USER MOD reduce.3.24.130724 H: found=0, std=0, add=741, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 738 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 28 GLN : amide:sc= -0.169 K(o=-0.73,f=-2.4!) USER MOD Set 1.2: A 51 THR OG1 : rot -150:sc= -0.558 USER MOD Single : A 1 GLY N :NH3+ 150:sc= 0.0318 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0649 USER MOD Single : A 3 HIS : no HE2:sc= 0.925 K(o=0.92,f=-2.8!) USER MOD Single : A 11 MET CE :methyl -134:sc= 0 (180deg=-0.0792) USER MOD Single : A 13 LYS NZ :NH3+ -114:sc= 1.1 (180deg=-1.12) USER MOD Single : A 14 SER OG : rot 180:sc= 0.0634 USER MOD Single : A 19 ASN : amide:sc= -0.394 K(o=-0.39,f=-12!) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -157:sc= -2.08 (180deg=-3.83!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot -150:sc= -0.162 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0438 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 TYR OH : rot 167:sc= 0.00134 USER MOD Single : A 59 SER OG : rot -157:sc= 1.33 USER MOD Single : A 73 CYS SG : rot -86:sc= 0.0534 USER MOD Single : A 82 TYR OH : rot -163:sc= 1 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 98 MET CE :methyl -172:sc= -0.225 (180deg=-0.385) USER MOD Single : A 100 GLN : amide:sc= -0.512 K(o=-0.51,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.990 18.044 -6.882 1.00 0.00 N ATOM 2 CA GLY A 1 -13.324 17.024 -7.886 1.00 0.00 C ATOM 3 C GLY A 1 -13.868 15.797 -7.182 1.00 0.00 C ATOM 4 O GLY A 1 -13.299 15.402 -6.166 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.201 18.627 -7.228 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.819 18.649 -6.712 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.713 17.579 -5.994 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.062 17.414 -8.587 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.439 16.763 -8.467 1.00 0.00 H new ATOM 8 N SER A 2 -14.945 15.193 -7.683 1.00 0.00 N ATOM 9 CA SER A 2 -15.558 14.020 -7.064 1.00 0.00 C ATOM 10 C SER A 2 -14.562 12.857 -6.936 1.00 0.00 C ATOM 11 O SER A 2 -13.638 12.734 -7.753 1.00 0.00 O ATOM 12 CB SER A 2 -16.829 13.632 -7.836 1.00 0.00 C ATOM 13 OG SER A 2 -16.727 13.934 -9.217 1.00 0.00 O ATOM 0 H SER A 2 -15.417 15.505 -8.532 1.00 0.00 H new ATOM 0 HA SER A 2 -15.849 14.270 -6.044 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.017 12.566 -7.711 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.685 14.158 -7.413 1.00 0.00 H new ATOM 0 HG SER A 2 -17.554 13.670 -9.671 1.00 0.00 H new ATOM 19 N HIS A 3 -14.724 12.034 -5.900 1.00 0.00 N ATOM 20 CA HIS A 3 -13.966 10.831 -5.573 1.00 0.00 C ATOM 21 C HIS A 3 -14.475 10.292 -4.250 1.00 0.00 C ATOM 22 O HIS A 3 -15.036 11.035 -3.442 1.00 0.00 O ATOM 23 CB HIS A 3 -12.455 11.089 -5.434 1.00 0.00 C ATOM 24 CG HIS A 3 -12.059 12.083 -4.371 1.00 0.00 C ATOM 25 ND1 HIS A 3 -12.309 13.437 -4.374 1.00 0.00 N ATOM 26 CD2 HIS A 3 -11.369 11.792 -3.224 1.00 0.00 C ATOM 27 CE1 HIS A 3 -11.770 13.953 -3.262 1.00 0.00 C ATOM 28 NE2 HIS A 3 -11.200 12.988 -2.521 1.00 0.00 N ATOM 0 H HIS A 3 -15.453 12.210 -5.209 1.00 0.00 H new ATOM 0 HA HIS A 3 -14.106 10.125 -6.392 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -11.961 10.141 -5.222 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.075 11.439 -6.394 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -12.814 13.954 -5.094 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -11.020 10.817 -2.919 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -11.791 15.000 -2.997 1.00 0.00 H new ATOM 36 N GLU A 4 -14.206 9.014 -4.009 1.00 0.00 N ATOM 37 CA GLU A 4 -14.676 8.316 -2.830 1.00 0.00 C ATOM 38 C GLU A 4 -13.633 8.390 -1.707 1.00 0.00 C ATOM 39 O GLU A 4 -12.467 8.722 -1.950 1.00 0.00 O ATOM 40 CB GLU A 4 -15.031 6.889 -3.253 1.00 0.00 C ATOM 41 CG GLU A 4 -15.899 6.214 -2.195 1.00 0.00 C ATOM 42 CD GLU A 4 -16.673 5.050 -2.796 1.00 0.00 C ATOM 43 OE1 GLU A 4 -16.035 4.091 -3.289 1.00 0.00 O ATOM 44 OE2 GLU A 4 -17.917 5.122 -2.847 1.00 0.00 O ATOM 0 H GLU A 4 -13.650 8.432 -4.636 1.00 0.00 H new ATOM 0 HA GLU A 4 -15.570 8.782 -2.415 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.559 6.908 -4.206 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -14.119 6.312 -3.405 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.273 5.857 -1.377 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.594 6.939 -1.771 1.00 0.00 H new ATOM 51 N GLY A 5 -14.048 8.089 -0.479 1.00 0.00 N ATOM 52 CA GLY A 5 -13.275 8.287 0.738 1.00 0.00 C ATOM 53 C GLY A 5 -12.875 6.993 1.435 1.00 0.00 C ATOM 54 O GLY A 5 -12.502 7.068 2.600 1.00 0.00 O ATOM 0 H GLY A 5 -14.968 7.685 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -12.374 8.851 0.496 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.856 8.896 1.430 1.00 0.00 H new ATOM 58 N GLU A 6 -12.931 5.833 0.767 1.00 0.00 N ATOM 59 CA GLU A 6 -12.450 4.559 1.270 1.00 0.00 C ATOM 60 C GLU A 6 -11.057 4.275 0.662 1.00 0.00 C ATOM 61 O GLU A 6 -10.980 3.657 -0.410 1.00 0.00 O ATOM 62 CB GLU A 6 -13.473 3.457 0.939 1.00 0.00 C ATOM 63 CG GLU A 6 -14.521 3.216 2.042 1.00 0.00 C ATOM 64 CD GLU A 6 -14.645 1.745 2.432 1.00 0.00 C ATOM 65 OE1 GLU A 6 -13.672 1.173 2.984 1.00 0.00 O ATOM 66 OE2 GLU A 6 -15.705 1.128 2.211 1.00 0.00 O ATOM 0 H GLU A 6 -13.328 5.764 -0.170 1.00 0.00 H new ATOM 0 HA GLU A 6 -12.342 4.584 2.354 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -13.988 3.721 0.015 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -12.939 2.526 0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -14.254 3.799 2.923 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -15.490 3.579 1.701 1.00 0.00 H new ATOM 73 N PRO A 7 -9.950 4.765 1.253 1.00 0.00 N ATOM 74 CA PRO A 7 -8.595 4.465 0.810 1.00 0.00 C ATOM 75 C PRO A 7 -8.255 3.016 1.201 1.00 0.00 C ATOM 76 O PRO A 7 -7.548 2.769 2.185 1.00 0.00 O ATOM 77 CB PRO A 7 -7.713 5.508 1.513 1.00 0.00 C ATOM 78 CG PRO A 7 -8.434 5.679 2.848 1.00 0.00 C ATOM 79 CD PRO A 7 -9.893 5.616 2.428 1.00 0.00 C ATOM 0 HA PRO A 7 -8.452 4.525 -0.269 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -6.689 5.157 1.643 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -7.661 6.442 0.954 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -8.178 4.889 3.554 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -8.188 6.627 3.327 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.510 5.211 3.230 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.275 6.612 2.204 1.00 0.00 H new ATOM 87 N VAL A 8 -8.731 2.033 0.444 1.00 0.00 N ATOM 88 CA VAL A 8 -8.424 0.619 0.653 1.00 0.00 C ATOM 89 C VAL A 8 -8.273 -0.036 -0.711 1.00 0.00 C ATOM 90 O VAL A 8 -8.857 0.432 -1.695 1.00 0.00 O ATOM 91 CB VAL A 8 -9.515 -0.093 1.503 1.00 0.00 C ATOM 92 CG1 VAL A 8 -8.963 -1.385 2.129 1.00 0.00 C ATOM 93 CG2 VAL A 8 -10.107 0.767 2.631 1.00 0.00 C ATOM 0 H VAL A 8 -9.353 2.198 -0.347 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.496 0.529 1.217 1.00 0.00 H new ATOM 0 HB VAL A 8 -10.318 -0.304 0.796 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.743 -1.866 2.719 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.636 -2.061 1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.117 -1.145 2.773 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -10.859 0.191 3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.314 1.063 3.318 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -10.569 1.658 2.205 1.00 0.00 H new ATOM 103 N VAL A 9 -7.512 -1.130 -0.748 1.00 0.00 N ATOM 104 CA VAL A 9 -7.489 -2.050 -1.867 1.00 0.00 C ATOM 105 C VAL A 9 -8.828 -2.801 -1.931 1.00 0.00 C ATOM 106 O VAL A 9 -9.512 -2.993 -0.923 1.00 0.00 O ATOM 107 CB VAL A 9 -6.249 -2.965 -1.736 1.00 0.00 C ATOM 108 CG1 VAL A 9 -6.287 -3.926 -0.540 1.00 0.00 C ATOM 109 CG2 VAL A 9 -5.963 -3.748 -3.028 1.00 0.00 C ATOM 0 H VAL A 9 -6.888 -1.399 0.013 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.389 -1.530 -2.820 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.430 -2.270 -1.550 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.378 -4.528 -0.528 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.356 -3.353 0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -7.154 -4.581 -0.627 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.083 -4.376 -2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.821 -4.375 -3.271 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.782 -3.049 -3.844 1.00 0.00 H new ATOM 119 N GLY A 10 -9.185 -3.275 -3.117 1.00 0.00 N ATOM 120 CA GLY A 10 -10.348 -4.100 -3.380 1.00 0.00 C ATOM 121 C GLY A 10 -10.065 -4.871 -4.651 1.00 0.00 C ATOM 122 O GLY A 10 -9.792 -6.067 -4.588 1.00 0.00 O ATOM 0 H GLY A 10 -8.643 -3.083 -3.960 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.534 -4.781 -2.549 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -11.240 -3.484 -3.493 1.00 0.00 H new ATOM 126 N MET A 11 -10.045 -4.179 -5.787 1.00 0.00 N ATOM 127 CA MET A 11 -9.577 -4.685 -7.073 1.00 0.00 C ATOM 128 C MET A 11 -8.930 -3.549 -7.863 1.00 0.00 C ATOM 129 O MET A 11 -7.808 -3.698 -8.361 1.00 0.00 O ATOM 130 CB MET A 11 -10.735 -5.286 -7.892 1.00 0.00 C ATOM 131 CG MET A 11 -11.333 -6.546 -7.258 1.00 0.00 C ATOM 132 SD MET A 11 -12.164 -7.678 -8.409 1.00 0.00 S ATOM 133 CE MET A 11 -10.707 -8.395 -9.221 1.00 0.00 C ATOM 0 H MET A 11 -10.367 -3.213 -5.838 1.00 0.00 H new ATOM 0 HA MET A 11 -8.847 -5.473 -6.885 1.00 0.00 H new ATOM 0 HB2 MET A 11 -11.519 -4.537 -8.005 1.00 0.00 H new ATOM 0 HB3 MET A 11 -10.377 -5.526 -8.893 1.00 0.00 H new ATOM 0 HG2 MET A 11 -10.536 -7.090 -6.751 1.00 0.00 H new ATOM 0 HG3 MET A 11 -12.048 -6.243 -6.493 1.00 0.00 H new ATOM 0 HE1 MET A 11 -10.862 -8.409 -10.300 1.00 0.00 H new ATOM 0 HE2 MET A 11 -9.828 -7.794 -8.988 1.00 0.00 H new ATOM 0 HE3 MET A 11 -10.555 -9.413 -8.863 1.00 0.00 H new ATOM 143 N ASP A 12 -9.644 -2.430 -8.008 1.00 0.00 N ATOM 144 CA ASP A 12 -9.272 -1.351 -8.911 1.00 0.00 C ATOM 145 C ASP A 12 -8.280 -0.423 -8.221 1.00 0.00 C ATOM 146 O ASP A 12 -8.588 0.189 -7.197 1.00 0.00 O ATOM 147 CB ASP A 12 -10.517 -0.586 -9.372 1.00 0.00 C ATOM 148 CG ASP A 12 -10.222 0.343 -10.549 1.00 0.00 C ATOM 149 OD1 ASP A 12 -9.125 0.249 -11.162 1.00 0.00 O ATOM 150 OD2 ASP A 12 -11.130 1.126 -10.911 1.00 0.00 O ATOM 0 H ASP A 12 -10.506 -2.251 -7.493 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.794 -1.771 -9.796 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.293 -1.297 -9.658 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -10.911 -0.002 -8.540 1.00 0.00 H new ATOM 155 N LYS A 13 -7.041 -0.367 -8.707 1.00 0.00 N ATOM 156 CA LYS A 13 -5.927 0.265 -8.002 1.00 0.00 C ATOM 157 C LYS A 13 -5.916 1.787 -8.006 1.00 0.00 C ATOM 158 O LYS A 13 -4.986 2.377 -7.465 1.00 0.00 O ATOM 159 CB LYS A 13 -4.591 -0.339 -8.477 1.00 0.00 C ATOM 160 CG LYS A 13 -4.242 -1.673 -7.799 1.00 0.00 C ATOM 161 CD LYS A 13 -4.095 -1.535 -6.279 1.00 0.00 C ATOM 162 CE LYS A 13 -3.564 -2.795 -5.619 1.00 0.00 C ATOM 163 NZ LYS A 13 -2.196 -3.137 -6.059 1.00 0.00 N ATOM 0 H LYS A 13 -6.780 -0.763 -9.610 1.00 0.00 H new ATOM 0 HA LYS A 13 -6.076 0.031 -6.948 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -4.633 -0.490 -9.556 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -3.791 0.376 -8.286 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -5.019 -2.405 -8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -3.312 -2.058 -8.218 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -3.424 -0.705 -6.058 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -5.064 -1.285 -5.847 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -3.571 -2.664 -4.537 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -4.232 -3.627 -5.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -2.216 -4.030 -6.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -1.827 -2.378 -6.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -1.581 -3.244 -5.228 1.00 0.00 H new ATOM 177 N SER A 14 -6.955 2.437 -8.507 1.00 0.00 N ATOM 178 CA SER A 14 -6.970 3.877 -8.664 1.00 0.00 C ATOM 179 C SER A 14 -7.417 4.661 -7.422 1.00 0.00 C ATOM 180 O SER A 14 -7.576 5.881 -7.499 1.00 0.00 O ATOM 181 CB SER A 14 -7.832 4.177 -9.892 1.00 0.00 C ATOM 182 OG SER A 14 -8.991 3.369 -9.954 1.00 0.00 O ATOM 0 H SER A 14 -7.811 1.977 -8.816 1.00 0.00 H new ATOM 0 HA SER A 14 -5.947 4.225 -8.803 1.00 0.00 H new ATOM 0 HB2 SER A 14 -8.126 5.227 -9.877 1.00 0.00 H new ATOM 0 HB3 SER A 14 -7.239 4.025 -10.794 1.00 0.00 H new ATOM 0 HG SER A 14 -9.508 3.599 -10.754 1.00 0.00 H new ATOM 188 N LEU A 15 -7.651 3.992 -6.287 1.00 0.00 N ATOM 189 CA LEU A 15 -8.475 4.502 -5.191 1.00 0.00 C ATOM 190 C LEU A 15 -7.667 5.000 -3.984 1.00 0.00 C ATOM 191 O LEU A 15 -8.257 5.323 -2.951 1.00 0.00 O ATOM 192 CB LEU A 15 -9.448 3.386 -4.760 1.00 0.00 C ATOM 193 CG LEU A 15 -10.415 2.914 -5.867 1.00 0.00 C ATOM 194 CD1 LEU A 15 -11.202 1.705 -5.364 1.00 0.00 C ATOM 195 CD2 LEU A 15 -11.388 4.010 -6.311 1.00 0.00 C ATOM 0 H LEU A 15 -7.265 3.066 -6.104 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.011 5.376 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -8.868 2.531 -4.413 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.033 3.740 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 15 -9.813 2.650 -6.736 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -11.887 1.367 -6.142 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -10.511 0.900 -5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.770 1.984 -4.477 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -12.043 3.621 -7.091 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -11.988 4.331 -5.459 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -10.826 4.860 -6.700 1.00 0.00 H new ATOM 207 N PHE A 16 -6.334 5.028 -4.055 1.00 0.00 N ATOM 208 CA PHE A 16 -5.501 5.189 -2.867 1.00 0.00 C ATOM 209 C PHE A 16 -5.320 6.663 -2.539 1.00 0.00 C ATOM 210 O PHE A 16 -5.651 7.076 -1.423 1.00 0.00 O ATOM 211 CB PHE A 16 -4.151 4.466 -3.019 1.00 0.00 C ATOM 212 CG PHE A 16 -4.317 2.967 -3.073 1.00 0.00 C ATOM 213 CD1 PHE A 16 -4.894 2.368 -4.201 1.00 0.00 C ATOM 214 CD2 PHE A 16 -4.005 2.184 -1.951 1.00 0.00 C ATOM 215 CE1 PHE A 16 -5.211 1.007 -4.187 1.00 0.00 C ATOM 216 CE2 PHE A 16 -4.264 0.802 -1.961 1.00 0.00 C ATOM 217 CZ PHE A 16 -4.871 0.215 -3.082 1.00 0.00 C ATOM 0 H PHE A 16 -5.810 4.941 -4.926 1.00 0.00 H new ATOM 0 HA PHE A 16 -6.014 4.720 -2.027 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.656 4.809 -3.927 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.502 4.729 -2.184 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -5.094 2.959 -5.082 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -3.565 2.644 -1.078 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.720 0.564 -5.031 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -3.997 0.194 -1.109 1.00 0.00 H new ATOM 0 HZ PHE A 16 -5.076 -0.845 -3.093 1.00 0.00 H new ATOM 227 N ALA A 17 -4.793 7.420 -3.502 1.00 0.00 N ATOM 228 CA ALA A 17 -4.335 8.791 -3.409 1.00 0.00 C ATOM 229 C ALA A 17 -5.517 9.742 -3.195 1.00 0.00 C ATOM 230 O ALA A 17 -6.044 10.331 -4.145 1.00 0.00 O ATOM 231 CB ALA A 17 -3.522 9.163 -4.657 1.00 0.00 C ATOM 0 H ALA A 17 -4.669 7.050 -4.444 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.680 8.889 -2.543 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.183 10.196 -4.576 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.658 8.503 -4.739 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.147 9.055 -5.544 1.00 0.00 H new ATOM 237 N GLY A 18 -5.926 9.920 -1.947 1.00 0.00 N ATOM 238 CA GLY A 18 -6.965 10.858 -1.548 1.00 0.00 C ATOM 239 C GLY A 18 -7.049 11.044 -0.038 1.00 0.00 C ATOM 240 O GLY A 18 -7.596 12.054 0.402 1.00 0.00 O ATOM 0 H GLY A 18 -5.533 9.401 -1.162 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -6.776 11.823 -2.018 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.927 10.506 -1.920 1.00 0.00 H new ATOM 244 N ASN A 19 -6.483 10.137 0.768 1.00 0.00 N ATOM 245 CA ASN A 19 -6.435 10.289 2.230 1.00 0.00 C ATOM 246 C ASN A 19 -4.990 10.510 2.709 1.00 0.00 C ATOM 247 O ASN A 19 -4.159 9.616 2.567 1.00 0.00 O ATOM 248 CB ASN A 19 -7.105 9.080 2.902 1.00 0.00 C ATOM 249 CG ASN A 19 -7.279 9.289 4.406 1.00 0.00 C ATOM 250 OD1 ASN A 19 -6.507 10.006 5.024 1.00 0.00 O ATOM 251 ND2 ASN A 19 -8.273 8.701 5.044 1.00 0.00 N ATOM 0 H ASN A 19 -6.047 9.280 0.428 1.00 0.00 H new ATOM 0 HA ASN A 19 -6.995 11.177 2.522 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -8.079 8.904 2.445 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -6.504 8.188 2.726 