114 1.00 0.00 H new ATOM 647 N GLY A 43 -7.674 -5.273 6.575 1.00 0.00 N ATOM 648 CA GLY A 43 -7.440 -5.190 5.144 1.00 0.00 C ATOM 649 C GLY A 43 -6.227 -6.030 4.737 1.00 0.00 C ATOM 650 O GLY A 43 -6.280 -6.767 3.754 1.00 0.00 O ATOM 0 H GLY A 43 -6.992 -4.777 7.149 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.323 -5.536 4.607 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.280 -4.151 4.858 1.00 0.00 H new ATOM 654 N MET A 44 -5.164 -5.888 5.514 1.00 0.00 N ATOM 655 CA MET A 44 -3.939 -6.624 5.247 1.00 0.00 C ATOM 656 C MET A 44 -4.208 -8.129 5.180 1.00 0.00 C ATOM 657 O MET A 44 -3.805 -8.793 4.226 1.00 0.00 O ATOM 658 CB MET A 44 -2.919 -6.335 6.349 1.00 0.00 C ATOM 659 CG MET A 44 -2.095 -7.582 6.674 1.00 0.00 C ATOM 660 SD MET A 44 -1.259 -8.161 5.206 1.00 0.00 S ATOM 661 CE MET A 44 -0.379 -9.559 5.881 1.00 0.00 C ATOM 0 H MET A 44 -5.125 -5.275 6.328 1.00 0.00 H new ATOM 0 HA MET A 44 -3.545 -6.301 4.283 1.00 0.00 H new ATOM 0 HB2 MET A 44 -2.256 -5.529 6.034 1.00 0.00 H new ATOM 0 HB3 MET A 44 -3.435 -5.992 7.246 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.366 -7.354 7.452 1.00 0.00 H new ATOM 0 HG3 MET A 44 -2.744 -8.365 7.066 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.332 -10.353 5.136 1.00 0.00 H new ATOM 0 HE2 MET A 44 0.632 -9.256 6.153 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.899 -9.923 6.767 1.00 0.00 H new ATOM 671 N LYS A 45 -4.885 -8.623 6.206 1.00 0.00 N ATOM 672 CA LYS A 45 -5.212 -10.036 6.276 1.00 0.00 C ATOM 673 C LYS A 45 -5.990 -10.438 5.021 1.00 0.00 C ATOM 674 O LYS A 45 -5.803 -11.535 4.495 1.00 0.00 O ATOM 675 CB LYS A 45 -5.944 -10.353 7.581 1.00 0.00 C ATOM 676 CG LYS A 45 -5.255 -9.686 8.773 1.00 0.00 C ATOM 677 CD LYS A 45 -4.776 -10.729 9.785 1.00 0.00 C ATOM 678 CE LYS A 45 -5.962 -11.443 10.437 1.00 0.00 C ATOM 679 NZ LYS A 45 -5.488 -12.443 11.420 1.00 0.00 N ATOM 0 H LYS A 45 -5.216 -8.069 6.996 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.303 -10.637 6.294 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.977 -10.010 7.515 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -5.975 -11.432 7.732 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.407 -9.097 8.424 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.946 -8.995 9.257 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.137 -11.458 9.287 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.171 -10.246 10.552 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.605 -10.715 10.931 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.564 -11.933 9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.305 -12.918 11.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.893 -13.147 10.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.933 -11.967 12.159 1.00 0.00 H new ATOM 693 N ILE A 46 -6.847 -9.530 4.578 1.00 0.00 N ATOM 694 CA ILE A 46 -7.653 -9.776 3.396 1.00 0.00 C ATOM 695 C ILE A 46 -6.734 -10.048 2.204 1.00 0.00 C ATOM 696 O ILE A 46 -6.976 -10.969 1.425 1.00 0.00 O ATOM 697 CB ILE A 46 -8.633 -8.623 3.166 1.00 0.00 C ATOM 698 CG1 ILE A 46 -9.985 -8.913 3.822 1.00 0.00 C ATOM 699 CG2 ILE A 46 -8.775 -8.313 1.674 1.00 0.00 C ATOM 700 CD1 ILE A 46 -9.800 -9.594 5.180 1.00 0.00 C ATOM 0 H ILE A 46 -7.000 -8.622 5.017 1.00 0.00 H new ATOM 0 HA ILE A 46 -8.269 -10.665 3.534 1.00 0.00 H new ATOM 0 HB ILE A 46 -8.228 -7.731 3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -10.538 -7.983 3.950 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -10.581 -9.551 3.169 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -9.477 -7.490 1.539 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -7.804 -8.032 1.267 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.146 -9.196 1.153 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -10.776 -9.789 5.625 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -9.268 -10.536 5.045 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -9.225 -8.943 5.838 1.00 0.00 H new ATOM 712 N MET A 47 -5.697 -9.230 2.098 1.00 0.00 N ATOM 713 CA MET A 47 -4.739 -9.370 1.014 1.00 0.00 C ATOM 714 C MET A 47 -3.948 -10.674 1.146 1.00 0.00 C ATOM 715 O MET A 47 -3.579 -11.284 0.145 1.00 0.00 O ATOM 716 CB MET A 47 -3.774 -8.183 1.027 1.00 0.00 C ATOM 717 CG MET A 47 -4.449 -6.922 0.482 1.00 0.00 C ATOM 718 SD MET A 47 -4.554 -7.007 -1.298 1.00 0.00 S ATOM 719 CE MET A 47 -2.969 -6.313 -1.736 1.00 0.00 C ATOM 0 H MET A 47 -5.499 -8.467 2.746 1.00 0.00 H new ATOM 0 HA MET A 47 -5.286 -9.393 0.072 1.00 0.00 H new ATOM 0 HB2 MET A 47 -3.427 -8.003 2.044 1.00 0.00 H new ATOM 0 HB3 MET A 47 -2.895 -8.418 0.427 1.00 0.00 H new ATOM 0 HG2 MET A 47 -5.447 -6.820 0.909 1.00 0.00 H new ATOM 0 HG3 MET A 47 -3.883 -6.039 0.779 1.00 0.00 H new ATOM 0 HE1 MET A 47 -2.737 -6.561 -2.772 1.00 0.00 H new ATOM 0 HE2 MET A 47 -3.002 -5.230 -1.621 1.00 0.00 H new ATOM 0 HE3 MET A 47 -2.199 -6.724 -1.083 1.00 0.00 H new ATOM 729 N ALA A 48 -3.712 -11.061 2.392 1.00 0.00 N ATOM 730 CA ALA A 48 -2.972 -12.279 2.669 1.00 0.00 C ATOM 731 C ALA A 48 -3.740 -13.477 2.105 1.00 0.00 C ATOM 732 O ALA A 48 -3.163 -14.327 1.429 1.00 0.00 O ATOM 733 CB ALA A 48 -2.729 -12.399 4.175 1.00 0.00 C ATOM 0 H ALA A 48 -4.021 -10.552 3.220 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.997 -12.254 2.183 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.173 -13.314 4.382 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -2.155 -11.539 4.521 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -3.686 -12.430 4.697 1.00 0.00 H new ATOM 739 N GLN A 49 -5.030 -13.505 2.405 1.00 0.00 N ATOM 740 CA GLN A 49 -5.884 -14.584 1.937 1.00 0.00 C ATOM 741 C GLN A 49 -5.981 -14.560 0.411 1.00 0.00 C ATOM 742 O GLN A 49 -5.550 -15.498 -0.258 1.00 0.00 O ATOM 743 CB GLN A 49 -7.271 -14.503 2.577 1.00 0.00 C ATOM 744 CG GLN A 49 -7.166 -14.296 4.090 1.00 0.00 C ATOM 745 CD GLN A 49 -7.521 -15.579 4.844 1.00 0.00 C ATOM 746 OE1 GLN A 49 -8.498 -16.249 4.556 1.00 0.00 O ATOM 747 NE2 GLN A 49 -6.674 -15.882 5.824 1.00 0.00 N ATOM 0 H GLN A 49 -5.505 -12.798 2.966 1.00 0.00 H new ATOM 0 HA GLN A 49 -5.437 -15.532 2.238 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.833 -13.682 2.132 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -7.825 -15.418 2.369 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -6.154 -13.986 4.349 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.834 -13.492 4.398 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.875 -15.277 6.013 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.824 -16.719 6.387 1.00 0.00 H new ATOM 756 N ASN A 50 -6.550 -13.476 -0.097 1.00 0.00 N ATOM 757 CA ASN A 50 -6.710 -13.317 -1.532 1.00 0.00 C ATOM 758 C ASN A 50 -5.380 -12.870 -2.142 1.00 0.00 C ATOM 759 O ASN A 50 -4.374 -12.771 -1.443 1.00 0.00 O ATOM 760 CB ASN A 50 -7.760 -12.251 -1.854 1.00 0.00 C ATOM 761 CG ASN A 50 -8.674 -12.001 -0.654 1.00 0.00 C ATOM 762 OD1 ASN A 50 -8.917 -12.872 0.166 1.00 0.00 O ATOM 763 ND2 ASN A 50 -9.167 -10.767 -0.596 1.00 0.00 N ATOM 0 H ASN A 50 -6.906 -12.699 0.460 1.00 0.00 H new ATOM 0 HA ASN A 50 -7.029 -14.274 -1.944 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.265 -11.322 -2.138 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -8.356 -12.569 -2.709 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.789 -10.502 0.168 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.923 -10.086 -1.315 1.00 0.00 H new ATOM 770 N PRO A 51 -5.419 -12.605 -3.476 1.00 0.00 N ATOM 771 CA PRO A 51 -4.230 -12.172 -4.189 1.00 0.00 C ATOM 772 C PRO A 51 -3.904 -10.711 -3.873 1.00 0.00 C ATOM 773 O PRO A 51 -4.806 -9.888 -3.726 1.00 0.00 O ATOM 774 CB PRO A 51 -4.544 -12.407 -5.657 1.00 0.00 C ATOM 775 CG PRO A 51 -6.057 -12.524 -5.746 1.00 0.00 C ATOM 776 CD PRO A 51 -6.594 -12.712 -4.337 1.00 0.00 C ATOM 0 HA PRO A 51 -3.338 -12.724 -3.894 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.179 -11.584 -6.271 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.060 -13.314 -6.020 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -6.483 -11.629 -6.201 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.338 -13.367 -6.377 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -7.336 -11.952 -4.091 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.081 -13.681 -4.225 1.00 0.00 H new ATOM 784 N HIS A 52 -2.612 -10.433 -3.779 1.00 0.00 N ATOM 785 CA HIS A 52 -2.156 -9.085 -3.485 1.00 0.00 C ATOM 786 C HIS A 52 -0.955 -8.745 -4.369 1.00 0.00 C ATOM 787 O HIS A 52 -0.124 -9.607 -4.653 1.00 0.00 O ATOM 788 CB HIS A 52 -1.856 -8.927 -1.992 1.00 0.00 C ATOM 789 CG HIS A 52 -1.120 -10.098 -1.386 1.00 0.00 C ATOM 790 ND1 HIS A 52 -0.337 -10.960 -2.135 1.00 0.00 N ATOM 791 CD2 HIS A 52 -1.054 -10.540 -0.098 1.00 0.00 C ATOM 792 CE1 HIS A 52 0.171 -11.875 -1.323 1.00 0.00 C ATOM 793 NE2 HIS A 52 -0.275 -11.614 -0.060 1.00 0.00 N ATOM 0 H HIS A 52 -1.866 -11.118 -3.901 1.00 0.00 H new ATOM 0 HA HIS A 52 -2.947 -8.371 -3.716 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -1.264 -8.024 -1.844 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -2.795 -8.784 -1.456 1.00 0.00 H new ATOM 0 HD1 HIS A 52 -0.178 -10.901 -3.141 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -1.552 -10.092 0.749 1.00 0.00 H new ATOM 0 HE1 HIS A 52 0.824 -12.686 -1.610 1.00 0.00 H new ATOM 802 N HIS A 53 -0.902 -7.487 -4.781 