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -8.393 8.847 6.046 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -8.922 8.101 4.535 1.00 0.00 H new ATOM 258 N THR A 20 -4.649 11.672 3.273 1.00 0.00 N ATOM 259 CA THR A 20 -3.301 11.970 3.780 1.00 0.00 C ATOM 260 C THR A 20 -2.945 11.243 5.093 1.00 0.00 C ATOM 261 O THR A 20 -1.859 11.472 5.613 1.00 0.00 O ATOM 262 CB THR A 20 -3.121 13.493 3.981 1.00 0.00 C ATOM 263 OG1 THR A 20 -4.112 14.041 4.836 1.00 0.00 O ATOM 264 CG2 THR A 20 -3.118 14.274 2.671 1.00 0.00 C ATOM 0 H THR A 20 -5.306 12.443 3.393 1.00 0.00 H new ATOM 0 HA THR A 20 -2.618 11.597 3.017 1.00 0.00 H new ATOM 0 HB THR A 20 -2.141 13.597 4.447 1.00 0.00 H new ATOM 0 HG1 THR A 20 -3.960 15.004 4.937 1.00 0.00 H new ATOM 0 HG21 THR A 20 -2.988 15.336 2.881 1.00 0.00 H new ATOM 0 HG22 THR A 20 -2.299 13.926 2.042 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.065 14.120 2.153 1.00 0.00 H new ATOM 272 N VAL A 21 -3.834 10.435 5.679 1.00 0.00 N ATOM 273 CA VAL A 21 -3.893 10.145 7.121 1.00 0.00 C ATOM 274 C VAL A 21 -3.880 8.628 7.374 1.00 0.00 C ATOM 275 O VAL A 21 -3.753 8.183 8.519 1.00 0.00 O ATOM 276 CB VAL A 21 -5.157 10.811 7.740 1.00 0.00 C ATOM 277 CG1 VAL A 21 -5.102 10.913 9.273 1.00 0.00 C ATOM 278 CG2 VAL A 21 -5.422 12.242 7.233 1.00 0.00 C ATOM 0 H VAL A 21 -4.557 9.948 5.149 1.00 0.00 H new ATOM 0 HA VAL A 21 -3.010 10.563 7.604 1.00 0.00 H new ATOM 0 HB VAL A 21 -5.955 10.141 7.420 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.013 11.386 9.639 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -5.015 9.914 9.701 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -4.239 11.511 9.567 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -6.319 12.637 7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.571 12.878 7.477 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -5.564 12.225 6.152 1.00 0.00 H new ATOM 288 N ILE A 22 -4.004 7.830 6.312 1.00 0.00 N ATOM 289 CA ILE A 22 -3.912 6.391 6.276 1.00 0.00 C ATOM 290 C ILE A 22 -2.490 5.999 6.646 1.00 0.00 C ATOM 291 O ILE A 22 -1.595 6.048 5.805 1.00 0.00 O ATOM 292 CB ILE A 22 -4.357 5.885 4.886 1.00 0.00 C ATOM 293 CG1 ILE A 22 -4.179 4.359 4.829 1.00 0.00 C ATOM 294 CG2 ILE A 22 -3.666 6.552 3.673 1.00 0.00 C ATOM 295 CD1 ILE A 22 -4.816 3.772 3.579 1.00 0.00 C ATOM 0 H ILE A 22 -4.186 8.217 5.386 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.579 5.920 6.998 1.00 0.00 H new ATOM 0 HB ILE A 22 -5.404 6.173 4.789 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -3.117 4.114 4.847 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.626 3.906 5.714 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -4.054 6.121 2.750 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.865 7.624 3.685 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.591 6.382 3.728 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.672 2.692 3.570 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -5.883 3.996 3.575 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.351 4.207 2.695 1.00 0.00 H new ATOM 307 N ARG A 23 -2.274 5.614 7.902 1.00 0.00 N ATOM 308 CA ARG A 23 -0.947 5.179 8.317 1.00 0.00 C ATOM 309 C ARG A 23 -0.725 3.703 8.035 1.00 0.00 C ATOM 310 O ARG A 23 0.410 3.264 8.145 1.00 0.00 O ATOM 311 CB ARG A 23 -0.658 5.521 9.784 1.00 0.00 C ATOM 312 CG ARG A 23 -0.889 7.009 10.091 1.00 0.00 C ATOM 313 CD ARG A 23 0.206 7.620 10.971 1.00 0.00 C ATOM 314 NE ARG A 23 -0.052 9.053 11.129 1.00 0.00 N ATOM 315 CZ ARG A 23 0.816 10.032 11.377 1.00 0.00 C ATOM 316 NH1 ARG A 23 2.087 9.800 11.664 1.00 0.00 N ATOM 317 NH2 ARG A 23 0.388 11.286 11.317 1.00 0.00 N ATOM 0 H ARG A 23 -2.984 5.595 8.634 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.232 5.738 7.714 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.296 4.916 10.428 1.00 0.00 H new ATOM 0 HB3 ARG A 23 0.374 5.259 10.020 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.944 7.563 9.154 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -1.852 7.126 10.587 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.222 7.131 11.945 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.185 7.462 10.518 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.027 9.339 11.037 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.435 8.842 11.702 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.719 10.579 11.848 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -0.586 11.482 11.085 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.033 12.054 11.503 1.00 0.00 H new ATOM 331 N GLU A 24 -1.758 2.948 7.661 1.00 0.00 N ATOM 332 CA GLU A 24 -1.693 1.492 7.514 1.00 0.00 C ATOM 333 C GLU A 24 -2.516 1.083 6.299 1.00 0.00 C ATOM 334 O GLU A 24 -3.662 1.523 6.179 1.00 0.00 O ATOM 335 CB GLU A 24 -2.290 0.780 8.751 1.00 0.00 C ATOM 336 CG GLU A 24 -1.273 0.439 9.844 1.00 0.00 C ATOM 337 CD GLU A 24 -1.936 -0.271 11.030 1.00 0.00 C ATOM 338 OE1 GLU A 24 -2.657 0.406 11.799 1.00 0.00 O ATOM 339 OE2 GLU A 24 -1.728 -1.494 11.219 1.00 0.00 O ATOM 0 H GLU A 24 -2.677 3.335 7.448 1.00 0.00 H new ATOM 0 HA GLU A 24 -0.647 1.206 7.404 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.065 1.415 9.180 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -2.775 -0.140 8.425 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -0.491 -0.197 9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -0.790 1.353 10.190 1.00 0.00 H new ATOM 346 N ILE A 25 -1.968 0.193 5.466 1.00 0.00 N ATOM 347 CA ILE A 25 -2.682 -0.498 4.393 1.00 0.00 C ATOM 348 C ILE A 25 -2.319 -1.975 4.531 1.00 0.00 C ATOM 349 O ILE A 25 -1.133 -2.309 4.502 1.00 0.00 O ATOM 350 CB ILE A 25 -2.294 0.012 2.978 1.00 0.00 C ATOM 351 CG1 ILE A 25 -1.915 1.507 2.960 1.00 0.00 C ATOM 352 CG2 ILE A 25 -3.413 -0.338 1.985 1.00 0.00 C ATOM 353 CD1 ILE A 25 -1.817 2.175 1.583 1.00 0.00 C ATOM 0 H ILE A 25 -0.985 -0.073 5.523 1.00 0.00 H new ATOM 0 HA ILE A 25 -3.752 -0.316 4.488 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.385 -0.501 2.664 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.651 2.052 3.551 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.955 1.621 3.463 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.143 0.019 0.991 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.550 -1.419 1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -4.342 0.137 2.301 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.544 3.223 1.706 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -1.057 1.670 0.987 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.780 2.108 1.077 1.00 0.00 H new ATOM 365 N THR A 26 -3.297 -2.859 4.691 1.00 0.00 N ATOM 366 CA THR A 26 -3.092 -4.280 4.417 1.00 0.00 C ATOM 367 C THR A 26 -3.272 -4.491 2.906 1.00 0.00 C ATOM 368 O THR A 26 -4.168 -3.890 2.309 1.00 0.00 O ATOM 369 CB THR A 26 -4.111 -5.113 5.211 1.00 0.00 C ATOM 370 OG1 THR A 26 -4.141 -4.708 6.566 1.00 0.00 O ATOM 371 CG2 THR A 26 -3.774 -6.608 5.186 1.00 0.00 C ATOM 0 H THR A 26 -4.237 -2.620 5.008 1.00 0.00 H new ATOM 0 HA THR A 26 -2.094 -4.598 4.720 1.00 0.00 H new ATOM 0 HB THR A 26 -5.077 -4.948 4.734 1.00 0.00 H new ATOM 0 HG1 THR A 26 -4.797 -5.248 7.055 1.00 0.00 H new ATOM 0 HG21 THR A 26 -4.520 -7.159 5.759 1.00 0.00 H new ATOM 0 HG22 THR A 26 -3.773 -6.964 4.156 1.00 0.00 H new ATOM 0 HG23 THR A 26 -2.789 -6.766 5.625 1.00 0.00 H new ATOM 379 N VAL A 27 -2.463 -5.346 2.278 1.00 0.00 N ATOM 380 CA VAL A 27 -2.570 -5.686 0.863 1.00 0.00 C ATOM 381 C VAL A 27 -2.345 -7.187 0.711 1.00 0.00 C ATOM 382 O VAL A 27 -1.497 -7.761 1.393 1.00 0.00 O ATOM 383 CB VAL A 27 -1.545 -4.902 0.010 1.00 0.00 C ATOM 384 CG1 VAL A 27 -2.031 -4.773 -1.443 1.00 0.00 C ATOM 385 CG2 VAL A 27 -1.225 -3.494 0.522 1.00 0.00 C ATOM 0 H VAL A 27 -1.700 -5.830 2.751 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.562 -5.412 0.505 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.631 -5.491 0.081 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.295 -4.218 -2.025 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.160 -5.766 -1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.983 -4.243 -1.462 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.498 -3.023 -0.140 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.137 -2.898 0.542 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.811 -3.558 1.528 1.00 0.00 H new ATOM 395 N GLN A 28 -3.078 -7.800 -0.213 1.00 0.00 N ATOM 396 CA GLN A 28 -2.924 -9.193 -0.601 1.00 0.00 C ATOM 397 C GLN A 28 -1.971 -9.308 -1.797 1.00 0.00 C ATOM 398 O GLN A 28 -1.694 -8.311 -2.478 1.00 0.00 O ATOM 399 CB GLN A 28 -4.330 -9.728 -0.949 1.00 0.00 C ATOM 400 CG GLN A 28 -5.251 -9.893 0.275 1.00 0.00 C ATOM 401 CD GLN A 28 -5.205 -11.274 0.926 1.00 0.00 C ATOM 402 OE1 GLN A 28 -4.840 -12.272 0.314 1.00 0.00 O ATOM 403 NE2 GLN A 28 -5.582 -11.385 2.187 1.00 0.00 N ATOM 0 H GLN A 28 -3.819 -7.323 -0.727 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.491 -9.781 0.208 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.802 -9.049 -1.659 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.229 -10.691 -1.449 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -4.980 -9.146 1.020 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.277 -9.683 -0.028 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.887 -10.559 2.703 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.568 -12.296 2.645 1.00 0.00 H new ATOM 412 N PRO A 29 -1.464 -10.516 -2.083 1.00 0.00 N ATOM 413 CA PRO A 29 -0.747 -10.792 -3.313 1.00 0.00 C ATOM 414 C PRO A 29 -1.717 -10.766 -4.504 1.00 0.00 C ATOM 415 O PRO A 29 -2.933 -10.728 -4.329 1.00 0.00 O ATOM 416 CB PRO A 29 -0.114 -12.168 -3.111 1.00 0.00 C ATOM 417 CG PRO A 29 -1.079 -12.853 -2.149 1.00 0.00 C ATOM 418 CD PRO A 29 -1.569 -11.715 -1.270 1.00 0.00 C ATOM 0 HA PRO A 29 0.018 -10.047 -3.533 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -0.026 -12.713 -4.051 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.889 -12.093 -2.691 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -1.901 -13.334 -2.679 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -0.581 -13.627 -1.564 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.598 -11.882 -0.950 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.965 -11.630 -0.367 1.00 0.00 H new ATOM 426 N ASN A 30 -1.162 -10.825 -5.716 1.00 0.00 N ATOM 427 CA ASN A 30 -1.862 -11.014 -6.989 1.00 0.00 C ATOM 428 C ASN A 30 -3.075 -10.085 -7.178 1.00 0.00 C ATOM 429 O ASN A 30 -4.079 -10.497 -7.766 1.00 0.00 O ATOM 430 CB ASN A 30 -2.203 -12.505 -7.168 1.00 0.00 C ATOM 431 CG ASN A 30 -0.989 -13.409 -7.008 1.00 0.00 C ATOM 432 OD1 ASN A 30 -0.014 -13.304 -7.749 1.00 0.00 O ATOM 433 ND2 ASN A 30 -0.990 -14.296 -6.026 1.00 0.00 N ATOM 0 H ASN A 30 -0.154 -10.737 -5.843 1.00 0.00 H new ATOM 0 HA ASN A 30 -1.186 -10.714 -7.790 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.962 -12.790 -6.439 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -2.637 -12.658 -8.156 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.179 -14.897 -5.881 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -1.802 -14.379 -5.414 1.00 0.00 H new ATOM 440 N ILE A 31 -3.020 -8.835 -6.690 1.00 0.00 N ATOM 441 CA ILE A 31 -4.183 -7.943 -6.635 1.00 0.00 C ATOM 442 C ILE A 31 -3.878 -6.549 -7.195 1.00 0.00 C ATOM 443 O ILE A 31 -3.962 -5.530 -6.516 1.00 0.00 O ATOM 444 CB ILE A 31 -4.831 -8.010 -5.241 1.00 0.00 C ATOM 445 CG1 ILE A 31 -6.297 -7.532 -5.288 1.00 0.00 C ATOM 446 CG2 ILE A 31 -4.013 -7.275 -4.177 1.00 0.00 C ATOM 447 CD1 ILE A 31 -7.123 -8.225 -4.207 1.00 0.00 C ATOM 0 H ILE A 31 -2.165 -8.417 -6.323 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.957 -8.293 -7.318 1.00 0.00 H new ATOM 0 HB ILE A 31 -4.838 -9.057 -4.938 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.338 -6.452 -5.148 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -6.722 -7.742 -6.269 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.515 -7.354 -3.213 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.021 -7.722 -4.107 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.919 -6.225 -4.452 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -8.154 -7.875 -4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.098 -9.303 -4.365 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.707 -7.993 -3.227 1.00 0.00 H new ATOM 459 N GLY A 32 -3.555 -6.487 -8.475 1.00 0.00 N ATOM 460 CA GLY A 32 -3.407 -5.265 -9.240 1.00 0.00 C ATOM 461 C GLY A 32 -2.009 -4.673 -9.108 1.00 0.00 C ATOM 462 O GLY A 32 -1.281 -4.934 -8.145 1.00 0.00 O ATOM 0 H GLY A 32 -3.382 -7.324 -9.032 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.617 -5.467 -10.290 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -4.143 -4.535 -8.903 1.00 0.00 H new ATOM 466 N LEU A 33 -1.648 -3.825 -10.071 1.00 0.00 N ATOM 467 CA LEU A 33 -0.315 -3.249 -10.217 1.00 0.00 C ATOM 468 C LEU A 33 0.027 -2.310 -9.053 1.00 0.00 C ATOM 469 O LEU A 33 -0.842 -1.963 -8.251 1.00 0.00 O ATOM 470 CB LEU A 33 -0.235 -2.544 -11.583 1.00 0.00 C ATOM 471 CG LEU A 33 1.173 -2.090 -12.024 1.00 0.00 C ATOM 472 CD1 LEU A 33 2.186 -3.244 -12.053 1.00 0.00 C ATOM 473 CD2 LEU A 33 1.082 -1.493 -13.419 1.00 0.00 C ATOM 0 H LEU A 33 -2.297 -3.511 -10.793 1.00 0.00 H new ATOM 0 HA LEU A 33 0.433 -4.041 -10.183 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.633 -3.217 -12.342 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.887 -1.671 -11.558 1.00 0.00 H new ATOM 0 HG LEU A 33 1.523 -1.359 -11.295 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.158 -2.867 -12.370 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.272 -3.678 -11.057 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.847 -4.008 -12.753 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.071 -1.169 -13.741 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.703 -2.244 -14.112 1.00 0.00 H new ATOM 0 HD23 LEU A 33 0.406 -0.638 -13.405 1.00 0.00 H new ATOM 485 N LEU A 34 1.293 -1.902 -8.939 1.00 0.00 N ATOM 486 CA LEU A 34 1.756 -0.863 -8.032 1.00 0.00 C ATOM 487 C LEU A 34 2.659 0.047 -8.857 1.00 0.00 C ATOM 488 O LEU A 34 3.857 -0.216 -8.942 1.00 0.00 O ATOM 489 CB LEU A 34 2.521 -1.511 -6.873 1.00 0.00 C ATOM 490 CG LEU A 34 1.702 -2.469 -6.009 1.00 0.00 C ATOM 491 CD1 LEU A 34 2.542 -3.400 -5.133 1.00 0.00 C ATOM 492 CD2 LEU A 34 0.720 -1.715 -5.117 1.00 0.00 C ATOM 0 H LEU A 34 2.046 -2.304 -9.498 1.00 0.00 H new ATOM 0 HA LEU A 34 0.936 -0.290 -7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.374 -2.053 -7.280 1.00 0.00 H new ATOM 0 HB3 LEU A 34 2.919 -0.722 -6.235 1.00 0.00 H new ATOM 0 HG LEU A 34 1.166 -3.090 -6.727 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.883 -4.046 -4.553 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.186 -4.012 -5.765 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.157 -2.806 -4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.154 -2.427 -4.516 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.269 -1.041 -4.460 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.034 -1.138 -5.737 1.00 0.00 H new ATOM 504 N TYR A 35 2.088 1.021 -9.567 1.00 0.00 N ATOM 505 CA TYR A 35 2.859 1.862 -10.481 1.00 0.00 C ATOM 506 C TYR A 35 3.512 3.023 -9.728 1.00 0.00 C ATOM 507 O TYR A 35 3.095 3.367 -8.616 1.00 0.00 O ATOM 508 CB TYR A 35 1.979 2.335 -11.645 1.00 0.00 C ATOM 509 CG TYR A 35 0.663 2.989 -11.270 1.00 0.00 C ATOM 510 CD1 TYR A 35 0.599 4.371 -11.020 1.00 0.00 C ATOM 511 CD2 TYR A 35 -0.520 2.227 -11.246 1.00 0.00 C ATOM 512 CE1 TYR A 35 -0.639 4.995 -10.785 1.00 0.00 C ATOM 513 CE2 TYR A 35 -1.760 2.844 -11.006 1.00 0.00 C ATOM 514 CZ TYR A 35 -1.833 4.239 -10.801 1.00 0.00 C ATOM 515 OH TYR A 35 -3.034 4.856 -10.626 1.00 0.00 O ATOM 0 H TYR A 35 1.094 1.246 -9.526 1.00 0.00 H new ATOM 0 HA TYR A 35 3.668 1.272 -10.911 1.00 0.00 H new ATOM 0 HB2 TYR A 35 2.554 3.042 -12.243 1.00 0.00 H new ATOM 0 HB3 TYR A 35 1.765 1.477 -12.283 1.00 0.00 H new ATOM 0 HD1 TYR A 35 1.506 4.957 -11.008 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -0.475 1.161 -11.413 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -0.678 6.057 -10.591 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -2.661 2.249 -10.978 1.00 0.00 H new ATOM 0 HH TYR A 35 -3.752 4.191 -10.666 1.00 0.00 H new ATOM 525 N ASP A 36 4.521 3.650 -10.330 1.00 0.00 N ATOM 526 CA ASP A 36 5.159 4.825 -9.749 1.00 0.00 C ATOM 527 C ASP A 36 4.140 5.959 -9.652 1.00 0.00 C ATOM 528 O ASP A 36 3.477 6.312 -10.628 1.00 0.00 O ATOM 529 CB ASP A 36 6.442 5.230 -10.493 1.00 0.00 C ATOM 530 CG ASP A 36 6.210 6.130 -11.708 1.00 0.00 C ATOM 531 OD1 ASP