1.00 0.00 N ATOM 803 CA HIS A 53 0.184 -7.022 -5.628 1.00 0.00 C ATOM 804 C HIS A 53 0.663 -5.653 -5.141 1.00 0.00 C ATOM 805 O HIS A 53 1.861 -5.372 -5.153 1.00 0.00 O ATOM 806 CB HIS A 53 -0.239 -7.013 -7.098 1.00 0.00 C ATOM 807 CG HIS A 53 0.916 -6.980 -8.070 1.00 0.00 C ATOM 808 ND1 HIS A 53 0.747 -7.087 -9.438 1.00 0.00 N ATOM 809 CD2 HIS A 53 2.256 -6.848 -7.856 1.00 0.00 C ATOM 810 CE1 HIS A 53 1.940 -7.023 -10.013 1.00 0.00 C ATOM 811 NE2 HIS A 53 2.874 -6.875 -9.031 1.00 0.00 N ATOM 0 H HIS A 53 -1.593 -6.775 -4.544 1.00 0.00 H new ATOM 0 HA HIS A 53 1.026 -7.710 -5.557 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.843 -7.899 -7.297 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -0.876 -6.147 -7.277 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.734 -6.740 -6.894 1.00 0.00 H new ATOM 0 HE1 HIS A 53 2.137 -7.078 -11.073 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.881 -6.798 -9.175 1.00 0.00 H new ATOM 820 N LEU A 54 -0.295 -4.838 -4.725 1.00 0.00 N ATOM 821 CA LEU A 54 0.015 -3.506 -4.236 1.00 0.00 C ATOM 822 C LEU A 54 -0.939 -3.153 -3.094 1.00 0.00 C ATOM 823 O LEU A 54 -2.146 -3.038 -3.301 1.00 0.00 O ATOM 824 CB LEU A 54 -0.001 -2.496 -5.385 1.00 0.00 C ATOM 825 CG LEU A 54 0.467 -1.081 -5.041 1.00 0.00 C ATOM 826 CD1 LEU A 54 1.803 -0.764 -5.717 1.00 0.00 C ATOM 827 CD2 LEU A 54 -0.608 -0.049 -5.385 1.00 0.00 C ATOM 0 H LEU A 54 -1.287 -5.075 -4.717 1.00 0.00 H new ATOM 0 HA LEU A 54 1.026 -3.475 -3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.628 -2.880 -6.188 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.017 -2.436 -5.776 1.00 0.00 H new ATOM 0 HG LEU A 54 0.631 -1.029 -3.965 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.112 0.248 -5.455 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.559 -1.473 -5.379 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.691 -0.841 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.250 0.948 -5.130 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.828 -0.094 -6.452 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.514 -0.265 -4.818 1.00 0.00 H new ATOM 839 N VAL A 55 -0.362 -2.990 -1.912 1.00 0.00 N ATOM 840 CA VAL A 55 -1.146 -2.652 -0.737 1.00 0.00 C ATOM 841 C VAL A 55 -1.085 -1.141 -0.506 1.00 0.00 C ATOM 842 O VAL A 55 -0.022 -0.535 -0.617 1.00 0.00 O ATOM 843 CB VAL A 55 -0.659 -3.460 0.468 1.00 0.00 C ATOM 844 CG1 VAL A 55 -1.022 -2.763 1.780 1.00 0.00 C ATOM 845 CG2 VAL A 55 -1.213 -4.886 0.432 1.00 0.00 C ATOM 0 H VAL A 55 0.639 -3.086 -1.743 1.00 0.00 H new ATOM 0 HA VAL A 55 -2.193 -2.917 -0.888 1.00 0.00 H new ATOM 0 HB VAL A 55 0.428 -3.521 0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.664 -3.359 2.620 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.556 -1.778 1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.105 -2.655 1.847 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.852 -5.439 1.299 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -2.302 -4.854 0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.880 -5.383 -0.479 1.00 0.00 H new ATOM 855 N ILE A 56 -2.242 -0.576 -0.190 1.00 0.00 N ATOM 856 CA ILE A 56 -2.335 0.853 0.057 1.00 0.00 C ATOM 857 C ILE A 56 -3.252 1.100 1.256 1.00 0.00 C ATOM 858 O ILE A 56 -4.428 0.743 1.227 1.00 0.00 O ATOM 859 CB ILE A 56 -2.770 1.589 -1.212 1.00 0.00 C ATOM 860 CG1 ILE A 56 -3.857 0.809 -1.953 1.00 0.00 C ATOM 861 CG2 ILE A 56 -1.568 1.889 -2.110 1.00 0.00 C ATOM 862 CD1 ILE A 56 -3.278 -0.439 -2.623 1.00 0.00 C ATOM 0 H ILE A 56 -3.123 -1.082 -0.099 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.357 1.260 0.314 1.00 0.00 H new ATOM 0 HB ILE A 56 -3.202 2.546 -0.921 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -4.642 0.520 -1.254 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -4.319 1.448 -2.705 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.904 2.412 -3.005 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.857 2.514 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.085 0.955 -2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -4.072 -0.975 -3.143 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.510 -0.145 -3.339 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.838 -1.088 -1.866 1.00 0.00 H new ATOM 874 N SER A 57 -2.678 1.711 2.283 1.00 0.00 N ATOM 875 CA SER A 57 -3.429 2.010 3.490 1.00 0.00 C ATOM 876 C SER A 57 -2.988 3.361 4.059 1.00 0.00 C ATOM 877 O SER A 57 -2.173 4.057 3.455 1.00 0.00 O ATOM 878 CB SER A 57 -3.251 0.910 4.537 1.00 0.00 C ATOM 879 OG SER A 57 -3.475 1.389 5.860 1.00 0.00 O ATOM 0 H SER A 57 -1.702 2.007 2.303 1.00 0.00 H new ATOM 0 HA SER A 57 -4.487 2.059 3.231 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.942 0.094 4.326 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.243 0.502 4.465 1.00 0.00 H new ATOM 0 HG SER A 57 -4.427 1.313 6.078 1.00 0.00 H new ATOM 885 N ASP A 58 -3.546 3.691 5.215 1.00 0.00 N ATOM 886 CA ASP A 58 -3.221 4.945 5.871 1.00 0.00 C ATOM 887 C ASP A 58 -1.952 4.765 6.707 1.00 0.00 C ATOM 888 O ASP A 58 -1.492 3.642 6.908 1.00 0.00 O ATOM 889 CB ASP A 58 -4.347 5.383 6.810 1.00 0.00 C ATOM 890 CG ASP A 58 -4.752 4.348 7.861 1.00 0.00 C ATOM 891 OD1 ASP A 58 -4.216 3.221 7.784 1.00 0.00 O ATOM 892 OD2 ASP A 58 -5.589 4.706 8.718 1.00 0.00 O ATOM 0 H ASP A 58 -4.221 3.111 5.714 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.079 5.702 5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.040 6.296 7.320 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.223 5.632 6.211 1.00 0.00 H new ATOM 897 N PHE A 59 -1.423 5.887 7.171 1.00 0.00 N ATOM 898 CA PHE A 59 -0.216 5.866 7.979 1.00 0.00 C ATOM 899 C PHE A 59 -0.543 5.571 9.445 1.00 0.00 C ATOM 900 O PHE A 59 0.346 5.244 10.229 1.00 0.00 O ATOM 901 CB PHE A 59 0.413 7.258 7.880 1.00 0.00 C ATOM 902 CG PHE A 59 1.748 7.286 7.133 1.00 0.00 C ATOM 903 CD1 PHE A 59 2.678 6.322 7.368 1.00 0.00 C ATOM 904 CD2 PHE A 59 2.003 8.273 6.234 1.00 0.00 C ATOM 905 CE1 PHE A 59 3.917 6.348 6.674 1.00 0.00 C ATOM 906 CE2 PHE A 59 3.242 8.299 5.540 1.00 0.00 C ATOM 907 CZ PHE A 59 4.174 7.335 5.775 1.00 0.00 C ATOM 0 H PHE A 59 -1.808 6.816 7.003 1.00 0.00 H new ATOM 0 HA PHE A 59 0.458 5.088 7.621 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -0.286 7.927 7.378 1.00 0.00 H new ATOM 0 HB3 PHE A 59 0.563 7.650 8.886 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.475 5.537 8.082 1.00 0.00 H new ATOM 0 HD2 PHE A 59 1.263 9.038 6.047 1.00 0.00 H new ATOM 0 HE1 PHE A 59 4.656 5.583 6.861 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.445 9.083 4.826 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.116 7.354 5.248 1.00 0.00 H new ATOM 917 N ASN A 60 -1.821 5.697 9.770 1.00 0.00 N ATOM 918 CA ASN A 60 -2.277 5.448 11.127 1.00 0.00 C ATOM 919 C ASN A 60 -1.586 4.195 11.670 1.00 0.00 C ATOM 920 O ASN A 60 -0.887 3.499 10.935 1.00 0.00 O ATOM 921 CB ASN A 60 -3.788 5.210 11.165 1.00 0.00 C ATOM 922 CG ASN A 60 -4.551 6.534 11.220 1.00 0.00 C ATOM 923 OD1 ASN A 60 -4.459 7.295 12.170 1.00 0.00 O ATOM 924 ND2 ASN A 60 -5.306 6.768 10.150 1.00 0.00 N ATOM 0 H ASN A 60 -2.556 5.968 9.117 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.035 6.323 11.731 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.093 4.647 10.283 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.042 4.603 12.034 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.853 7.627 10.090 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -5.338 6.089 9.390 1.00 0.00 H new ATOM 931 N MET A 61 -1.806 3.947 12.953 1.00 0.00 N ATOM 932 CA MET A 61 -1.214 2.790 13.603 1.00 0.00 C ATOM 933 C MET A 61 -2.275 1.731 13.911 1.00 0.00 C ATOM 934 O MET A 61 -2.580 1.474 15.075 1.00 0.00 O ATOM 935 CB MET A 61 -0.535 3.227 14.902 1.00 0.00 C ATOM 936 CG MET A 61 -1.570 3.623 15.956 1.00 0.00 C ATOM 937 SD MET A 61 -0.990 5.034 16.882 1.00 0.00 S ATOM 938 CE MET A 61 -1.733 4.691 18.468 1.00 0.00 C ATOM 0 H MET A 61 -2.386 4.527 13.559 1.00 0.00 H new ATOM 0 HA MET A 61 -0.478 2.353 12.927 1.00 0.00 H new ATOM 0 HB2 MET A 61 0.085 2.416 15.283 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.128 4.069 14.704 1.00 0.00 H new ATOM 0 HG2 MET A 61 -2.519 3.859 15.475 1.00 0.00 H new ATOM 0 HG3 MET A 61 -1.753 2.786 16.630 1.00 0.00 H new ATOM 0 HE1 MET A 61 -1.470 5.481 19.172 1.00 0.00 H new ATOM 0 HE2 MET A 61 -2.817 4.647 18.360 1.00 0.00 H new ATOM 0 HE3 MET A 61 -1.367 3.735 18.842 1.00 0.00 H new ATOM 948 N PRO A 62 -2.822 1.131 12.820 1.00 0.00 N ATOM 949 CA PRO A 62 -3.842 0.106 12.964 1.00 0.00 C ATOM 950 C PRO A 62 -3.230 -1.216 13.428 1.00 0.00 C ATOM 951 O PRO A 62 -2.135 -1.235 13.988 1.00 0.00 O ATOM 952 CB PRO A 62 -4.497 0.009 11.596 1.00 0.00 C ATOM 953 CG PRO A 62 -3.519 0.644 10.620 1.00 0.00 C ATOM 954 CD PRO A 62 -2.485 1.410 11.428 1.00 0.00 C ATOM 0 HA PRO A 62 -4.579 0.351 13.728 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.695 -1.029 11.330 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -5.455 0.529 11.584 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -3.037 -0.121 10.011 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -4.042 1.313 9.937 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -1.474 1.080 11.192 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -2.529 2.478 11.216 1.00 0.00 H new ATOM 962 N LYS A 63 -3.963 -2.291 13.177 1.00 0.00 N ATOM 963 CA LYS A 63 -3.505 -3.616 13.563 1.00 0.00 C ATOM 964 C LYS A 63 -2.189 -3.925 12.847 1.00 0.00 C ATOM 965 O LYS A 63 -1.342 -4.642 13.379 1.00 0.00 O ATOM 966 CB LYS A 63 -4.600 -4.655 13.311 1.00 0.00 C ATOM 967 CG LYS A 63 -5.553 -4.747 14.505 1.00 0.00 C ATOM 968 CD LYS A 63 -5.260 -5.991 15.347 1.00 0.00 C ATOM 969 CE LYS A 63 -3.776 -6.359 15.282 1.00 0.00 C ATOM 970 NZ LYS A 63 -3.349 -7.008 16.542 1.00 0.00 N ATOM 0 H LYS A 63 -4.870 -2.272 12.711 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.302 -3.652 14.633 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.159 -4.389 12.414 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.147 -5.629 13.127 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -5.455 -3.854 15.123 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.583 -4.778 14.151 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.549 -5.810 16.382 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -5.862 -6.827 14.990 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -3.598 -7.030 14.442 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.180 -5.463 15.