A 36 5.939 5.601 -12.809 1.00 0.00 O ATOM 532 OD2 ASP A 36 6.364 7.369 -11.583 1.00 0.00 O ATOM 0 H ASP A 36 4.915 3.360 -11.225 1.00 0.00 H new ATOM 0 HA ASP A 36 5.492 4.579 -8.741 1.00 0.00 H new ATOM 0 HB2 ASP A 36 7.105 5.744 -9.797 1.00 0.00 H new ATOM 0 HB3 ASP A 36 6.959 4.327 -10.818 1.00 0.00 H new ATOM 537 N GLY A 37 3.984 6.515 -8.454 1.00 0.00 N ATOM 538 CA GLY A 37 3.064 7.618 -8.196 1.00 0.00 C ATOM 539 C GLY A 37 1.645 7.190 -7.803 1.00 0.00 C ATOM 540 O GLY A 37 0.754 8.039 -7.790 1.00 0.00 O ATOM 0 H GLY A 37 4.498 6.210 -7.627 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.476 8.238 -7.399 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.007 8.242 -9.088 1.00 0.00 H new ATOM 544 N MET A 38 1.387 5.912 -7.496 1.00 0.00 N ATOM 545 CA MET A 38 0.112 5.441 -6.968 1.00 0.00 C ATOM 546 C MET A 38 -0.224 6.065 -5.604 1.00 0.00 C ATOM 547 O MET A 38 -1.397 6.300 -5.312 1.00 0.00 O ATOM 548 CB MET A 38 0.166 3.909 -6.838 1.00 0.00 C ATOM 549 CG MET A 38 -1.073 3.268 -7.437 1.00 0.00 C ATOM 550 SD MET A 38 -1.129 1.464 -7.282 1.00 0.00 S ATOM 551 CE MET A 38 -1.923 1.303 -5.667 1.00 0.00 C ATOM 0 H MET A 38 2.075 5.168 -7.612 1.00 0.00 H new ATOM 0 HA MET A 38 -0.673 5.744 -7.661 1.00 0.00 H new ATOM 0 HB2 MET A 38 1.055 3.529 -7.341 1.00 0.00 H new ATOM 0 HB3 MET A 38 0.251 3.632 -5.787 1.00 0.00 H new ATOM 0 HG2 MET A 38 -1.955 3.690 -6.955 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.130 3.532 -8.493 1.00 0.00 H new ATOM 0 HE1 MET A 38 -1.677 0.333 -5.236 1.00 0.00 H new ATOM 0 HE2 MET A 38 -1.568 2.094 -5.007 1.00 0.00 H new ATOM 0 HE3 MET A 38 -3.004 1.385 -5.783 1.00 0.00 H new ATOM 561 N PHE A 39 0.789 6.348 -4.777 1.00 0.00 N ATOM 562 CA PHE A 39 0.668 6.869 -3.412 1.00 0.00 C ATOM 563 C PHE A 39 1.078 8.343 -3.349 1.00 0.00 C ATOM 564 O PHE A 39 1.608 8.809 -2.338 1.00 0.00 O ATOM 565 CB PHE A 39 1.514 6.016 -2.449 1.00 0.00 C ATOM 566 CG PHE A 39 1.152 4.549 -2.462 1.00 0.00 C ATOM 567 CD1 PHE A 39 -0.062 4.107 -1.908 1.00 0.00 C ATOM 568 CD2 PHE A 39 2.010 3.635 -3.092 1.00 0.00 C ATOM 569 CE1 PHE A 39 -0.431 2.754 -2.020 1.00 0.00 C ATOM 570 CE2 PHE A 39 1.637 2.291 -3.215 1.00 0.00 C ATOM 571 CZ PHE A 39 0.408 1.851 -2.695 1.00 0.00 C ATOM 0 H PHE A 39 1.761 6.213 -5.055 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.376 6.807 -3.105 1.00 0.00 H new ATOM 0 HB2 PHE A 39 2.567 6.124 -2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.396 6.402 -1.436 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.710 4.804 -1.398 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.960 3.969 -3.483 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.359 2.409 -1.587 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.295 1.592 -3.710 1.00 0.00 H new ATOM 0 HZ PHE A 39 0.109 0.820 -2.814 1.00 0.00 H new ATOM 581 N SER A 40 0.891 9.074 -4.446 1.00 0.00 N ATOM 582 CA SER A 40 1.366 10.437 -4.600 1.00 0.00 C ATOM 583 C SER A 40 0.603 11.319 -3.608 1.00 0.00 C ATOM 584 O SER A 40 -0.578 11.604 -3.815 1.00 0.00 O ATOM 585 CB SER A 40 1.167 10.857 -6.066 1.00 0.00 C ATOM 586 OG SER A 40 1.600 12.179 -6.320 1.00 0.00 O ATOM 0 H SER A 40 0.395 8.724 -5.265 1.00 0.00 H new ATOM 0 HA SER A 40 2.429 10.537 -4.378 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.712 10.170 -6.713 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.112 10.769 -6.325 1.00 0.00 H new ATOM 0 HG SER A 40 1.453 12.396 -7.264 1.00 0.00 H new ATOM 592 N GLY A 41 1.243 11.691 -2.496 1.00 0.00 N ATOM 593 CA GLY A 41 0.635 12.506 -1.450 1.00 0.00 C ATOM 594 C GLY A 41 0.080 11.692 -0.274 1.00 0.00 C ATOM 595 O GLY A 41 -0.648 12.244 0.553 1.00 0.00 O ATOM 0 H GLY A 41 2.209 11.430 -2.298 1.00 0.00 H new ATOM 0 HA2 GLY A 41 1.377 13.210 -1.074 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -0.172 13.095 -1.885 1.00 0.00 H new ATOM 599 N CYS A 42 0.402 10.398 -0.150 1.00 0.00 N ATOM 600 CA CYS A 42 0.044 9.591 1.019 1.00 0.00 C ATOM 601 C CYS A 42 0.973 9.944 2.195 1.00 0.00 C ATOM 602 O CYS A 42 1.757 9.117 2.655 1.00 0.00 O ATOM 603 CB CYS A 42 0.116 8.102 0.662 1.00 0.00 C ATOM 604 SG CYS A 42 -1.190 7.644 -0.513 1.00 0.00 S ATOM 0 H CYS A 42 0.920 9.882 -0.861 1.00 0.00 H new ATOM 0 HA CYS A 42 -0.979 9.810 1.324 1.00 0.00 H new ATOM 0 HB2 CYS A 42 1.092 7.875 0.232 1.00 0.00 H new ATOM 0 HB3 CYS A 42 0.020 7.503 1.568 1.00 0.00 H new ATOM 0 HG CYS A 42 -1.525 6.402 -0.327 1.00 0.00 H new ATOM 610 N THR A 43 0.916 11.186 2.667 1.00 0.00 N ATOM 611 CA THR A 43 1.981 11.818 3.431 1.00 0.00 C ATOM 612 C THR A 43 2.126 11.315 4.875 1.00 0.00 C ATOM 613 O THR A 43 3.141 11.612 5.507 1.00 0.00 O ATOM 614 CB THR A 43 1.765 13.337 3.382 1.00 0.00 C ATOM 615 OG1 THR A 43 0.424 13.665 3.697 1.00 0.00 O ATOM 616 CG2 THR A 43 2.050 13.923 1.993 1.00 0.00 C ATOM 0 H THR A 43 0.109 11.793 2.524 1.00 0.00 H new ATOM 0 HA THR A 43 2.927 11.541 2.965 1.00 0.00 H new ATOM 0 HB THR A 43 2.459 13.757 4.110 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.308 14.637 3.662 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.883 15.000 2.011 1.00 0.00 H new ATOM 0 HG22 THR A 43 3.085 13.721 1.718 1.00 0.00 H new ATOM 0 HG23 THR A 43 1.385 13.465 1.261 1.00 0.00 H new ATOM 624 N ALA A 44 1.162 10.558 5.418 1.00 0.00 N ATOM 625 CA ALA A 44 1.273 9.935 6.738 1.00 0.00 C ATOM 626 C ALA A 44 1.328 8.407 6.652 1.00 0.00 C ATOM 627 O ALA A 44 1.121 7.739 7.662 1.00 0.00 O ATOM 628 CB ALA A 44 0.132 10.405 7.645 1.00 0.00 C ATOM 0 H ALA A 44 0.279 10.361 4.948 1.00 0.00 H new ATOM 0 HA ALA A 44 2.218 10.254 7.178 1.00 0.00 H new ATOM 0 HB1 ALA A 44 0.227 9.934 8.623 1.00 0.00 H new ATOM 0 HB2 ALA A 44 0.179 11.488 7.758 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.824 10.128 7.200 1.00 0.00 H new ATOM 634 N LEU A 45 1.553 7.837 5.465 1.00 0.00 N ATOM 635 CA LEU A 45 1.665 6.395 5.296 1.00 0.00 C ATOM 636 C LEU A 45 2.904 5.925 6.041 1.00 0.00 C ATOM 637 O LEU A 45 4.006 6.338 5.692 1.00 0.00 O ATOM 638 CB LEU A 45 1.703 6.044 3.801 1.00 0.00 C ATOM 639 CG LEU A 45 1.127 4.656 3.468 1.00 0.00 C ATOM 640 CD1 LEU A 45 0.846 4.540 1.963 1.00 0.00 C ATOM 641 CD2 LEU A 45 1.522 3.318 4.072 1.00 0.00 C ATOM 0 H LEU A 45 1.662 8.365 4.599 1.00 0.00 H new ATOM 0 HA LEU A 45 0.799 5.881 5.713 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.146 6.799 3.247 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.735 6.090 3.454 1.00 0.00 H new ATOM 0 HG LEU A 45 0.285 4.757 4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.439 3.553 1.744 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.126 5.303 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.773 4.682 1.408 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.925 2.525 3.621 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.579 3.130 3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.346 3.338 5.147 1.00 0.00 H new ATOM 653 N GLU A 46 2.741 5.073 7.054 1.00 0.00 N ATOM 654 CA GLU A 46 3.843 4.607 7.891 1.00 0.00 C ATOM 655 C GLU A 46 3.924 3.086 7.987 1.00 0.00 C ATOM 656 O GLU A 46 4.922 2.573 8.506 1.00 0.00 O ATOM 657 CB GLU A 46 3.738 5.226 9.287 1.00 0.00 C ATOM 658 CG GLU A 46 4.050 6.733 9.252 1.00 0.00 C ATOM 659 CD GLU A 46 4.728 7.221 10.523 1.00 0.00 C ATOM 660 OE1 GLU A 46 5.793 6.670 10.895 1.00 0.00 O ATOM 661 OE2 GLU A 46 4.244 8.208 11.127 1.00 0.00 O ATOM 0 H GLU A 46 1.835 4.686 7.317 1.00 0.00 H new ATOM 0 HA GLU A 46 4.765 4.934 7.410 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.735 5.069 9.683 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.430 4.724 9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.692 6.947 8.397 1.00 0.00 H new ATOM 0 HG3 GLU A 46 3.124 7.288 9.103 1.00 0.00 H new ATOM 668 N LYS A 47 2.929 2.354 7.478 1.00 0.00 N ATOM 669 CA LYS A 47 2.910 0.906 7.462 1.00 0.00 C ATOM 670 C LYS A 47 2.172 0.354 6.258 1.00 0.00 C ATOM 671 O LYS A 47 1.180 0.918 5.799 1.00 0.00 O ATOM 672 CB LYS A 47 2.215 0.366 8.720 1.00 0.00 C ATOM 673 CG LYS A 47 3.116 0.370 9.956 1.00 0.00 C ATOM 674 CD LYS A 47 2.617 -0.642 10.994 1.00 0.00 C ATOM 675 CE LYS A 47 3.708 -1.101 11.974 1.00 0.00 C ATOM 676 NZ LYS A 47 4.312 0.009 12.739 1.00 0.00 N ATOM 0 H LYS A 47 2.099 2.771 7.058 1.00 0.00 H new ATOM 0 HA LYS A 47 3.951 0.587 7.421 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.328 0.966 8.923 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.874 -0.652 8.530 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.139 0.128 9.667 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.136 1.368 10.394 1.00 0.00 H new ATOM 0 HD2 LYS A 47 1.796 -0.198 11.558 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.214 -1.513 10.477 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.281 -1.823 12.670 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.491 -1.618 11.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.039 -0.367 13.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.747 0.687 12.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.575 0.489 13.294 1.00 0.00 H new ATOM 690 N LEU A 48 2.618 -0.807 5.802 1.00 0.00 N ATOM 691 CA LEU A 48 2.134 -1.477 4.615 1.00 0.00 C ATOM 692 C LEU A 48 2.333 -2.965 4.829 1.00 0.00 C ATOM 693 O LEU A 48 3.440 -3.494 4.702 1.00 0.00 O ATOM 694 CB LEU A 48 2.846 -1.012 3.340 1.00 0.00 C ATOM 695 CG LEU A 48 2.092 -1.630 2.141 1.00 0.00 C ATOM 696 CD1 LEU A 48 1.247 -0.579 1.437 1.00 0.00 C ATOM 697 CD2 LEU A 48 3.028 -2.292 1.141 1.00 0.00 C ATOM 0 H LEU A 48 3.359 -1.326 6.273 1.00 0.00 H new ATOM 0 HA LEU A 48 1.082 -1.234 4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.846 0.076 3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.888 -1.331 3.344 1.00 0.00 H new ATOM 0 HG LEU A 48 1.444 -2.406 2.548 1.00 0.00 H new ATOM 0 HD11 LEU A 48 0.725 -1.035 0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.519 -0.169 2.137 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.891 0.221 1.073 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.446 -2.709 0.319 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.727 -1.552 0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.583 -3.090 1.635 1.00 0.00 H new ATOM 709 N ILE A 49 1.255 -3.632 5.190 1.00 0.00 N ATOM 710 CA ILE A 49 1.274 -5.034 5.545 1.00 0.00 C ATOM 711 C ILE A 49 0.938 -5.817 4.285 1.00 0.00 C ATOM 712 O ILE A 49 0.051 -5.427 3.527 1.00 0.00 O ATOM 713 CB ILE A 49 0.302 -5.301 6.707 1.00 0.00 C ATOM 714 CG1 ILE A 49 0.578 -4.370 7.908 1.00 0.00 C ATOM 715 CG2 ILE A 49 0.468 -6.763 7.146 1.00 0.00 C ATOM 716 CD1 ILE A 49 -0.356 -3.154 7.978 1.00 0.00 C ATOM 0 H ILE A 49 0.329 -3.208 5.245 1.00 0.00 H new ATOM 0 HA ILE A 49 2.253 -5.352 5.905 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.715 -5.106 6.366 1.00 0.00 H new ATOM 0 HG12 ILE A 49 0.482 -4.944 8.830 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.609 -4.021 7.856 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -0.213 -6.975 7.970 1.00 0.00 H new ATOM 0 HG22 ILE A 49 0.240 -7.422 6.309 1.00 0.00 H new ATOM 0 HG23 ILE A 49 1.495 -6.931 7.471 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -0.100 -2.548 8.847 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -0.243 -2.556 7.074 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -1.389 -3.493 8.063 1.00 0.00 H new ATOM 728 N LEU A 50 1.647 -6.918 4.057 1.00 0.00 N ATOM 729 CA LEU A 50 1.511 -7.743 2.865 1.00 0.00 C ATOM 730 C LEU A 50 1.184 -9.170 3.285 1.00 0.00 C ATOM 731 O LEU A 50 1.920 -9.737 4.091 1.00 0.00 O ATOM 732 CB LEU A 50 2.823 -7.744 2.071 1.00 0.00 C ATOM 733 CG LEU A 50 3.302 -6.409 1.478 1.00 0.00 C ATOM 734 CD1 LEU A 50 4.463 -6.698 0.519 1.00 0.00 C ATOM 735 CD2 LEU A 50 2.213 -5.659 0.713 1.00 0.00 C ATOM 0 H LEU A 50 2.347 -7.268 4.711 1.00 0.00 H new ATOM 0 HA LEU A 50 0.714 -7.340 2.239 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.610 -8.122 2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.719 -8.456 1.252 1.00 0.00 H new ATOM 0 HG LEU A 50 3.602 -5.773 2.310 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.819 -5.763 0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.275 -7.177 1.065 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.121 -7.359 -0.277 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.620 -4.726 0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 50 1.859 -6.275 -0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.383 -5.439 1.384 1.00 0.00 H new ATOM 747 N THR A 51 0.153 -9.778 2.707 1.00 0.00 N ATOM 748 CA THR A 51 -0.404 -11.054 3.154 1.00 0.00 C ATOM 749 C THR A 51 -0.185 -12.160 2.107 1.00 0.00 C ATOM 750 O THR A 51 -1.068 -12.982 1.838 1.00 0.00 O ATOM 751 CB THR A 51 -1.878 -10.840 3.532 1.00 0.00 C ATOM 752 OG1 THR A 51 -2.666 -10.647 2.386 1.00 0.00 O ATOM 753 CG2 THR A 51 -2.116 -9.616 4.417 1.00 0.00 C ATOM 0 H THR A 51 -0.331 -9.390 1.897 1.00 0.00 H new ATOM 0 HA THR A 51 0.120 -11.406 4.043 1.00 0.00 H new ATOM 0 HB THR A 51 -2.152 -11.743 4.078 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.428 -10.071 2.606 1.00 0.00 H new ATOM 0 HG21 THR A 51 -3.179 -9.531 4.642 1.00 0.00 H new ATOM 0 HG22 THR A 51 -1.556 -9.724 5.346 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.782 -8.719 3.895 1.00 0.00 H new ATOM 761 N GLY A 52 0.959 -12.118 1.416 1.00 0.00 N ATOM 762 CA GLY A 52 1.377 -13.131 0.458 1.00 0.00 C ATOM 763 C GLY A 52 2.820 -13.499 0.742 1.00 0.00 C ATOM 764 O GLY A 52 3.626 -12.616 1.040 1.00 0.00 O ATOM 0 H GLY A 52 1.632 -11.358 1.514 1.00 0.00 H new ATOM 0 HA2 GLY A 52 0.740 -14.012 0.536 1.00 0.00 H new ATOM 0 HA3 GLY A 52 1.276 -12.754 -0.560 1.00 0.00 H new ATOM 768 N GLU A 53 3.133 -14.785 0.643 1.00 0.00 N ATOM 769 CA GLU A 53 4.342 -15.367 1.211 1.00 0.00 C ATOM 770 C GLU A 53 5.588 -15.156 0.335 1.00 0.00 C ATOM 771 O GLU A 53 6.643 -15.716 0.638 1.00 0.00 O ATOM 772 CB GLU A 53 4.140 -16.874 1.463 1.00 0.00 C ATOM 773 CG GLU A 53 2.999 -17.258 2.415 1.00 0.00 C ATOM 774 CD GLU A 53 2.787 -18.782 2.462 1.00 0.00 C ATOM 775 OE1 GLU A 53 3.784 -19.539 2.507 1.00 0.00 O ATOM 776 OE2 GLU A 53 1.612 -19.226 2.466 1.00 0.00 O ATOM 0 H GLU A 53 2.545 -15.463 0.158 1.00 0.00 H new ATOM 0 HA GLU A 53 4.520 -14.846 2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 53 3.963 -17.360 0.504 1.00 0.00 H new ATOM 0 HB3 GLU A 53 5.069 -17.282 1.861 1.00 0.00 H new ATOM 0 HG2 GLU A 53 3.221 -16.890 3.417 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.078 -16.772 2.094 1.00 0.00 H new ATOM 783 N ASP A 54 5.502 -14.423 -0.777 1.00 0.00 N ATOM 784 CA ASP A 54 6.521 -14.426 -1.823 1.00 0.00 C ATOM 785 C ASP A 54 6.516 -13.068 -2.546 1.00 0.00 C ATOM 786 O ASP A 54 5.434 -12.507 -2.738 1.00 0.00 O ATOM 787 CB ASP A 54 6.101 -15.499 -2.830 1.00 0.00 C ATOM 788 CG ASP A 54 7.131 -15.653 -3.931 1.00 0.00 C ATOM 789 OD1 ASP A 54 8.065 -16.460 -3.715 1.00 0.00 O ATOM 790 OD2 ASP A 54 6.981 -15.022 -4.996 1.00 0.00 O ATOM 0 H ASP A 54 4.715 -13.806 -0.976 1.00 0.00 H new ATOM 0 HA ASP A 54 7.510 -14.612 -1.405 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.969 -16.451 -2.316 1.00 0.00 H new ATOM 0 HB3 ASP A 54 5.137 -15.235 -3.265 1.00 0.00 H new ATOM 795 N PRO A 55 7.673 -12.541 -2.980 1.00 0.00 N ATOM 796 CA PRO A 55 7.761 -11.241 -3.637 1.00 0.00 C ATOM 797 C PRO A 55 7.217 -11.249 -5.065 1.00 0.00 C ATOM 798 O PRO A 55 6.574 -10.283 -5.470 1.00 0.00 O ATOM 799 CB PRO A 55 9.244 -10.859 -3.619 1.00 0.00 C ATOM 800 CG PRO A 55 9.979 -12.183 -3.437 1.00 0.00 C ATOM 801 CD PRO A 55 8.993 -13.055 -2.683 1.00 0.00 C ATOM 0 HA PRO A 55 7.142 -10.516 -3.108 1.00 0.00 H new ATOM 0 HB2 PRO A 55 9.538 -10.366 -4.546 1.00 0.00 H new ATOM 0 HB3 PRO A 55 9.466 -10.167 -2.806 1.00 0.00 H new ATOM 0 HG2 PRO A 55 10.248 -12.624 -4.397 1.00 0.00 H new ATOM 0 HG3 PRO A 55 10.904 -12.051 -2.876 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.082 -14.096 -2.992 1.00 0.00 H new ATOM 0 HD3 PRO A 55 9.189 -13.023 -1.611 1.00 0.00 H new ATOM 809 N SER A 56 7.438 -12.316 -5.836 1.00 0.00 N ATOM 810 CA SER A 56 7.026 -12.387 -7.234 1.00 0.00 C ATOM 811 C SER A 56 5.512 -12.602 -7.380 1.00 0.00 C ATOM 812 O SER A 56 4.980 -12.490 -8.486 1.00 0.00 O ATOM 813 CB SER A 56 7.864 -13.460 -7.945 1.00 0.00 C ATOM 814 OG SER A 56 9.243 -13.143 -7.853 1.00 0.00 O ATOM 0 H SER A 56 7.910 -13.157 -5.504 1.00 0.00 H new ATOM 0 HA SER A 56 7.217 -11.430 -7.719 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.677 -14.435 -7.496 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.568 -13.529 -8.992 1.00 0.00 H new ATOM 0 HG SER A 56 9.769 -13.834 -8.308 1.00 0.00 H new ATOM 820 N ALA A 57 4.793 -12.839 -6.276 1.00 0.00 N ATOM 821 CA