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -2.340 -7.252 16.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -3.501 -6.356 17.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -3.906 -7.873 16.693 1.00 0.00 H new ATOM 984 N MET A 64 -2.057 -3.367 11.653 1.00 0.00 N ATOM 985 CA MET A 64 -0.858 -3.574 10.859 1.00 0.00 C ATOM 986 C MET A 64 -0.608 -2.389 9.924 1.00 0.00 C ATOM 987 O MET A 64 -1.465 -2.043 9.112 1.00 0.00 O ATOM 988 CB MET A 64 -1.006 -4.853 10.033 1.00 0.00 C ATOM 989 CG MET A 64 -1.583 -5.988 10.881 1.00 0.00 C ATOM 990 SD MET A 64 -1.519 -7.523 9.972 1.00 0.00 S ATOM 991 CE MET A 64 0.051 -8.155 10.542 1.00 0.00 C ATOM 0 H MET A 64 -2.761 -2.772 11.216 1.00 0.00 H new ATOM 0 HA MET A 64 -0.009 -3.665 11.536 1.00 0.00 H new ATOM 0 HB2 MET A 64 -1.656 -4.665 9.179 1.00 0.00 H new ATOM 0 HB3 MET A 64 -0.035 -5.148 9.636 1.00 0.00 H new ATOM 0 HG2 MET A 64 -1.020 -6.082 11.809 1.00 0.00 H new ATOM 0 HG3 MET A 64 -2.613 -5.761 11.155 1.00 0.00 H new ATOM 0 HE1 MET A 64 0.342 -9.010 9.932 1.00 0.00 H new ATOM 0 HE2 MET A 64 0.809 -7.376 10.459 1.00 0.00 H new ATOM 0 HE3 MET A 64 -0.038 -8.466 11.583 1.00 0.00 H new ATOM 1001 N ASP A 65 0.569 -1.799 10.070 1.00 0.00 N ATOM 1002 CA ASP A 65 0.942 -0.660 9.247 1.00 0.00 C ATOM 1003 C ASP A 65 2.273 -0.952 8.551 1.00 0.00 C ATOM 1004 O ASP A 65 2.933 -1.944 8.857 1.00 0.00 O ATOM 1005 CB ASP A 65 1.120 0.599 10.099 1.00 0.00 C ATOM 1006 CG ASP A 65 1.025 1.919 9.331 1.00 0.00 C ATOM 1007 OD1 ASP A 65 -0.065 2.172 8.773 1.00 0.00 O ATOM 1008 OD2 ASP A 65 2.042 2.643 9.319 1.00 0.00 O ATOM 0 H ASP A 65 1.277 -2.088 10.745 1.00 0.00 H new ATOM 0 HA ASP A 65 0.147 -0.495 8.520 1.00 0.00 H new ATOM 0 HB2 ASP A 65 0.364 0.598 10.884 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.091 0.552 10.591 1.00 0.00 H new ATOM 1013 N GLY A 66 2.628 -0.071 7.628 1.00 0.00 N ATOM 1014 CA GLY A 66 3.868 -0.222 6.886 1.00 0.00 C ATOM 1015 C GLY A 66 4.900 -1.008 7.698 1.00 0.00 C ATOM 1016 O GLY A 66 5.641 -1.820 7.147 1.00 0.00 O ATOM 0 H GLY A 66 2.078 0.751 7.377 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.673 -0.736 5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.268 0.760 6.636 1.00 0.00 H new ATOM 1020 N LEU A 67 4.916 -0.738 8.995 1.00 0.00 N ATOM 1021 CA LEU A 67 5.845 -1.409 9.888 1.00 0.00 C ATOM 1022 C LEU A 67 5.399 -2.860 10.085 1.00 0.00 C ATOM 1023 O LEU A 67 6.109 -3.788 9.701 1.00 0.00 O ATOM 1024 CB LEU A 67 5.990 -0.629 11.196 1.00 0.00 C ATOM 1025 CG LEU A 67 6.474 0.817 11.064 1.00 0.00 C ATOM 1026 CD1 LEU A 67 7.870 0.873 10.438 1.00 0.00 C ATOM 1027 CD2 LEU A 67 5.463 1.665 10.290 1.00 0.00 C ATOM 0 H LEU A 67 4.300 -0.063 9.449 1.00 0.00 H new ATOM 0 HA LEU A 67 6.842 -1.437 9.448 1.00 0.00 H new ATOM 0 HB2 LEU A 67 5.024 -0.623 11.702 1.00 0.00 H new ATOM 0 HB3 LEU A 67 6.685 -1.166 11.841 1.00 0.00 H new ATOM 0 HG LEU A 67 6.553 1.244 12.064 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.190 1.912 10.355 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.573 0.325 11.066 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.842 0.422 9.446 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.831 2.688 10.211 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.328 1.249 9.291 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.508 1.663 10.816 1.00 0.00 H new ATOM 1039 N GLY A 68 4.225 -3.009 10.680 1.00 0.00 N ATOM 1040 CA GLY A 68 3.676 -4.331 10.931 1.00 0.00 C ATOM 1041 C GLY A 68 3.467 -5.095 9.622 1.00 0.00 C ATOM 1042 O GLY A 68 3.735 -6.294 9.550 1.00 0.00 O ATOM 0 H GLY A 68 3.639 -2.236 10.996 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.349 -4.891 11.580 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.727 -4.240 11.459 1.00 0.00 H new ATOM 1046 N LEU A 69 2.991 -4.371 8.620 1.00 0.00 N ATOM 1047 CA LEU A 69 2.743 -4.967 7.319 1.00 0.00 C ATOM 1048 C LEU A 69 4.024 -5.637 6.818 1.00 0.00 C ATOM 1049 O LEU A 69 3.994 -6.782 6.366 1.00 0.00 O ATOM 1050 CB LEU A 69 2.175 -3.925 6.352 1.00 0.00 C ATOM 1051 CG LEU A 69 0.758 -4.188 5.840 1.00 0.00 C ATOM 1052 CD1 LEU A 69 -0.249 -4.189 6.991 1.00 0.00 C ATOM 1053 CD2 LEU A 69 0.376 -3.188 4.746 1.00 0.00 C ATOM 0 H LEU A 69 2.771 -3.377 8.683 1.00 0.00 H new ATOM 0 HA LEU A 69 1.984 -5.745 7.394 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.187 -2.954 6.847 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.843 -3.853 5.493 1.00 0.00 H new ATOM 0 HG LEU A 69 0.736 -5.181 5.391 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.249 -4.378 6.600 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.015 -4.969 7.705 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.232 -3.220 7.490 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.636 -3.397 4.399 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.420 -2.175 5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.071 -3.278 3.912 1.00 0.00 H new ATOM 1065 N LEU A 70 5.118 -4.896 6.912 1.00 0.00 N ATOM 1066 CA LEU A 70 6.407 -5.405 6.473 1.00 0.00 C ATOM 1067 C LEU A 70 6.711 -6.711 7.208 1.00 0.00 C ATOM 1068 O LEU A 70 6.716 -7.782 6.603 1.00 0.00 O ATOM 1069 CB LEU A 70 7.489 -4.337 6.642 1.00 0.00 C ATOM 1070 CG LEU A 70 8.881 -4.705 6.123 1.00 0.00 C ATOM 1071 CD1 LEU A 70 9.921 -3.674 6.565 1.00 0.00 C ATOM 1072 CD2 LEU A 70 9.265 -6.124 6.545 1.00 0.00 C ATOM 0 H LEU A 70 5.139 -3.947 7.286 1.00 0.00 H new ATOM 0 HA LEU A 70 6.384 -5.637 5.408 1.00 0.00 H new ATOM 0 HB2 LEU A 70 7.161 -3.431 6.132 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.570 -4.095 7.702 1.00 0.00 H new ATOM 0 HG LEU A 70 8.855 -4.689 5.033 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.901 -3.959 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.650 -2.693 6.174 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.954 -3.634 7.654 1.00 0.00 H new ATOM 0 HD21 LEU A 70 10.258 -6.361 6.164 1.00 0.00 H new ATOM 0 HD22 LEU A 70 9.268 -6.192 7.633 1.00 0.00 H new ATOM 0 HD23 LEU A 70 8.542 -6.832 6.140 1.00 0.00 H new ATOM 1084 N GLN A 71 6.958 -6.581 8.503 1.00 0.00 N ATOM 1085 CA GLN A 71 7.263 -7.738 9.327 1.00 0.00 C ATOM 1086 C GLN A 71 6.306 -8.888 9.002 1.00 0.00 C ATOM 1087 O GLN A 71 6.684 -10.055 9.085 1.00 0.00 O ATOM 1088 CB GLN A 71 7.208 -7.382 10.815 1.00 0.00 C ATOM 1089 CG GLN A 71 8.086 -6.167 11.120 1.00 0.00 C ATOM 1090 CD GLN A 71 8.630 -6.230 12.548 1.00 0.00 C ATOM 1091 OE1 GLN A 71 9.285 -7.178 12.950 1.00 0.00 O ATOM 1092 NE2 GLN A 71 8.325 -5.170 13.291 1.00 0.00 N ATOM 0 H GLN A 71 6.953 -5.691 9.002 1.00 0.00 H new ATOM 0 HA GLN A 71 8.279 -8.062 9.102 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.178 -7.173 11.105 1.00 0.00 H new ATOM 0 HB3 GLN A 71 7.540 -8.234 11.409 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.914 -6.125 10.413 1.00 0.00 H new ATOM 0 HG3 GLN A 71 7.507 -5.253 10.987 1.00 0.00 H new ATOM 0 HE21 GLN A 71 7.773 -4.410 12.893 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.643 -5.117 14.259 1.00 0.00 H new ATOM 1101 N ALA A 72 5.087 -8.516 8.641 1.00 0.00 N ATOM 1102 CA ALA A 72 4.074 -9.502 8.304 1.00 0.00 C ATOM 1103 C ALA A 72 4.504 -10.258 7.045 1.00 0.00 C ATOM 1104 O ALA A 72 4.484 -11.488 7.019 1.00 0.00 O ATOM 1105 CB ALA A 72 2.722 -8.806 8.133 1.00 0.00 C ATOM 0 H ALA A 72 4.778 -7.546 8.574 1.00 0.00 H new ATOM 0 HA ALA A 72 3.966 -10.232 9.106 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.962 -9.545 7.880 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.449 -8.308 9.063 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.791 -8.068 7.333 1.00 0.00 H new ATOM 1111 N VAL A 73 4.881 -9.492 6.033 1.00 0.00 N ATOM 1112 CA VAL A 73 5.315 -10.075 4.774 1.00 0.00 C ATOM 1113 C VAL A 73 6.527 -10.974 5.024 1.00 0.00 C ATOM 1114 O VAL A 73 6.546 -12.129 4.601 1.00 0.00 O ATOM 1115 CB VAL A 73 5.592 -8.969 3.754 1.00 0.00 C ATOM 1116 CG1 VAL A 73 4.692 -7.757 4.000 1.00 0.00 C ATOM 1117 CG2 VAL A 73 7.069 -8.567 3.768 1.00 0.00 C ATOM 0 H VAL A 73 4.895 -8.472 6.058 1.00 0.00 H new ATOM 0 HA VAL A 73 4.528 -10.700 4.351 1.00 0.00 H new ATOM 0 HB VAL A 73 5.361 -9.362 2.764 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.910 -6.986 3.261 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.647 -8.056 3.915 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.877 -7.364 5.000 1.00 0.00 H new ATOM 0 HG21 VAL A 73 7.239 -7.779 3.034 1.00 0.00 H new ATOM 0 HG22 VAL A 73 7.338 -8.203 4.760 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.684 -9.432 3.520 1.00 0.00 H new ATOM 1127 N ARG A 74 7.510 -10.411 5.711 1.00 0.00 N ATOM 1128 CA ARG A 74 8.722 -11.148 6.024 1.00 0.00 C ATOM 1129 C ARG A 74 8.388 -12.603 6.360 1.00 0.00 C ATOM 1130 O ARG A 74 9.194 -13.501 6.118 1.00 0.00 O ATOM 1131 CB ARG A 74 9.463 -10.517 7.205 1.00 0.00 C ATOM 1132 CG ARG A 74 9.821 -9.058 6.910 1.00 0.00 C ATOM 1133 CD ARG A 74 10.126 -8.857 5.425 1.00 0.00 C ATOM 1134 NE ARG A 74 11.284 -9.691 5.029 1.00 0.00 N ATOM 1135 CZ ARG A 74 12.552 -9.424 5.367 1.00 0.00 C ATOM 1136 NH1 ARG A 74 12.835 -8.345 6.110 1.00 0.00 N ATOM 1137 NH2 ARG A 74 13.538 -10.236 4.964 1.00 0.00 N ATOM 0 H ARG A 74 7.492 -9.453 6.060 1.00 0.00 H new ATOM 0 HA ARG A 74 9.366 -11.113 5.145 1.00 0.00 H new ATOM 0 HB2 ARG A 74 8.842 -10.569 8.099 1.00 0.00 H new ATOM 0 HB3 ARG A 74 10.371 -11.083 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 74 8.996 -8.410 7.206 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.686 -8.765 7.505 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.254 -9.123 4.827 1.00 0.00 H new ATOM 0 HD3 ARG A 74 10.339 -7.806 5.228 1.00 0.00 H new ATOM 0 HE ARG A 74 11.105 -10.521 4.463 1.00 0.00 H new ATOM 0 HH11 ARG A 74 12.084 -7.727 6.418 1.00 0.00 H new ATOM 0 HH12 ARG A 74 13.801 -8.142 6.367 1.00 0.00 H new ATOM 0 HH21 ARG A 74 13.323 -11.058 4.400 1.00 0.00 H new ATOM 0 HH22 ARG A 74 14.504 -10.032 5.222 1.00 0.00 H new ATOM 1151 N ALA A 75 7.199 -12.791 6.912 1.00 0.00 N ATOM 1152 CA ALA A 75 6.748 -14.122 7.284 1.00 0.00 C ATOM 1153 C ALA A 75 6.173 -14.823 6.051 1.00 0.00 C ATOM 1154 O ALA A 75 6.532 -15.963 5.758 1.00 0.00 O ATOM 1155 CB ALA A 75 5.731 -14.017 8.422 1.00 0.00 C ATOM 0 H ALA A 75 6.533 -12.044 7.111 1.00 0.00 H new ATOM 0 HA ALA A 75 7.582 -14.723 7.647 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.393 -15.015 8.701 1.00 0.00 H new ATOM 0 HB2 ALA A 75 6.197 -13.538 9.283 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.878 -13.423 8.094 1.00 0.00 H new ATOM 1161 N ASN A 76 5.291 -14.114 5.363 1.00 0.00 N ATOM 1162 CA ASN A 76 4.663 -14.654 4.170 1.00 0.00 C ATOM 1163 C ASN A 76 5.335 -14.057 2.931 1.00 0.00 C ATOM 1164 O ASN A 76 5.378 -12.839 2.771 1.00 0.00 O ATOM 1165 CB ASN A 76 3.177 -14.299 4.120 1.00 0.00 C ATOM 1166 CG ASN A 76 2.309 -15.556 4.200 1.00 0.00 C ATOM 1167 OD1 ASN A 76 2.790 -16.677 4.179 1.00 0.00 O ATOM 1168 ND2 ASN A 76 1.005 -15.308 4.295 1.00 0.00 N ATOM 0 H ASN A 76 4.996 -13.169 5.609 1.00 0.00 H new ATOM 0 HA ASN A 76 4.773 -15.738 4.193 1.00 0.00 H new ATOM 0 HB2 ASN A 76 2.931 -13.630 4.945 1.00 0.00 H new ATOM 0 HB3 ASN A 76 2.959 -13.761 3.198 1.00 0.00 H new ATOM 0 HD21 ASN A 76 0.342 -16.081 4.356 1.00 0.00 H new ATOM 0 HD22 ASN A 76 0.669 -14.345 4.307 1.00 0.00 H new ATOM 1175 N PRO A 77 5.854 -14.967 2.064 1.00 0.00 N ATOM 1176 CA PRO A 77 6.521 -14.543 0.845 1.00 0.00 C ATOM 1177 C PRO A 77 5.507 -14.075 -0.200 1.00 0.00 C ATOM 1178 O PRO A 77 5.879 -13.471 -1.205 1.00 0.00 O ATOM 1179 CB PRO A 77 7.323 -15.753 0.394 1.00 0.00 C ATOM 1180 CG PRO A 77 6.715 -16.948 1.112 1.00 0.00 C ATOM 1181 CD PRO A 77 5.821 -16.418 2.221 1.00 0.00 C ATOM 0 HA PRO A 77 7.174 -13.684 1.000 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.267 -15.877 -0.687 1.00 0.00 H new ATOM 0 HB3 PRO A 77 8.377 -15.640 0.648 1.00 0.00 H new ATOM 0 HG2 PRO A 77 6.140 -17.559 0.417 1.00 0.00 H new ATOM 0 HG3 PRO A 77 7.498 -17.585 1.524 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.805 -16.803 2.129 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.188 -16.718 3.203 1.00 0.00 H new ATOM 1189 N ALA A 78 4.244 -14.372 0.072 1.00 0.00 N ATOM 1190 CA ALA A 78 3.174 -13.990 -0.833 1.00 0.00 C ATOM 1191 C ALA A 78 3.075 -12.463 -0.882 1.00 0.00 C ATOM 1192 O ALA A 78 3.018 -11.876 -1.961 1.00 0.00 O ATOM 1193 CB ALA A 78 1.866 -14.644 -0.382 1.00 0.00 C ATOM 0 H ALA A 78 3.938 -14.873 0.906 1.00 0.00 H new ATOM 0 HA ALA A 78 3.383 -14.340 -1.844 1.00 0.00 H new ATOM 0 HB1 ALA A 78 1.063 -14.357 -1.061 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.979 -15.728 -0.391 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.623 -14.313 0.628 1.00 0.00 H new ATOM 1199 N THR A 79 3.057 -11.865 0.300 1.00 0.00 N ATOM 1200 CA THR A 79 2.967 -10.418 0.404 1.00 0.00 C ATOM 1201 C THR A 79 4.363 -9.793 0.372 1.00 0.00 C ATOM 1202 O THR A 79 4.514 -8.621 0.030 1.00 0.00 O ATOM 1203 CB THR A 79 2.181 -10.085 1.673 1.00 0.00 C ATOM 1204 OG1 THR A 79 2.655 -8.793 2.046 1.00 0.00 O ATOM 1205 CG2 THR A 79 2.567 -10.978 2.853 1.00 0.00 C ATOM 0 H THR A 79 3.103 -12.355 1.193 1.00 0.00 H new ATOM 0 HA THR A 79 2.436 -9.992 -0.447 1.00 0.00 H new ATOM 0 HB THR A 79 1.114 -10.186 1.475 1.00 0.00 H new ATOM 0 HG1 THR A 79 1.942 -8.303 2.506 1.00 0.00 H new ATOM 0 HG21 THR A 79 1.979 -10.699 3.728 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.370 -12.020 2.601 1.00 0.00 H new ATOM 0 HG23 THR A 79 3.627 -10.852 3.073 1.00 0.00 H new ATOM 1213 N LYS A 80 5.348 -10.602 0.732 1.00 0.00 N ATOM 1214 CA LYS A 80 6.726 -10.142 0.749 1.00 0.00 C ATOM 1215 C LYS A 80 7.108 -9.640 -0.644 1.00 0.00 C ATOM 1216 O LYS A 80 8.076 -8.895 -0.795 1.00 0.00 O ATOM 1217 CB LYS A 80 7.650 -11.239 1.283 1.00 0.00 C ATOM 1218 CG LYS A 80 8.381 -11.945 0.138 1.00 0.00 C ATOM 1219 CD LYS A 80 9.494 -11.061 -0.428 1.00 0.00 C ATOM 1220 CE LYS A 80 10.826 -11.814 -0.467 1.00 0.00 C ATOM 1221 NZ LYS A 80 11.706 -11.367 0.637 1.00 0.00 N ATOM 0 H LYS A 80 5.219 -11.574 1.014 1.00 0.00 H new ATOM 0 HA LYS A 80 6.839 -9.301 1.433 1.00 0.00 H new ATOM 0 HB2 LYS A 80 8.376 -10.805 1.970 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.068 -11.965 1.851 1.00 0.00 H new ATOM 0 HG2 LYS A 80 8.804 -12.884 0.495 1.00 0.00 H new ATOM 0 HG3 LYS A 80 7.672 -12.195 -0.652 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.228 -10.734 -1.433 1.00 0.00 H new ATOM 0 HD3 LYS A 80 9.597 -10.164 0.183 1.00 0.00 H new ATOM 0 HE2 LYS A 80 10.647 -12.886 -0.386 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.319 -11.644 -1.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.606 -11.887 0.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 11.891 -10.348 0.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 11.240 -11.551 1.548 1.00 0.00 H new ATOM 1235 N LYS A 81 6.330 -10.068 -1.626 1.00 0.00 N ATOM 1236 CA LYS A 81 6.575 -9.670 -3.003 1.00 0.00 C ATOM 1237 C LYS A 81 5.627 -8.529 -3.376 1.00 0.00 C ATOM 1238 O LYS A 81 5.730 -7.962 -4.463 1.00 0.00 O ATOM 1239 CB LYS A 81 6.478 -10.880 -3.935 1.00 0.00 C ATOM 1240 CG LYS A 81 5.067 -11.017 -4.509 1.00 0.00 C ATOM 1241 CD LYS A 81 4.906 -12.342 -5.258 1.00 0.00 C ATOM 1242 CE LYS A 81 3.621 -13.057 -4.840 1.00 0.00 C ATOM 1243 NZ LYS A 81 2.734 -13.258 -6.009 1.00 0.00 N ATOM 0 H LYS A 81 5.529 -10.686 -1.497 1.00 0.00 H new ATOM 0 HA LYS A 81 7.591 -9.290 -3.115 1.00 0.00 H new ATOM 0 HB2 LYS A 81 7.197 -10.776 -4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 81 6.742 -11.786 -3.390 1.00 0.00 H new ATOM 0 HG2 LYS A 81 4.335 -10.960 -3.703 1.00 0.00 H new ATOM 0 HG3 LYS A 81 4.863 -10.186 -5.184 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.890 -12.157 -6.332 1.00 0.00 H new ATOM 0 HD3 LYS A 81 5.764 -12.983 -5.058 1.00 0.00 H new ATOM 0 HE2 LYS A 81 3.864 -14.020 -4.391 1.00 0.00 H new ATOM 0 HE3 LYS A 81 3.103 -12.472 -4.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 1.866 -13.745 -5.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 2.488 -12.335 -6.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 3.224 -13.835 -6.722 1.00 0.00 H new ATOM 1257 N ALA A 82 4.726 -8.225 -2.453 1.00 0.00 N ATOM 1258 CA ALA A 82 3.761 -7.161 -2.672 1.00 0.00 C ATOM 1259 C ALA A 82 4.283 -5.868 -2.043 1.00 0.00 C ATOM 1260 O ALA A 82 5.065 -5.906 -1.094 1.00 0.00 O ATOM 1261 CB ALA A 82 2.403 -7.578 -2.102 1.00 0.00 C ATOM 0 H ALA A 82 4.644 -8.697 -1.552 1.00 0.00 H new ATOM 0 HA ALA A 82 3.626 -6.979 -3.738 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.679 -6.780 -2.266 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.062 -8.485 -2.601 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.499 -7.766 -1.033 1.00 0.00 H new ATOM 1267 N ALA A 83 3.831 -4.753 -2.598 1.00 0.00 N ATOM 1268 CA ALA A 83 4.243 -3.450 -2.105 1.00 0.00 C ATOM 1269 C ALA A 83 3.179 -2.915 -1.143 1.00 0.00 C ATOM 1270 O ALA A 83 2.106 -3.499 -1.011 1.00 0.00 O ATOM 1271 CB ALA A 83 4.488 -2.510 -3.286 1.00 0.00 C ATOM 0 H ALA A 83 3.183 -4.725 -3.385 1.00 0.00 H new ATOM 0 HA ALA A 83 5.179 -3.527 -1.552 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.797 -1.533 -2.915 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.272 -2.921 -3.922 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.570 -2.405 -3.864 1.00 0.00 H new ATOM 1277 N PHE A 84 3.516 -1.808 -0.497 1.00 0.00 N ATOM 1278 CA PHE A 84 2.604 -1.187 0.449 1.00 0.00 C ATOM 1279 C PHE A 84 2.813 0.328 0.499 1.00 0.00 C ATOM 1280 O PHE A 84 3.948 0.799 0.554 1.00 0.00 O ATOM 1281 CB PHE A 84 2.915 -1.778 1.825 1.00 0.00 C ATOM 1282 CG PHE A 84 3.786 -3.036 1.780 1.00 0.00 C ATOM 1283 CD1 PHE A 84 3.235 -4.232 1.442 1.00 0.00 C ATOM 1284 CD2 PHE A 84 5.110 -2.956 2.077 1.00 0.00 C ATOM 1285 CE1 PHE A 84 4.042 -5.399 1.400 1.00 0.00 C ATOM 1286 CE2 PHE A 84 5.918 -4.123 2.035 1.00 0.00 C ATOM 1287 CZ PHE A 84 5.367 -5.319 1.698 1.00 0.00 C ATOM 0 H PHE A 84 4.407 -1.325 -0.610 1.00 0.00 H new ATOM 0 HA PHE A 84 1.573 -1.375 0.149 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.417 -1.022 2.429 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.977 -2.016 2.327 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.183 -4.294 1.205 1.00 0.00 H new ATOM 0 HD2 PHE A 84 5.547 -2.005 2.345 1.00 0.00 H new ATOM 0 HE1 PHE A 84 3.605 -6.349 1.132 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.970 -4.060 2.271 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.982 -6.207 1.667 1.00 0.00 H new ATOM 1297 N ILE A 85 1.702 1.049 0.476 1.00 0.00 N ATOM 1298 CA ILE A 85 1.750 2.501 0.519 1.00 0.00 C ATOM 1299 C ILE A 85 1.161 2.987 1.844 1.00 0.00 C ATOM 1300 O ILE A 85 0.095 2.533 2.257 1.00 0.00 O ATOM 1301 CB ILE A 85 1.066 3.095 -0.714 1.00 0.00 C ATOM 1302 CG1 ILE A 85 1.622 2.480 -2.000 1.00 0.00 C ATOM 1303 CG2 ILE A 85 1.171 4.621 -0.717 1.00 0.00 C ATOM 1304 CD1 ILE A 85 1.247 3.325 -3.219 1.00 0.00 C ATOM 0 H ILE A 85 0.762 0.655 0.428 1.00 0.00 H new ATOM 0 HA ILE A 85 2.782 2.850 0.482 1.00 0.00 H new ATOM 0 HB ILE A 85 0.006 2.845 -0.670 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.707 2.399 -1.929 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.234 1.469 -2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.677 5.018 -1.604 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.690 5.021 0.176 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.221 4.913 -0.725 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.655 2.866 -4.120 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.162 3.384 -3.301 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.657 4.329 -3.106 1.00 0.00 H new ATOM 1316 N ILE A 86 1.880 3.905 2.472 1.00 0.00 N ATOM 1317 CA ILE A 86 1.442 4.459 3.743 1.00 0.00 C ATOM 1318 C ILE A 86 1.381 5.984 3.635 1.00 0.00 C ATOM 1319 O ILE A 86 2.414 6.646 3.552 1.00 0.00 O ATOM 1320 CB ILE A 86 2.332 3.959 4.881 1.00 0.00 C ATOM 1321 CG1 ILE A 86 3.228 2.810 4.412 1.00 0.00 C ATOM 1322 CG2 ILE A 86 1.495 3.570 6.101 1.00 0.00 C ATOM 1323 CD1 ILE A 86 4.479 2.700 5.285 1.00 0.00 C ATOM 0 H ILE A 86 2.763 4.280 2.125 1.00 0.00 H new ATOM 0 HA ILE A 86 0.436 4.115 3.982 1.00 0.00 H new ATOM 0 HB ILE A 86 2.987 4.775 5.186 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.672 1.873 4.447 1.00 0.00 H new ATOM 0 HG13 ILE A 86 3.518 2.970 3.374 1.00 0.00 H new ATOM 0 HG21 ILE A 86 2.152 3.218 6.896 1.00 0.00 H new ATOM 0 HG22 ILE A 86 0.936 4.438 6.450 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.800 2.777 5.827 1.00 0.00 H new ATOM 0 HD11 ILE A 86 5.099 1.876 4.931 1.00 0.00 H new ATOM 0 HD12 ILE A 86 5.045 3.630 5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.186 2.515 6.319 1.00 0.00 H new ATOM 1335 N LEU A 87 0.159 6.497 3.640 1.00 0.00 N ATOM 1336 CA LEU A 87 -0.050 7.932 3.544 1.00 0.00 C ATOM 1337 C LEU A 87 -0.789 8.420 4.792 1.00 0.00 C ATOM 1338 O LEU A 87 -1.394 7.625 5.510 1.00 0.00 O ATOM 1339 CB LEU A 87 -0.759 8.284 2.234 1.00 0.00 C ATOM 1340 CG LEU A 87 -2.279 8.430 2.311 1.00 0.00 C ATOM 1341 CD1 LEU A 87 -2.927 7.151 2.844 1.00 0.00 C ATOM 1342 CD2 LEU A 87 -2.671 9.657 3.137 1.00 0.00 C ATOM 0 H LEU A 87 -0.696 5.945 3.709 1.00 0.00 H new ATOM 0 HA LEU A 87 0.906 8.455 3.513 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.343 9.219 1.859 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.525 7.514 1.499 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.658 8.586 1.301 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.008 7.282 2.889 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.689 6.319 2.181 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.546 6.939 3.843 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.757 9.738 3.176 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -2.278 9.555 4.149 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.257 10.554 2.676 1.00 0.00 H new ATOM 1354 N THR A 88 -0.715 9.724 5.013 1.00 0.00 N ATOM 1355 CA THR A 88 -1.369 10.328 6.161 1.00 0.00 C ATOM 1356 C THR A 88 -2.071 11.625 5.755 1.00 0.00 C ATOM 1357 O THR A 88 -1.950 12.069 4.614 1.00 0.00 O ATOM 1358 CB THR A 88 -0.317 10.523 7.255 1.00 0.00 C ATOM 1359 OG1 THR A 88 -0.927 11.436 8.163 1.00 0.00 O ATOM 1360 CG2 THR A 88 0.920 11.270 6.751 1.00 0.00 C ATOM 0 H THR A 88 -0.211 10.380 4.416 1.00 0.00 H new ATOM 0 HA THR A 88 -2.153 9.681 6.555 1.00 0.00 H new ATOM 0 HB THR A 88 -0.019 9.552 7.650 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.314 11.617 8.906 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.635 11.382 7.566 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.380 10.706 5.940 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.627 12.255 6.388 1.00 0.00 H new ATOM 1368 N ALA A 89 -2.790 12.196 6.710 1.00 0.00 N ATOM 1369 CA ALA A 89 -3.512 13.433 6.466 1.00 0.00 C ATOM 1370 C ALA A 89 -2.517 14.533 6.090 1.00 0.00 C ATOM 1371 O ALA A 89 -2.908 15.580 5.577 1.00 0.00 O ATOM 1372 CB ALA A 89 -4.340 13.793 7.701 1.00 0.00 C ATOM 0 H ALA A 89 -2.888 11.825 7.655 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.204 13.316 5.632 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -4.882 14.721 7.518 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.051 12.993 7.909 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.678 13.922 8.558 1.00 0.00 H new ATOM 1378 N GLN A 90 -1.250 14.257 6.359 1.00 0.00 N ATOM 1379 CA GLN A 90 -0.196 15.211 6.055 1.00 0.00 C ATOM 1380 C GLN A 90 0.846 14.574 5.134 1.00 0.00 C ATOM 1381 O GLN A 90 0.743 14.675 3.912 1.00 0.00 O ATOM 1382 CB GLN A 90 0.455 15.735 7.337 1.00 0.00 C ATOM 1383 CG GLN A 90 -0.485 16.689 8.077 1.00 0.00 C ATOM 1384 CD GLN A 90 0.230 17.992 8.441 1.00 0.00 C ATOM 1385 OE1 GLN A 90 1.438 18.042 8.607 1.00 0.00 O ATOM 1386 NE2 GLN A 90 -0.579 19.040 8.554 1.00 0.00 N ATOM 0 H GLN A 90 -0.929 13.387 6.784 1.00 0.00 H new ATOM 0 HA GLN A 90 -0.640 16.061 5.537 1.00 0.00 H new ATOM 0 HB2 GLN A 90 0.715 14.898 7.986 1.00 0.00 H new ATOM 0 HB3 GLN A 90 1.384 16.250 7.093 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -1.352 16.908 7.453 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -0.857 16.209 8.982 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -1.581 18.929 8.402 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -0.198 19.955 8.793 1.00 0.00 H new ATOM 1395 N GLY A 91 1.825 13.933 5.753 1.00 0.00 N ATOM 1396 CA GLY A 91 2.885 13.279 5.003 1.00 0.00 C ATOM 1397 C GLY A 91 4.037 12.870 5.923 1.00 0.00 C ATOM 1398 O GLY A 91 4.463 13.649 6.775 1.00 0.00 O ATOM 0 H GLY A 91 1.908 13.852 6.766 1.00 0.00 H new ATOM 0 HA2 GLY A 91 2.488 12.398 4.498 1.00 0.00 H new ATOM 0 HA3 GLY A 91 3.255 13.951 4.228 1.00 0.00 H new ATOM 1402 N ASP A 92 4.508 11.648 5.722 1.00 0.00 N ATOM 1403 CA ASP A 92 5.601 11.125 6.523 1.00 0.00 C ATOM 1404 C ASP A 92 6.546 10.322 5.627 1.00 0.00 C ATOM 1405 O ASP A 92 6.501 9.093 5.616 1.00 0.00 O ATOM 1406 CB ASP A 92 5.083 10.195 7.620 1.00 0.00 C ATOM 1407 CG ASP A 92 4.086 10.830 8.590 1.00 0.00 C ATOM 1408 OD1 ASP A 92 3.867 12.053 8.459 1.00 0.00 O ATOM 1409 OD2 ASP A 92 3.565 10.077 9.441 1.00 0.00 O ATOM 0 H ASP A 92 4.152 11.005 5.015 1.00 0.00 H new ATOM 0 HA ASP A 92 6.118 11.969 6.981 1.00 0.00 H new ATOM 0 HB2 ASP A 92 4.610 9.332 7.150 1.00 0.00 H new ATOM 0 HB3 ASP A 92 5.934 9.822 8.190 1.00 0.00 H new ATOM 1414 N ARG A 93 7.378 11.049 4.896 1.00 0.00 N ATOM 1415 CA ARG A 93 8.332 10.418 4.000 1.00 0.00 C ATOM 1416 C ARG A 93 9.274 9.504 4.784 1.00 0.00 C ATOM 1417 O ARG A 93 9.668 8.445 4.295 1.00 0.00 O ATOM 1418 CB ARG A 93 9.156 11.465 3.248 1.00 0.00 C ATOM 1419 CG ARG A 93 8.363 12.054 2.080 1.00 0.00 C ATOM 1420 CD ARG A 93 8.865 13.455 1.726 1.00 0.00 C ATOM 1421 NE ARG A 93 7.940 14.475 2.270 1.00 0.00 N ATOM 1422 CZ ARG A 93 8.260 15.766 2.438 1.00 0.00 C ATOM 1423 NH1 ARG A 93 9.484 16.201 2.107 1.00 0.00 N ATOM 1424 NH2 ARG A 93 7.358 16.620 2.939 1.00 0.00 N ATOM 0 H ARG A 93 7.411 12.068 4.906 1.00 0.00 H new ATOM 0 HA ARG A 93 7.768 9.828 3.278 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.449 12.262 3.932 1.00 0.00 H new ATOM 0 HB3 ARG A 93 10.074 11.011 2.876 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.451 11.402 1.211 1.00 0.00 H new ATOM 0 HG3 ARG A 93 7.305 12.098 2.340 1.00 0.00 H new ATOM 0 HD2 ARG A 93 9.865 13.605 2.132 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.941 13.561 0.644 1.00 0.00 H new ATOM 0 HE ARG A 93 7.001 14.177 2.533 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.171 15.550 1.728 1.00 0.00 H new ATOM 0 HH12 ARG A 93 9.728 17.183 2.235 1.00 0.00 H new ATOM 0 HH21 ARG A 93 6.427 16.288 3.193 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.602 17.602 3.067 1.00 0.00 H new ATOM 1438 N ALA A 94 9.609 9.944 5.987 1.00 0.00 N ATOM 1439 CA ALA A 94 10.498 9.179 6.845 1.00 0.00 C ATOM 1440 C ALA A 94 9.813 7.870 7.244 1.00 0.00 C ATOM 1441 O ALA A 94 10.450 6.819 7.287 1.00 0.00 O ATOM 1442 CB ALA A 94 10.892 10.024 8.057 1.00 0.00 C ATOM 0 H ALA A 94 