ALA A 57 3.340 -12.752 -6.215 1.00 0.00 C ATOM 822 C ALA A 57 2.846 -11.296 -6.149 1.00 0.00 C ATOM 823 O ALA A 57 1.642 -11.043 -6.271 1.00 0.00 O ATOM 824 CB ALA A 57 2.864 -13.527 -4.989 1.00 0.00 C ATOM 0 H ALA A 57 5.219 -13.101 -5.387 1.00 0.00 H new ATOM 0 HA ALA A 57 2.926 -13.182 -7.127 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.777 -13.474 -4.925 1.00 0.00 H new ATOM 0 HB2 ALA A 57 3.172 -14.569 -5.075 1.00 0.00 H new ATOM 0 HB3 ALA A 57 3.302 -13.092 -4.091 1.00 0.00 H new ATOM 830 N TYR A 58 3.730 -10.319 -5.932 1.00 0.00 N ATOM 831 CA TYR A 58 3.382 -8.908 -5.919 1.00 0.00 C ATOM 832 C TYR A 58 3.691 -8.266 -7.261 1.00 0.00 C ATOM 833 O TYR A 58 4.191 -8.881 -8.206 1.00 0.00 O ATOM 834 CB TYR A 58 4.009 -8.183 -4.718 1.00 0.00 C ATOM 835 CG TYR A 58 3.206 -8.458 -3.468 1.00 0.00 C ATOM 836 CD1 TYR A 58 3.448 -9.633 -2.740 1.00 0.00 C ATOM 837 CD2 TYR A 58 2.151 -7.602 -3.098 1.00 0.00 C ATOM 838 CE1 TYR A 58 2.621 -9.973 -1.660 1.00 0.00 C ATOM 839 CE2 TYR A 58 1.343 -7.914 -1.991 1.00 0.00 C ATOM 840 CZ TYR A 58 1.574 -9.109 -1.276 1.00 0.00 C ATOM 841 OH TYR A 58 0.771 -9.442 -0.233 1.00 0.00 O ATOM 0 H TYR A 58 4.720 -10.495 -5.759 1.00 0.00 H new ATOM 0 HA TYR A 58 2.305 -8.811 -5.779 1.00 0.00 H new ATOM 0 HB2 TYR A 58 5.038 -8.516 -4.579 1.00 0.00 H new ATOM 0 HB3 TYR A 58 4.044 -7.110 -4.909 1.00 0.00 H new ATOM 0 HD1 TYR A 58 4.272 -10.276 -3.012 1.00 0.00 H new ATOM 0 HD2 TYR A 58 1.962 -6.703 -3.666 1.00 0.00 H new ATOM 0 HE1 TYR A 58 2.785 -10.895 -1.123 1.00 0.00 H new ATOM 0 HE2 TYR A 58 0.551 -7.244 -1.690 1.00 0.00 H new ATOM 0 HH TYR A 58 0.242 -8.662 0.035 1.00 0.00 H new ATOM 851 N SER A 59 3.263 -7.020 -7.357 1.00 0.00 N ATOM 852 CA SER A 59 3.536 -6.044 -8.375 1.00 0.00 C ATOM 853 C SER A 59 4.574 -5.074 -7.795 1.00 0.00 C ATOM 854 O SER A 59 5.162 -5.343 -6.744 1.00 0.00 O ATOM 855 CB SER A 59 2.181 -5.399 -8.747 1.00 0.00 C ATOM 856 OG SER A 59 1.266 -5.446 -7.658 1.00 0.00 O ATOM 0 H SER A 59 2.649 -6.634 -6.640 1.00 0.00 H new ATOM 0 HA SER A 59 3.960 -6.446 -9.295 1.00 0.00 H new ATOM 0 HB2 SER A 59 2.340 -4.363 -9.046 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.754 -5.917 -9.606 1.00 0.00 H new ATOM 0 HG SER A 59 0.349 -5.379 -7.998 1.00 0.00 H new ATOM 862 N ALA A 60 4.728 -3.918 -8.444 1.00 0.00 N ATOM 863 CA ALA A 60 5.742 -2.884 -8.295 1.00 0.00 C ATOM 864 C ALA A 60 7.043 -3.312 -8.957 1.00 0.00 C ATOM 865 O ALA A 60 7.461 -4.468 -8.852 1.00 0.00 O ATOM 866 CB ALA A 60 6.072 -2.521 -6.837 1.00 0.00 C ATOM 0 H ALA A 60 4.063 -3.659 -9.172 1.00 0.00 H new ATOM 0 HA ALA A 60 5.308 -2.005 -8.772 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.836 -1.744 -6.820 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.173 -2.157 -6.340 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.442 -3.405 -6.317 1.00 0.00 H new ATOM 872 N GLY A 61 7.706 -2.336 -9.566 1.00 0.00 N ATOM 873 CA GLY A 61 9.066 -2.529 -10.053 1.00 0.00 C ATOM 874 C GLY A 61 9.724 -1.241 -10.518 1.00 0.00 C ATOM 875 O GLY A 61 10.926 -1.058 -10.355 1.00 0.00 O ATOM 0 H GLY A 61 7.325 -1.405 -9.734 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.669 -2.972 -9.261 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.052 -3.241 -10.878 1.00 0.00 H new ATOM 879 N ASP A 62 8.920 -0.327 -11.037 1.00 0.00 N ATOM 880 CA ASP A 62 9.255 1.040 -11.389 1.00 0.00 C ATOM 881 C ASP A 62 9.628 1.831 -10.138 1.00 0.00 C ATOM 882 O ASP A 62 10.628 2.547 -10.143 1.00 0.00 O ATOM 883 CB ASP A 62 8.050 1.691 -12.106 1.00 0.00 C ATOM 884 CG ASP A 62 6.666 1.371 -11.508 1.00 0.00 C ATOM 885 OD1 ASP A 62 6.571 0.856 -10.370 1.00 0.00 O ATOM 886 OD2 ASP A 62 5.668 1.476 -12.256 1.00 0.00 O ATOM 0 H ASP A 62 7.943 -0.540 -11.238 1.00 0.00 H new ATOM 0 HA ASP A 62 10.114 1.043 -12.060 1.00 0.00 H new ATOM 0 HB2 ASP A 62 8.187 2.772 -12.100 1.00 0.00 H new ATOM 0 HB3 ASP A 62 8.057 1.375 -13.149 1.00 0.00 H new ATOM 891 N GLY A 63 8.853 1.706 -9.062 1.00 0.00 N ATOM 892 CA GLY A 63 8.898 2.676 -7.985 1.00 0.00 C ATOM 893 C GLY A 63 7.679 2.596 -7.090 1.00 0.00 C ATOM 894 O GLY A 63 6.875 3.521 -7.111 1.00 0.00 O ATOM 0 H GLY A 63 8.191 0.943 -8.919 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.796 2.512 -7.389 1.00 0.00 H new ATOM 0 HA3 GLY A 63 8.973 3.679 -8.405 1.00 0.00 H new ATOM 898 N LEU A 64 7.558 1.538 -6.274 1.00 0.00 N ATOM 899 CA LEU A 64 6.376 1.284 -5.447 1.00 0.00 C ATOM 900 C LEU A 64 5.916 2.559 -4.758 1.00 0.00 C ATOM 901 O LEU A 64 4.781 2.996 -4.930 1.00 0.00 O ATOM 902 CB LEU A 64 6.642 0.209 -4.363 1.00 0.00 C ATOM 903 CG LEU A 64 5.492 0.098 -3.320 1.00 0.00 C ATOM 904 CD1 LEU A 64 4.201 -0.365 -3.969 1.00 0.00 C ATOM 905 CD2 LEU A 64 5.812 -0.882 -2.197 1.00 0.00 C ATOM 0 H LEU A 64 8.286 0.831 -6.171 1.00 0.00 H new ATOM 0 HA LEU A 64 5.601 0.919 -6.121 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.782 -0.758 -4.845 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.572 0.445 -3.846 1.00 0.00 H new ATOM 0 HG LEU A 64 5.380 1.100 -2.907 1.00 0.00 H new ATOM 0 HD11 LEU A 64 3.418 -0.432 -3.214 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.904 0.349 -4.737 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.353 -1.344 -4.423 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.976 -0.920 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.980 -1.874 -2.617 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.709 -0.554 -1.672 1.00 0.00 H new ATOM 917 N ARG A 65 6.768 3.095 -3.887 1.00 0.00 N ATOM 918 CA ARG A 65 6.308 4.097 -2.946 1.00 0.00 C ATOM 919 C ARG A 65 6.219 5.476 -3.571 1.00 0.00 C ATOM 920 O ARG A 65 5.711 6.359 -2.894 1.00 0.00 O ATOM 921 CB ARG A 65 7.258 4.197 -1.757 1.00 0.00 C ATOM 922 CG ARG A 65 7.476 2.912 -0.956 1.00 0.00 C ATOM 923 CD ARG A 65 7.820 3.250 0.497 1.00 0.00 C ATOM 924 NE ARG A 65 9.262 3.316 0.693 1.00 0.00 N ATOM 925 CZ ARG A 65 10.121 4.248 0.276 1.00 0.00 C ATOM 926 NH1 ARG A 65 9.737 5.430 -0.205 1.00 0.00 N ATOM 927 NH2 ARG A 65 11.407 3.952 0.301 1.00 0.00 N ATOM 0 H ARG A 65 7.757 2.856 -3.817 1.00 0.00 H new ATOM 0 HA ARG A 65 5.315 3.778 -2.629 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.226 4.543 -2.120 1.00 0.00 H new ATOM 0 HB3 ARG A 65 6.880 4.963 -1.080 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.578 2.295 -0.991 1.00 0.00 H new ATOM 0 HG3 ARG A 65 8.281 2.328 -1.402 1.00 0.00 H new ATOM 0 HD2 ARG A 65 7.369 4.205 0.768 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.394 2.497 1.160 1.00 0.00 H new ATOM 0 HE ARG A 65 9.671 2.545 1.221 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.745 5.657 -0.268 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.436 6.108 -0.511 1.00 0.00 H new ATOM 0 HH21 ARG A 65 11.713 3.037 0.631 1.00 0.00 H new ATOM 0 HH22 ARG A 65 12.094 4.638 -0.010 1.00 0.00 H new ATOM 941 N ASP A 66 6.738 5.664 -4.790 1.00 0.00 N ATOM 942 CA ASP A 66 7.151 6.954 -5.333 1.00 0.00 C ATOM 943 C ASP A 66 6.094 8.014 -5.052 1.00 0.00 C ATOM 944 O ASP A 66 4.966 7.888 -5.533 1.00 0.00 O ATOM 945 CB ASP A 66 7.408 6.828 -6.835 1.00 0.00 C ATOM 946 CG ASP A 66 8.271 7.974 -7.337 1.00 0.00 C ATOM 947 OD1 ASP A 66 7.735 9.041 -7.699 1.00 0.00 O ATOM 948 OD2 ASP A 66 9.515 7.838 -7.349 1.00 0.00 O ATOM 0 H ASP A 66 6.885 4.894 -5.443 1.00 0.00 H new ATOM 0 HA ASP A 66 8.076 7.263 -4.846 1.00 0.00 H new ATOM 0 HB2 ASP A 66 7.900 5.878 -7.045 1.00 0.00 H new ATOM 0 HB3 ASP A 66 6.459 6.821 -7.371 1.00 0.00 H new ATOM 953 N GLY A 67 6.425 8.985 -4.200 1.00 0.00 N ATOM 954 CA GLY A 67 5.487 9.996 -3.732 1.00 0.00 C ATOM 955 C GLY A 67 5.111 9.881 -2.248 1.00 0.00 C ATOM 956 O GLY A 67 4.438 10.783 -1.739 1.00 0.00 O ATOM 0 H GLY A 67 7.363 9.089 -3.813 1.00 0.00 H new ATOM 0 HA2 GLY A 67 5.917 10.982 -3.909 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.578 9.933 -4.330 1.00 0.00 H new ATOM 960 N ALA A 68 5.548 8.833 -1.541 1.00 0.00 N ATOM 961 CA ALA A 68 5.491 8.687 -0.085 1.00 0.00 C ATOM 962 C ALA A 68 6.671 7.833 0.425 1.00 0.00 C ATOM 963 O ALA A 68 7.402 7.219 -0.357 1.00 0.00 O ATOM 964 CB ALA A 68 4.149 8.048 0.302 1.00 0.00 C ATOM 0 H ALA A 68 5.972 8.023 -1.993 1.00 0.00 H new ATOM 0 HA ALA A 68 5.570 9.670 0.380 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.098 7.936 1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.332 