9.280 10.822 6.389 1.00 0.00 H new ATOM 0 HA ALA A 94 11.416 8.923 6.315 1.00 0.00 H new ATOM 0 HB1 ALA A 94 11.559 9.449 8.700 1.00 0.00 H new ATOM 0 HB2 ALA A 94 11.401 10.927 7.721 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.997 10.299 8.615 1.00 0.00 H new ATOM 1448 N LEU A 95 8.523 7.977 7.525 1.00 0.00 N ATOM 1449 CA LEU A 95 7.744 6.816 7.919 1.00 0.00 C ATOM 1450 C LEU A 95 7.800 5.768 6.806 1.00 0.00 C ATOM 1451 O LEU A 95 8.084 4.599 7.063 1.00 0.00 O ATOM 1452 CB LEU A 95 6.322 7.229 8.304 1.00 0.00 C ATOM 1453 CG LEU A 95 6.163 7.898 9.671 1.00 0.00 C ATOM 1454 CD1 LEU A 95 5.816 6.869 10.748 1.00 0.00 C ATOM 1455 CD2 LEU A 95 7.410 8.708 10.032 1.00 0.00 C ATOM 0 H LEU A 95 7.997 8.850 7.488 1.00 0.00 H new ATOM 0 HA LEU A 95 8.170 6.357 8.811 1.00 0.00 H new ATOM 0 HB2 LEU A 95 5.944 7.911 7.542 1.00 0.00 H new ATOM 0 HB3 LEU A 95 5.689 6.342 8.280 1.00 0.00 H new ATOM 0 HG LEU A 95 5.329 8.598 9.615 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.709 7.371 11.710 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.880 6.374 10.490 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.612 6.127 10.813 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.272 9.173 11.008 1.00 0.00 H new ATOM 0 HD22 LEU A 95 8.276 8.047 10.065 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.572 9.481 9.281 1.00 0.00 H new ATOM 1467 N VAL A 96 7.525 6.224 5.593 1.00 0.00 N ATOM 1468 CA VAL A 96 7.541 5.341 4.439 1.00 0.00 C ATOM 1469 C VAL A 96 8.958 4.800 4.236 1.00 0.00 C ATOM 1470 O VAL A 96 9.177 3.591 4.269 1.00 0.00 O ATOM 1471 CB VAL A 96 6.998 6.073 3.211 1.00 0.00 C ATOM 1472 CG1 VAL A 96 7.793 5.705 1.957 1.00 0.00 C ATOM 1473 CG2 VAL A 96 5.507 5.789 3.019 1.00 0.00 C ATOM 0 H VAL A 96 7.290 7.194 5.384 1.00 0.00 H new ATOM 0 HA VAL A 96 6.887 4.485 4.604 1.00 0.00 H new ATOM 0 HB VAL A 96 7.116 7.143 3.379 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.386 6.239 1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 96 8.838 5.982 2.095 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.722 4.631 1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 96 5.146 6.321 2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.355 4.718 2.883 1.00 0.00 H new ATOM 0 HG23 VAL A 96 4.957 6.125 3.898 1.00 0.00 H new ATOM 1483 N GLN A 97 9.884 5.725 4.028 1.00 0.00 N ATOM 1484 CA GLN A 97 11.275 5.357 3.818 1.00 0.00 C ATOM 1485 C GLN A 97 11.740 4.396 4.914 1.00 0.00 C ATOM 1486 O GLN A 97 12.639 3.586 4.693 1.00 0.00 O ATOM 1487 CB GLN A 97 12.168 6.598 3.760 1.00 0.00 C ATOM 1488 CG GLN A 97 11.854 7.443 2.525 1.00 0.00 C ATOM 1489 CD GLN A 97 13.117 7.703 1.702 1.00 0.00 C ATOM 1490 OE1 GLN A 97 13.515 8.832 1.467 1.00 0.00 O ATOM 1491 NE2 GLN A 97 13.724 6.597 1.280 1.00 0.00 N ATOM 0 H GLN A 97 9.699 6.728 4.000 1.00 0.00 H new ATOM 0 HA GLN A 97 11.356 4.848 2.858 1.00 0.00 H new ATOM 0 HB2 GLN A 97 12.024 7.196 4.660 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.215 6.296 3.742 1.00 0.00 H new ATOM 0 HG2 GLN A 97 11.113 6.932 1.909 1.00 0.00 H new ATOM 0 HG3 GLN A 97 11.414 8.392 2.832 1.00 0.00 H new ATOM 0 HE21 GLN A 97 13.337 5.682 1.513 1.00 0.00 H new ATOM 0 HE22 GLN A 97 14.576 6.664 0.724 1.00 0.00 H new ATOM 1500 N LYS A 98 11.109 4.518 6.072 1.00 0.00 N ATOM 1501 CA LYS A 98 11.447 3.671 7.203 1.00 0.00 C ATOM 1502 C LYS A 98 11.004 2.237 6.910 1.00 0.00 C ATOM 1503 O LYS A 98 11.778 1.296 7.083 1.00 0.00 O ATOM 1504 CB LYS A 98 10.863 4.244 8.495 1.00 0.00 C ATOM 1505 CG LYS A 98 11.925 5.015 9.283 1.00 0.00 C ATOM 1506 CD LYS A 98 11.284 6.099 10.150 1.00 0.00 C ATOM 1507 CE LYS A 98 11.251 5.677 11.622 1.00 0.00 C ATOM 1508 NZ LYS A 98 12.468 6.145 12.322 1.00 0.00 N ATOM 0 H LYS A 98 10.364 5.192 6.252 1.00 0.00 H new ATOM 0 HA LYS A 98 12.526 3.647 7.352 1.00 0.00 H new ATOM 0 HB2 LYS A 98 10.029 4.905 8.259 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.466 3.435 9.109 1.00 0.00 H new ATOM 0 HG2 LYS A 98 12.487 4.326 9.913 1.00 0.00 H new ATOM 0 HG3 LYS A 98 12.636 5.469 8.593 1.00 0.00 H new ATOM 0 HD2 LYS A 98 11.843 7.029 10.047 1.00 0.00 H new ATOM 0 HD3 LYS A 98 10.270 6.296 9.802 1.00 0.00 H new ATOM 0 HE2 LYS A 98 10.365 6.089 12.105 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.177 4.592 11.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 12.430 5.851 13.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 13.309 5.731 11.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 12.522 7.182 12.269 1.00 0.00 H new ATOM 1522 N ALA A 99 9.759 2.113 6.471 1.00 0.00 N ATOM 1523 CA ALA A 99 9.204 0.809 6.153 1.00 0.00 C ATOM 1524 C ALA A 99 10.096 0.118 5.118 1.00 0.00 C ATOM 1525 O ALA A 99 10.518 -1.020 5.319 1.00 0.00 O ATOM 1526 CB ALA A 99 7.764 0.973 5.664 1.00 0.00 C ATOM 0 H ALA A 99 9.120 2.895 6.328 1.00 0.00 H new ATOM 0 HA ALA A 99 9.177 0.176 7.040 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.347 -0.005 5.425 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.166 1.442 6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.752 1.600 4.772 1.00 0.00 H new ATOM 1532 N ALA A 100 10.356 0.836 4.036 1.00 0.00 N ATOM 1533 CA ALA A 100 11.189 0.306 2.970 1.00 0.00 C ATOM 1534 C ALA A 100 12.529 -0.147 3.554 1.00 0.00 C ATOM 1535 O ALA A 100 12.990 -1.252 3.274 1.00 0.00 O ATOM 1536 CB ALA A 100 11.357 1.364 1.878 1.00 0.00 C ATOM 0 H ALA A 100 10.005 1.780 3.874 1.00 0.00 H new ATOM 0 HA ALA A 100 10.718 -0.563 2.511 1.00 0.00 H new ATOM 0 HB1 ALA A 100 11.982 0.966 1.079 1.00 0.00 H new ATOM 0 HB2 ALA A 100 10.379 1.630 1.476 1.00 0.00 H new ATOM 0 HB3 ALA A 100 11.829 2.251 2.300 1.00 0.00 H new ATOM 1542 N ALA A 101 13.117 0.730 4.353 1.00 0.00 N ATOM 1543 CA ALA A 101 14.395 0.435 4.979 1.00 0.00 C ATOM 1544 C ALA A 101 14.228 -0.747 5.936 1.00 0.00 C ATOM 1545 O ALA A 101 15.053 -1.659 5.950 1.00 0.00 O ATOM 1546 CB ALA A 101 14.920 1.688 5.685 1.00 0.00 C ATOM 0 H ALA A 101 12.732 1.646 4.582 1.00 0.00 H new ATOM 0 HA ALA A 101 15.133 0.151 4.229 1.00 0.00 H new ATOM 0 HB1 ALA A 101 15.878 1.466 6.154 1.00 0.00 H new ATOM 0 HB2 ALA A 101 15.049 2.489 4.957 1.00 0.00 H new ATOM 0 HB3 ALA A 101 14.207 2.002 6.447 1.00 0.00 H new ATOM 1552 N LEU A 102 13.155 -0.692 6.711 1.00 0.00 N ATOM 1553 CA LEU A 102 12.870 -1.747 7.669 1.00 0.00 C ATOM 1554 C LEU A 102 13.154 -3.106 7.024 1.00 0.00 C ATOM 1555 O LEU A 102 13.894 -3.918 7.579 1.00 0.00 O ATOM 1556 CB LEU A 102 11.445 -1.610 8.210 1.00 0.00 C ATOM 1557 CG LEU A 102 11.177 -0.387 9.090 1.00 0.00 C ATOM 1558 CD1 LEU A 102 10.422 -0.782 10.360 1.00 0.00 C ATOM 1559 CD2 LEU A 102 12.477 0.358 9.403 1.00 0.00 C ATOM 0 H LEU A 102 12.473 0.066 6.695 1.00 0.00 H new ATOM 0 HA LEU A 102 13.525 -1.661 8.536 1.00 0.00 H new ATOM 0 HB2 LEU A 102 10.758 -1.582 7.365 1.00 0.00 H new ATOM 0 HB3 LEU A 102 11.208 -2.505 8.785 1.00 0.00 H new ATOM 0 HG LEU A 102 10.538 0.300 8.536 1.00 0.00 H new ATOM 0 HD11 LEU A 102 10.244 0.105 10.968 1.00 0.00 H new ATOM 0 HD12 LEU A 102 9.468 -1.235 10.090 1.00 0.00 H new ATOM 0 HD13 LEU A 102 11.015 -1.498 10.928 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.259 1.223 10.030 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.161 -0.308 9.929 1.00 0.00 H new ATOM 0 HD23 LEU A 102 12.939 0.691 8.473 1.00 0.00 H new ATOM 1571 N GLY A 103 12.552 -3.312 5.862 1.00 0.00 N ATOM 1572 CA GLY A 103 12.732 -4.557 5.137 1.00 0.00 C ATOM 1573 C GLY A 103 11.498 -4.882 4.292 1.00 0.00 C ATOM 1574 O GLY A 103 11.094 -6.040 4.197 1.00 0.00 O ATOM 0 H GLY A 103 11.939 -2.637 5.405 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.609 -4.484 4.494 1.00 0.00 H new ATOM 0 HA3 GLY A 103 12.919 -5.368 5.841 1.00 0.00 H new ATOM 1578 N ALA A 104 10.935 -3.840 3.700 1.00 0.00 N ATOM 1579 CA ALA A 104 9.756 -4.000 2.866 1.00 0.00 C ATOM 1580 C ALA A 104 10.184 -4.143 1.404 1.00 0.00 C ATOM 1581 O ALA A 104 11.275 -3.714 1.030 1.00 0.00 O ATOM 1582 CB ALA A 104 8.812 -2.815 3.083 1.00 0.00 C ATOM 0 H ALA A 104 11.273 -2.881 3.781 1.00 0.00 H new ATOM 0 HA ALA A 104 9.213 -4.905 3.140 1.00 0.00 H new ATOM 0 HB1 ALA A 104 7.928 -2.935 2.457 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.513 -2.775 4.130 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.322 -1.890 2.816 1.00 0.00 H new ATOM 1588 N ASN A 105 9.305 -4.746 0.619 1.00 0.00 N ATOM 1589 CA ASN A 105 9.578 -4.952 -0.793 1.00 0.00 C ATOM 1590 C ASN A 105 9.523 -3.606 -1.520 1.00 0.00 C ATOM 1591 O ASN A 105 10.430 -3.268 -2.278 1.00 0.00 O ATOM 1592 CB ASN A 105 8.538 -5.875 -1.428 1.00 0.00 C ATOM 1593 CG ASN A 105 9.019 -6.391 -2.786 1.00 0.00 C ATOM 1594 OD1 ASN A 105 10.165 -6.762 -2.968 1.00 0.00 O ATOM 1595 ND2 ASN A 105 8.078 -6.392 -3.727 1.00 0.00 N ATOM 0 H ASN A 105 8.402 -5.099 0.934 1.00 0.00 H new ATOM 0 HA ASN A 105 10.564 -5.407 -0.882 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.340 -6.717 -0.764 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.597 -5.338 -1.551 1.00 0.00 H new ATOM 0 HD21 ASN A 105 8.298 -6.717 -4.668 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.136 -6.067 -3.507 1.00 0.00 H new ATOM 1602 N ASN A 106 8.448 -2.875 -1.262 1.00 0.00 N ATOM 1603 CA ASN A 106 8.262 -1.574 -1.881 1.00 0.00 C ATOM 1604 C ASN A 106 7.162 -0.813 -1.139 1.00 0.00 C ATOM 1605 O ASN A 106 6.013 -1.250 -1.106 1.00 0.00 O ATOM 1606 CB ASN A 106 7.832 -1.717 -3.343 1.00 0.00 C ATOM 1607 CG ASN A 106 8.886 -2.474 -4.152 1.00 0.00 C ATOM 1608 OD1 ASN A 106 10.019 -2.045 -4.302 1.00 0.00 O ATOM 1609 ND2 ASN A 106 8.453 -3.623 -4.665 1.00 0.00 N ATOM 0 H ASN A 106 7.697 -3.159 -0.633 1.00 0.00 H new ATOM 0 HA ASN A 106 9.211 -1.039 -1.833 1.00 0.00 H new ATOM 0 HB2 ASN A 106 6.880 -2.245 -3.396 1.00 0.00 H new ATOM 0 HB3 ASN A 106 7.674 -0.730 -3.778 1.00 0.00 H new ATOM 0 HD21 ASN A 106 9.082 -4.202 -5.221 1.00 0.00 H new ATOM 0 HD22 ASN A 106 7.492 -3.925 -4.502 1.00 0.00 H new ATOM 1616 N VAL A 107 7.553 0.313 -0.559 1.00 0.00 N ATOM 1617 CA VAL A 107 6.615 1.139 0.181 1.00 0.00 C ATOM 1618 C VAL A 107 6.693 2.578 -0.332 1.00 0.00 C ATOM 1619 O VAL A 107 7.778 3.153 -0.417 1.00 0.00 O ATOM 1620 CB VAL A 107 6.889 1.024 1.682 1.00 0.00 C ATOM 1621 CG1 VAL A 107 8.319 1.452 2.013 1.00 0.00 C ATOM 1622 CG2 VAL A 107 5.873 1.837 2.488 1.00 0.00 C ATOM 0 H VAL A 107 8.507 0.672 -0.587 1.00 0.00 H new ATOM 0 HA VAL A 107 5.594 0.793 0.022 1.00 0.00 H new ATOM 0 HB VAL A 107 6.780 -0.023 1.963 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.487 1.361 3.086 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.023 0.813 1.480 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.468 2.488 1.709 1.00 0.00 H new ATOM 0 HG21 VAL A 107 6.090 1.738 3.552 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.937 2.886 2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.868 1.466 2.287 1.00 0.00 H new ATOM 1632 N LEU A 108 5.529 3.119 -0.662 1.00 0.00 N ATOM 1633 CA LEU A 108 5.452 4.480 -1.164 1.00 0.00 C ATOM 1634 C LEU A 108 4.556 5.310 -0.243 1.00 0.00 C ATOM 1635 O LEU A 108 3.600 4.791 0.331 1.00 0.00 O ATOM 1636 CB LEU A 108 5.004 4.486 -2.627 1.00 0.00 C ATOM 1637 CG LEU A 108 6.074 4.123 -3.658 1.00 0.00 C ATOM 1638 CD1 LEU A 108 7.408 4.793 -3.322 1.00 0.00 C ATOM 1639 CD2 LEU A 108 6.211 2.606 -3.795 1.00 0.00 C ATOM 0 H LEU A 108 4.632 2.639 -0.591 1.00 0.00 H new ATOM 0 HA LEU A 108 6.437 4.946 -1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.173 3.789 -2.735 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.621 5.478 -2.865 1.00 0.00 H new ATOM 0 HG LEU A 108 5.758 4.505 -4.629 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.152 4.519 -4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.280 5.875 -3.317 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.744 4.463 -2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.978 2.375 -4.534 1.00 0.00 H new ATOM 0 HD22 LEU A 108 6.493 2.178 -2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.259 2.182 -4.115 1.00 0.00 H new ATOM 1651 N ALA A 109 4.898 6.585 -0.129 1.00 0.00 N ATOM 1652 CA ALA A 109 4.136 7.491 0.713 1.00 0.00 C ATOM 1653 C ALA A 109 3.317 8.435 -0.171 1.00 0.00 C ATOM 1654 O ALA A 109 3.481 8.448 -1.390 1.00 0.00 O ATOM 1655 CB ALA A 109 5.088 8.245 1.644 1.00 0.00 C ATOM 0 H ALA A 109 5.692 7.012 -0.606 1.00 0.00 H new ATOM 0 HA ALA A 109 3.438 6.936 1.340 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.516 8.925 2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.625 7.532 2.270 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.802 8.816 1.050 1.00 0.00 H new ATOM 1661 N LYS A 110 2.453 9.201 0.478 1.00 0.00 N ATOM 1662 CA LYS A 110 1.608 10.145 -0.234 1.00 0.00 C ATOM 1663 C LYS A 110 1.617 11.487 0.503 1.00 0.00 C ATOM 1664 O LYS A 110 0.589 11.922 1.019 1.00 0.00 O ATOM 1665 CB LYS A 110 0.207 9.564 -0.434 1.00 0.00 C ATOM 1666 CG LYS A 110 -0.187 9.583 -1.914 1.00 0.00 C ATOM 1667 CD LYS A 110 -1.556 8.934 -2.124 1.00 0.00 C ATOM 1668 CE LYS A 110 -1.773 8.578 -3.597 1.00 0.00 C ATOM 1669 NZ LYS A 110 -2.822 9.438 -4.188 1.00 0.00 N ATOM 0 H LYS A 110 2.320 9.187 1.489 1.00 0.00 H new ATOM 0 HA LYS A 110 1.999 10.327 -1.235 1.00 0.00 H new ATOM 0 HB2 LYS A 110 0.176 8.541 -0.059 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.515 10.138 0.146 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.208 10.611 -2.275 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.564 9.054 -2.501 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -1.634 8.034 -1.513 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.340 9.614 -1.791 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.841 8.700 -4.148 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.060 7.530 -3.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.957 9.184 -5.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.715 9.301 -3.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.533 10.435 -4.120 1.00 0.00 H new ATOM 1683 N PRO A 111 2.819 12.120 0.528 1.00 0.00 N ATOM 1684 CA PRO A 111 2.976 13.403 1.192 1.00 0.00 C ATOM 1685 C PRO A 111 2.360 14.530 0.360 1.00 0.00 C ATOM 1686 O PRO A 111 1.529 14.280 -0.511 1.00 0.00 O ATOM 1687 CB PRO A 111 4.474 13.562 1.393 1.00 0.00 C ATOM 1688 CG PRO A 111 5.130 12.591 0.424 1.00 0.00 C ATOM 1689 CD PRO A 111 4.059 11.634 -0.073 1.00 0.00 C ATOM 0 HA PRO A 111 2.453 13.449 2.147 1.00 0.00 H new ATOM 0 HB2 PRO A 111 4.788 14.586 1.192 1.00 0.00 H new ATOM 0 HB3 PRO A 111 4.756 13.338 2.422 1.00 0.00 H new ATOM 0 HG2 PRO A 111 5.578 13.129 -0.411 1.00 0.00 H new ATOM 0 HG3 PRO A 111 5.933 12.043 0.917 1.00 0.00 H new ATOM 0 HD2 PRO A 111 3.999 11.637 -1.161 1.00 0.00 H new ATOM 0 HD3 PRO A 111 4.272 10.609 0.232 1.00 0.00 H new ATOM 1697 N PHE A 112 2.793 15.746 0.658 1.00 0.00 N ATOM 1698 CA PHE A 112 2.295 16.912 -0.052 1.00 0.00 C ATOM 1699 C PHE A 112 3.200 17.262 -1.235 1.00 0.00 C ATOM 1700 O PHE A 112 3.184 18.392 -1.721 1.00 0.00 O ATOM 1701 CB PHE A 112 2.302 18.076 0.940 1.00 0.00 C ATOM 1702 CG PHE A 112 0.939 18.361 1.576 1.00 0.00 C ATOM 1703 CD1 PHE A 112 0.398 17.472 2.450 1.00 0.00 C ATOM 1704 CD2 PHE A 112 0.270 19.504 1.265 1.00 0.00 C ATOM 1705 CE1 PHE A 112 -0.868 17.736 3.039 1.00 0.00 C ATOM 1706 CE2 PHE A 112 -0.995 19.768 1.854 1.00 0.00 C ATOM 1707 CZ PHE A 112 -1.537 18.879 2.729 1.00 0.00 C ATOM 0 H PHE A 112 3.483 15.949 1.381 1.00 0.00 H new ATOM 0 HA PHE A 112 1.296 16.713 -0.439 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.022 17.862 1.730 1.00 0.00 H new ATOM 0 HB3 PHE A 112 2.647 18.974 0.428 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.930 16.565 2.697 1.00 0.00 H new ATOM 0 HD2 PHE A 112 0.701 20.210 0.571 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.299 17.029 3.733 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -1.527 20.675 1.607 1.00 0.00 H new ATOM 0 HZ PHE A 112 -2.498 19.081 3.178 1.00 0.00 H new ATOM 1717 N THR A 113 3.967 16.270 -1.665 1.00 0.00 N ATOM 1718 CA THR A 113 4.876 16.458 -2.783 1.00 0.00 C ATOM 1719 C THR A 113 4.595 15.428 -3.879 1.00 0.00 C ATOM 1720 O THR A 113 5.089 14.304 -3.819 1.00 0.00 O ATOM 1721 CB THR A 113 6.307 16.398 -2.245 1.00 0.00 C ATOM 1722 OG1 THR A 113 7.087 16.015 -3.374 1.00 0.00 O ATOM 1723 CG2 THR A 113 6.509 15.253 -1.248 1.00 0.00 C ATOM 0 H THR A 113 3.977 15.334 -1.259 1.00 0.00 H new ATOM 0 HA THR A 113 4.730 17.432 -3.251 1.00 0.00 H new ATOM 0 HB THR A 113 6.555 17.346 -1.767 1.00 0.00 H new ATOM 0 HG1 THR A 113 8.030 15.953 -3.114 1.00 0.00 H new ATOM 0 HG21 THR A 113 7.541 15.254 -0.896 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.837 15.386 -0.400 1.00 0.00 H new ATOM 0 HG23 THR A 113 6.294 14.303 -1.737 1.00 0.00 H new ATOM 1731 N ILE A 114 3.802 15.849 -4.853 1.00 0.00 N ATOM 1732 CA ILE A 114 3.450 14.977 -5.961 1.00 0.00 C ATOM 1733 C ILE A 114 4.724 14.374 -6.555 1.00 0.00 C ATOM 1734 O ILE A 114 4.690 13.291 -7.138 1.00 0.00 O ATOM 1735 CB ILE A 114 2.589 15.726 -6.980 1.00 0.00 C ATOM 1736 CG1 ILE A 114 3.408 16.791 -7.712 1.00 0.00 C ATOM 1737 CG2 ILE A 114 1.343 16.317 -6.317 1.00 0.00 C ATOM 1738 CD1 ILE A 114 3.607 16.415 -9.182 1.00 0.00 C ATOM 0 H ILE A 114 3.393 16.782 -4.898 1.00 0.00 H new ATOM 0 HA ILE A 114 2.837 14.146 -5.612 1.00 0.00 H new ATOM 0 HB ILE A 114 2.247 15.011 -7.729 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.902 17.754 -7.645 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.378 16.906 -7.228 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.749 16.844 -7.064 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.748 15.515 -5.880 1.00 0.00 H new ATOM 0 HG23 ILE A 114 1.643 17.014 -5.534 1.00 0.00 H new ATOM 0 HD11 ILE A 114 4.192 17.189 -9.679 1.00 0.00 H new ATOM 0 HD12 ILE A 114 4.135 15.463 -9.246 1.00 0.00 H new ATOM 0 HD13 ILE A 114 2.636 16.325 -9.669 1.00 0.00 H new ATOM 1750 N GLU A 115 5.818 15.103 -6.389 1.00 0.00 N ATOM 1751 CA GLU A 115 7.101 14.654 -6.904 1.00 0.00 C ATOM 1752 C GLU A 115 7.521 13.351 -6.219 1.00 0.00 C ATOM 1753 O GLU A 115 8.016 12.435 -6.874 1.00 0.00 O ATOM 1754 CB GLU A 115 8.170 15.734 -6.727 1.00 0.00 C ATOM 1755 CG GLU A 115 8.105 16.761 -7.860 1.00 0.00 C ATOM 1756 CD GLU A 115 8.337 18.177 -7.331 1.00 0.00 C ATOM 1757 OE1 GLU A 115 9.293 18.339 -6.542 1.00 0.00 O ATOM 1758 OE2 GLU A 115 7.553 19.067 -7.729 1.00 0.00 O ATOM 0 H GLU A 115 5.843 16.001 -5.906 1.00 0.00 H new ATOM 0 HA GLU A 115 6.996 14.463 -7.972 1.00 0.00 H new ATOM 0 HB2 GLU A 115 8.031 16.235 -5.769 1.00 0.00 H new ATOM 0 HB3 GLU A 115 9.158 15.273 -6.705 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.855 16.523 -8.614 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.133 16.707 -8.349 1.00 0.00 H new ATOM 1765 N LYS A 116 7.306 13.311 -4.913 1.00 0.00 N ATOM 1766 CA LYS A 116 7.656 12.135 -4.133 1.00 0.00 C ATOM 1767 C LYS A 116 6.621 11.036 -4.385 1.00 0.00 C ATOM 1768 O LYS A 116 6.971 9.935 -4.806 1.00 0.00 O ATOM 1769 CB LYS A 116 7.819 12.500 -2.656 1.00 0.00 C ATOM 1770 CG LYS A 116 9.276 12.354 -2.213 1.00 0.00 C ATOM 1771 CD LYS A 116 9.606 10.897 -1.885 1.00 0.00 C ATOM 1772 CE LYS A 116 10.708 10.365 -2.803 1.00 0.00 C ATOM 1773 NZ LYS A 116 11.901 11.237 -2.740 1.00 0.00 N ATOM 0 H LYS A 116 6.894 14.073 -4.375 1.00 0.00 H new ATOM 0 HA LYS A 116 8.623 11.742 -4.448 1.00 0.00 H new ATOM 0 HB2 LYS A 116 7.486 13.525 -2.492 1.00 0.00 H new ATOM 0 HB3 LYS A 116 7.184 11.857 -2.047 1.00 0.00 H new ATOM 0 HG2 LYS A 116 9.937 12.712 -3.002 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.458 12.978 -1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 116 9.924 10.817 -0.845 1.00 0.00 H new ATOM 0 HD3 LYS A 116 8.711 10.284 -1.992 1.00 0.00 H new ATOM 0 HE2 LYS A 116 10.976 9.350 -2.509 1.00 0.00 H new ATOM 0 HE3 LYS A 116 10.342 10.313 -3.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 12.759 10.659 -2.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 11.859 11.939 -3.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 11.925 11.727 -1.823 1.00 0.00 H new ATOM 1787 N MET A 117 5.369 11.374 -4.116 1.00 0.00 N ATOM 1788 CA MET A 117 4.281 10.430 -4.307 1.00 0.00 C ATOM 1789 C MET A 117 4.275 9.883 -5.736 1.00 0.00 C ATOM 1790 O MET A 117 4.286 8.670 -5.941 1.00 0.00 O ATOM 1791 CB MET A 117 2.948 11.121 -4.018 1.00 0.00 C ATOM 1792 CG MET A 117 1.774 10.286 -4.534 1.00 0.00 C ATOM 1793 SD MET A 117 1.408 10.726 -6.225 1.00 0.00 S ATOM 1794 CE MET A 117 0.661 12.327 -5.974 1.00 0.00 C ATOM 0 H MET A 117 5.083 12.289 -3.767 1.00 0.00 H new ATOM 0 HA MET A 117 4.423 9.596 -3.620 1.00 0.00 H new ATOM 0 HB2 MET A 117 2.842 11.280 -2.945 1.00 0.00 H new ATOM 0 HB3 MET A 117 2.934 12.104 -4.489 1.00 0.00 H new ATOM 0 HG2 MET A 117 2.016 9.225 -4.470 1.00 0.00 H new ATOM 0 HG3 MET A 117 0.897 10.451 -3.909 1.00 0.00 H new ATOM 0 HE1 MET A 117 -0.406 12.269 -6.190 1.00 0.00 H new ATOM 0 HE2 MET A 117 0.805 12.637 -4.939 1.00 0.00 H new ATOM 0 HE3 MET A 117 1.127 13.054 -6.639 1.00 0.00 H new ATOM 1804 N LYS A 118 4.257 10.805 -6.688 1.00 0.00 N ATOM 1805 CA LYS A 118 4.249 10.431 -8.092 1.00 0.00 C ATOM 1806 C LYS A 118 5.479 9.573 -8.394 1.00 0.00 C ATOM 1807 O LYS A 118 5.352 8.435 -8.843 1.00 0.00 O ATOM 1808 CB LYS A 118 4.133 11.674 -8.977 1.00 0.00 C ATOM 1809 CG LYS A 118 3.747 11.294 -10.408 1.00 0.00 C ATOM 1810 CD LYS A 118 4.802 11.776 -11.406 1.00 0.00 C ATOM 1811 CE LYS A 118 4.784 13.300 -11.529 1.00 0.00 C ATOM 1812 NZ LYS A 118 5.423 13.725 -12.795 1.00 0.00 N ATOM 0 H LYS A 118 4.248 11.810 -6.514 1.00 0.00 H new ATOM 0 HA LYS A 118 3.373 9.824 -8.319 1.00 0.00 H new ATOM 0 HB2 LYS A 118 3.386 12.351 -8.563 1.00 0.00 H new ATOM 0 HB3 LYS A 118 5.082 12.211 -8.983 1.00 0.00 H new ATOM 0 HG2 LYS A 118 3.637 10.212 -10.484 1.00 0.00 H new ATOM 0 HG3 LYS A 118 2.780 11.731 -10.656 1.00 0.00 H new ATOM 0 HD2 LYS A 118 5.790 11.445 -11.085 1.00 0.00 H new ATOM 0 HD3 LYS A 118 4.617 11.327 -12.382 1.00 0.00 H new ATOM 0 HE2 LYS A 118 3.756 13.662 -11.494 1.00 0.00 H new ATOM 0 HE3 LYS A 118 5.307 13.745 -10.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 5.403 14.763 -12.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.409 13.396 -12.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 4.906 13.315 -13.599 1.00 0.00 H new ATOM 1826 N ALA A 119 6.642 10.153 -8.136 1.00 0.00 N ATOM 1827 CA ALA A 119 7.895 9.456 -8.374 1.00 0.00 C ATOM 1828 C ALA A 119 7.887 8.127 -7.617 1.00 0.00 C ATOM 1829 O ALA A 119 8.433 7.134 -8.094 1.00 0.00 O ATOM 1830 CB ALA A 119 9.065 10.354 -7.966 1.00 0.00 C ATOM 0 H ALA A 119 6.743 11.098 -7.765 1.00 0.00 H new ATOM 0 HA ALA A 119 8.013 9.230 -9.434 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.005 9.831 -8.145 1.00 0.00 H new ATOM 0 HB2 ALA A 119 9.042 11.271 -8.555 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.983 10.601 -6.907 1.00 0.00 H new ATOM 1836 N ALA A 120 7.261 8.153 -6.449 1.00 0.00 N ATOM 1837 CA ALA A 120 7.174 6.962 -5.621 1.00 0.00 C ATOM 1838 C ALA A 120 6.488 5.845 -6.410 1.00 0.00 C ATOM 1839 O ALA A 120 7.040 4.756 -6.559 1.00 0.00 O ATOM 1840 CB ALA A 120 6.438 7.295 -4.322 1.00 0.00 C ATOM 0 H ALA A 120 6.810 8.979 -6.057 1.00 0.00 H new ATOM 0 HA ALA A 120 8.170 6.610 -5.350 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.373 6.401 -3.701 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.982 8.071 -3.784 1.00 0.00 H new ATOM 0 HB3 ALA A 120 5.434 7.650 -4.554 1.00 0.00 H new ATOM 1846 N ILE A 121 5.295 6.155 -6.894 1.00 0.00 N ATOM 1847 CA ILE A 121 4.526 5.191 -7.665 1.00 0.00 C ATOM 1848 C ILE A 121 5.352 4.733 -8.869 1.00 0.00 C ATOM 1849 O ILE A 121 5.372 3.548 -9.198 1.00 0.00 O ATOM 1850 CB ILE A 121 3.161 5.770 -8.040 1.00 0.00 C ATOM 1851 CG1 ILE A 121 3.151 6.254 -9.491 1.00 0.00 C ATOM 1852 CG2 ILE A 121 2.748 6.874 -7.065 1.00 0.00 C ATOM 1853 CD1 ILE A 121 1.756 6.735 -9.900 1.00 0.00 C ATOM 0 H ILE A 121 4.841 7.060 -6.768 1.00 0.00 H new ATOM 0 HA ILE A 121 4.316 4.305 -7.066 1.00 0.00 H new ATOM 0 HB ILE A 121 2.419 4.976 -7.960 1.00 0.00 H new ATOM 0 HG12 ILE A 121 3.869 7.065 -9.612 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.468 5.446 -10.150 1.00 0.00 H new ATOM 0 HG21 ILE A 121 1.774 7.269 -7.354 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.689 6.465 -6.056 1.00 0.00 H new ATOM 0 HG23 ILE A 121 3.486 7.676 -7.089 1.00 0.00 H new ATOM 0 HD11 ILE A 121 1.777 7.074 -10.936 1.00 0.00 H new ATOM 0 HD12 ILE A 121 1.045 5.915 -9.801 1.00 0.00 H new ATOM 0 HD13 ILE A 121 1.452 7.559 -9.255 1.00 0.00 H new ATOM 1865 N GLU A 122 6.013 5.696 -9.493 1.00 0.00 N ATOM 1866 CA GLU A 122 6.838 5.407 -10.654 1.00 0.00 C ATOM 1867 C GLU A 122 7.885 4.345 -10.309 1.00 0.00 C ATOM 1868 O GLU A 122 8.431 3.695 -11.200 1.00 0.00 O ATOM 1869 CB GLU A 122 7.502 6.679 -11.185 1.00 0.00 C ATOM 1870 CG GLU A 122 6.457 7.661 -11.718 1.00 0.00 C ATOM 1871 CD GLU A 122 7.048 8.547 -12.817 1.00 0.00 C ATOM 1872 OE1 GLU A 122 8.099 9.165 -12.544 1.00 0.00 O ATOM 1873 OE2 GLU A 122 6.434 8.586 -13.906 1.00 0.00 O ATOM 0 H GLU A 122 5.994 6.678 -9.217 1.00 0.00 H new ATOM 0 HA GLU A 122 6.197 5.015 -11.443 1.00 0.00 H new ATOM 0 HB2 GLU A 122 8.078 7.152 -10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 122 8.204 6.423 -11.979 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.602 7.110 -12.110 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.088 8.284 -10.903 1.00 0.00 H new ATOM 1880 N ALA A 123 8.133 4.202 -9.016 1.00 0.00 N ATOM 1881 CA ALA A 123 9.105 3.230 -8.543 1.00 0.00 C ATOM 1882 C ALA A 123 8.409 1.885 -8.328 1.00 0.00 C ATOM 1883 O ALA A 123 8.893 0.851 -8.788 1.00 0.00 O ATOM 1884 CB ALA A 123 9.771 3.753 -7.269 1.00 0.00 C ATOM 0 H ALA A 123 7.678 4.743 -8.281 1.00 0.00 H new ATOM 0 HA ALA A 123 9.891 3.080 -9.283 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.500 3.024 -6.914 1.00 0.00 H new ATOM 0 HB2 ALA A 123 10.275 4.696 -7.482 1.00 0.00 H new ATOM 0 HB3 ALA A 123 9.014 3.912 -6.501 1.00 0.00 H new ATOM 1890 N VAL A 124 7.285 1.941 -7.630 1.00 0.00 N ATOM 1891 CA VAL A 124 6.518 0.739 -7.348 1.00 0.00 C ATOM 1892 C VAL A 124 6.083 0.096 -8.666 1.00 0.00 C ATOM 1893 O VAL A 124 5.964 -1.124 -8.756 1.00 0.00 O ATOM 1894 CB VAL A 124 5.343 1.072 -6.427 1.00 0.00 C ATOM 1895 CG1 VAL A 124 4.033 1.142 -7.214 1.00 0.00 C ATOM 1896 CG2 VAL A 124 5.240 0.062 -5.281 1.00 0.00 C ATOM 0 H VAL A 124 6.886 2.800 -7.251 1.00 0.00 H new ATOM 0 HA VAL A 124 7.131 0.010 -6.818 1.00 0.00 H new ATOM 0 HB VAL A 124 5.527 2.055 -5.992 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.213 1.380 -6.536 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.108 1.916 -7.978 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.842 0.180 -7.690 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.397 0.322 -4.641 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.091 -0.938 -5.689 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.159 0.081 -4.695 1.00 0.00 H new ATOM 1906 N PHE A 125 5.856 0.947 -9.655 1.00 0.00 N ATOM 1907 CA PHE A 125 5.435 0.479 -10.965 1.00 0.00 C ATOM 1908 C PHE A 125 6.644 0.163 -11.849 1.00 0.00 C ATOM 1909 O PHE A 125 6.500 -0.433 -12.915 1.00 0.00 O ATOM 1910 CB PHE A 125 4.630 1.609 -11.608 1.00 0.00 C ATOM 1911 CG PHE A 125 3.392 2.023 -10.809 1.00 0.00 C ATOM 1912 CD1 PHE A 125 2.910 1.211 -9.831 1.00 0.00 C ATOM 1913 CD2 PHE A 125 2.774 3.204 -11.078 1.00 0.00 C ATOM 1914 CE1 PHE A 125 1.762 1.595 -9.090 1.00 0.00 C ATOM 1915 CE2 PHE A 125 1.625 3.589 -10.337 1.00 0.00 C ATOM 1916 CZ PHE A 125 1.143 2.776 -9.359 1.00 0.00 C ATOM 0 H PHE A 125 5.956 1.959 -9.576 1.00 0.00 H new ATOM 0 HA PHE A 125 4.845 -0.432 -10.862 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.277 2.477 -11.732 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.319 1.298 -12.605 1.00 0.00 H new ATOM 0 HD1 PHE A 125 3.401 0.273 -9.618 1.00 0.00 H new ATOM 0 HD2 PHE A 125 3.157 3.849 -11.855 1.00 0.00 H new ATOM 0 HE1 PHE A 125 1.380 0.950 -8.313 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.134 4.527 -10.550 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.269 3.068 -8.796 1.00 0.00 H new