8.686 -0.035 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.063 7.069 -0.169 1.00 0.00 H new ATOM 970 N ASP A 69 6.831 7.727 1.751 1.00 0.00 N ATOM 971 CA ASP A 69 7.868 6.918 2.400 1.00 0.00 C ATOM 972 C ASP A 69 7.274 6.235 3.632 1.00 0.00 C ATOM 973 O ASP A 69 7.366 6.718 4.762 1.00 0.00 O ATOM 974 CB ASP A 69 9.131 7.736 2.703 1.00 0.00 C ATOM 975 CG ASP A 69 10.290 6.825 3.133 1.00 0.00 C ATOM 976 OD1 ASP A 69 10.359 6.438 4.325 1.00 0.00 O ATOM 977 OD2 ASP A 69 11.130 6.496 2.271 1.00 0.00 O ATOM 0 H ASP A 69 6.229 8.213 2.416 1.00 0.00 H new ATOM 0 HA ASP A 69 8.201 6.139 1.715 1.00 0.00 H new ATOM 0 HB2 ASP A 69 9.420 8.305 1.819 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.920 8.458 3.492 1.00 0.00 H new ATOM 982 N PHE A 70 6.593 5.116 3.373 1.00 0.00 N ATOM 983 CA PHE A 70 5.981 4.254 4.376 1.00 0.00 C ATOM 984 C PHE A 70 6.947 3.116 4.712 1.00 0.00 C ATOM 985 O PHE A 70 8.079 3.096 4.230 1.00 0.00 O ATOM 986 CB PHE A 70 4.606 3.799 3.852 1.00 0.00 C ATOM 987 CG PHE A 70 4.621 3.031 2.537 1.00 0.00 C ATOM 988 CD1 PHE A 70 5.005 1.676 2.475 1.00 0.00 C ATOM 989 CD2 PHE A 70 4.183 3.680 1.365 1.00 0.00 C ATOM 990 CE1 PHE A 70 4.901 0.975 1.262 1.00 0.00 C ATOM 991 CE2 PHE A 70 4.028 2.964 0.167 1.00 0.00 C ATOM 992 CZ PHE A 70 4.365 1.602 0.124 1.00 0.00 C ATOM 0 H PHE A 70 6.450 4.777 2.422 1.00 0.00 H new ATOM 0 HA PHE A 70 5.797 4.774 5.316 1.00 0.00 H new ATOM 0 HB2 PHE A 70 4.137 3.173 4.612 1.00 0.00 H new ATOM 0 HB3 PHE A 70 3.975 4.679 3.730 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.378 1.178 3.358 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.965 4.737 1.389 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.234 -0.051 1.204 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.652 3.458 -0.716 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.212 1.036 -0.783 1.00 0.00 H new ATOM 1002 N LEU A 71 6.540 2.180 5.567 1.00 0.00 N ATOM 1003 CA LEU A 71 7.340 1.025 5.994 1.00 0.00 C ATOM 1004 C LEU A 71 6.569 -0.235 5.610 1.00 0.00 C ATOM 1005 O LEU A 71 5.355 -0.174 5.465 1.00 0.00 O ATOM 1006 CB LEU A 71 7.551 1.098 7.520 1.00 0.00 C ATOM 1007 CG LEU A 71 8.981 0.903 8.048 1.00 0.00 C ATOM 1008 CD1 LEU A 71 8.982 0.949 9.575 1.00 0.00 C ATOM 1009 CD2 LEU A 71 9.568 -0.422 7.594 1.00 0.00 C ATOM 0 H LEU A 71 5.616 2.202 5.998 1.00 0.00 H new ATOM 0 HA LEU A 71 8.319 1.016 5.515 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.195 2.070 7.863 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.915 0.344 7.984 1.00 0.00 H new ATOM 0 HG LEU A 71 9.594 1.710 7.645 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.999 0.810 9.943 1.00 0.00 H new ATOM 0 HD12 LEU A 71 8.604 1.915 9.910 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.344 0.155 9.963 1.00 0.00 H new ATOM 0 HD21 LEU A 71 10.580 -0.525 7.986 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.950 -1.240 7.965 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.596 -0.453 6.505 1.00 0.00 H new ATOM 1021 N ILE A 72 7.225 -1.382 5.471 1.00 0.00 N ATOM 1022 CA ILE A 72 6.624 -2.636 4.992 1.00 0.00 C ATOM 1023 C ILE A 72 6.735 -3.687 6.093 1.00 0.00 C ATOM 1024 O ILE A 72 7.797 -3.833 6.706 1.00 0.00 O ATOM 1025 CB ILE A 72 7.255 -3.146 3.678 1.00 0.00 C ATOM 1026 CG1 ILE A 72 7.315 -2.042 2.605 1.00 0.00 C ATOM 1027 CG2 ILE A 72 6.451 -4.342 3.115 1.00 0.00 C ATOM 1028 CD1 ILE A 72 8.386 -2.367 1.567 1.00 0.00 C ATOM 0 H ILE A 72 8.216 -1.475 5.693 1.00 0.00 H new ATOM 0 HA ILE A 72 5.577 -2.440 4.761 1.00 0.00 H new ATOM 0 HB ILE A 72 8.271 -3.459 3.917 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.345 -1.946 2.118 1.00 0.00 H new ATOM 0 HG13 ILE A 72 7.533 -1.082 3.073 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.912 -4.687 2.189 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.448 -5.153 3.843 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.426 -4.030 2.916 1.00 0.00 H new ATOM 0 HD11 ILE A 72 8.416 -1.578 0.816 1.00 0.00 H new ATOM 0 HD12 ILE A 72 9.357 -2.439 2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 72 8.151 -3.317 1.086 1.00 0.00 H new ATOM 1040 N CYS A 73 5.688 -4.488 6.287 1.00 0.00 N ATOM 1041 CA CYS A 73 5.704 -5.679 7.124 1.00 0.00 C ATOM 1042 C CYS A 73 5.283 -6.901 6.308 1.00 0.00 C ATOM 1043 O CYS A 73 4.295 -6.849 5.575 1.00 0.00 O ATOM 1044 CB CYS A 73 4.807 -5.482 8.349 1.00 0.00 C ATOM 1045 SG CYS A 73 5.671 -4.440 9.565 1.00 0.00 S ATOM 0 H CYS A 73 4.781 -4.318 5.852 1.00 0.00 H new ATOM 0 HA CYS A 73 6.719 -5.850 7.483 1.00 0.00 H new ATOM 0 HB2 CYS A 73 3.867 -5.015 8.055 1.00 0.00 H new ATOM 0 HB3 CYS A 73 4.558 -6.447 8.791 1.00 0.00 H new ATOM 0 HG CYS A 73 6.425 -5.185 10.317 1.00 0.00 H new ATOM 1051 N VAL A 74 6.025 -7.994 6.479 1.00 0.00 N ATOM 1052 CA VAL A 74 5.813 -9.293 5.834 1.00 0.00 C ATOM 1053 C VAL A 74 6.007 -10.368 6.913 1.00 0.00 C ATOM 1054 O VAL A 74 6.690 -10.082 7.899 1.00 0.00 O ATOM 1055 CB VAL A 74 6.789 -9.469 4.640 1.00 0.00 C ATOM 1056 CG1 VAL A 74 6.660 -8.347 3.599 1.00 0.00 C ATOM 1057 CG2 VAL A 74 8.256 -9.564 5.062 1.00 0.00 C ATOM 0 H VAL A 74 6.832 -8.000 7.103 1.00 0.00 H new ATOM 0 HA VAL A 74 4.809 -9.374 5.417 1.00 0.00 H new ATOM 0 HB VAL A 74 6.490 -10.418 4.194 1.00 0.00 H new ATOM 0 HG11 VAL A 74 7.366 -8.521 2.787 1.00 0.00 H new ATOM 0 HG12 VAL A 74 5.645 -8.334 3.201 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.877 -7.388 4.069 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.882 -9.686 4.178 1.00 0.00 H new ATOM 0 HG22 VAL A 74 8.543 -8.653 5.587 1.00 0.00 H new ATOM 0 HG23 VAL A 74 8.390 -10.421 5.722 1.00 0.00 H new ATOM 1067 N PRO A 75 5.433 -11.576 6.811 1.00 0.00 N ATOM 1068 CA PRO A 75 5.621 -12.596 7.830 1.00 0.00 C ATOM 1069 C PRO A 75 7.069 -13.093 7.796 1.00 0.00 C ATOM 1070 O PRO A 75 7.708 -13.058 6.741 1.00 0.00 O ATOM 1071 CB PRO A 75 4.617 -13.695 7.487 1.00 0.00 C ATOM 1072 CG PRO A 75 4.410 -13.560 5.982 1.00 0.00 C ATOM 1073 CD PRO A 75 4.649 -12.082 5.700 1.00 0.00 C ATOM 0 HA PRO A 75 5.451 -12.230 8.843 1.00 0.00 H new ATOM 0 HB2 PRO A 75 5.001 -14.681 7.749 1.00 0.00 H new ATOM 0 HB3 PRO A 75 3.682 -13.563 8.031 1.00 0.00 H new ATOM 0 HG2 PRO A 75 5.106 -14.189 5.427 1.00 0.00 H new ATOM 0 HG3 PRO A 75 3.405 -13.863 5.690 1.00 0.00 H new ATOM 0 HD2 PRO A 75 5.179 -11.947 4.757 1.00 0.00 H new ATOM 0 HD3 PRO A 75 3.704 -11.545 5.614 1.00 0.00 H new ATOM 1081 N GLU A 76 7.590 -13.593 8.918 1.00 0.00 N ATOM 1082 CA GLU A 76 8.986 -14.036 8.988 1.00 0.00 C ATOM 1083 C GLU A 76 9.311 -15.130 7.960 1.00 0.00 C ATOM 1084 O GLU A 76 10.437 -15.206 7.460 1.00 0.00 O ATOM 1085 CB GLU A 76 9.401 -14.461 10.400 1.00 0.00 C ATOM 1086 CG GLU A 76 8.649 -15.682 10.939 1.00 0.00 C ATOM 1087 CD GLU A 76 9.230 -16.151 12.273 1.00 0.00 C ATOM 1088 OE1 GLU A 76 8.961 -15.530 13.327 1.00 0.00 O ATOM 1089 OE2 GLU A 76 9.972 -17.166 12.279 1.00 0.00 O ATOM 0 H GLU A 76 7.069 -13.702 9.788 1.00 0.00 H new ATOM 0 HA GLU A 76 9.583 -13.162 8.728 1.00 0.00 H new ATOM 0 HB2 GLU A 76 10.469 -14.677 10.402 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.244 -13.623 11.080 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.595 -15.435 11.066 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.701 -16.493 10.213 1.00 0.00 H new ATOM 1096 N GLU A 77 8.318 -15.950 7.612 1.00 0.00 N ATOM 1097 CA GLU A 77 8.445 -17.028 6.639 1.00 0.00 C ATOM 1098 C GLU A 77 8.681 -16.480 5.228 1.00 0.00 C ATOM 1099 O GLU A 77 9.355 -17.124 4.420 1.00 0.00 O ATOM 1100 CB GLU A 77 7.187 -17.917 6.677 1.00 0.00 C ATOM 1101 CG GLU A 77 7.578 -19.357 7.010 1.00 0.00 C ATOM 1102 CD GLU A 77 6.369 -20.251 7.276 1.00 0.00 C ATOM 1103 OE1 GLU A 77 5.812 -20.173 8.398 1.00 0.00 O ATOM 1104 OE2 GLU A 77 6.012 -21.038 6.366 1.00 0.00 O ATOM 0 H GLU A 77 7.382 -15.878 8.011 1.00 0.00 H new ATOM 0 HA GLU A 77 9.313 -17.631 6.904 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.487 -17.540 7.422 1.00 0.00 H new ATOM 0 HB3 GLU A 77 6.677 -17.883 5.714 1.00 0.00 H new ATOM 0 HG2 GLU A 77 8.157 -19.772 6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.226 -19.359 7.886 1.00 0.00 H new ATOM 1111 N ALA A 78 8.165 -15.287 4.932 1.00 0.00 N ATOM 1112 CA ALA A 78 8.351 -14.606 3.662 1.00 0.00 C ATOM 1113 C ALA A 78 9.469 -13.564 3.743 1.00 0.00 C ATOM 1114 O ALA A 78 9.889 -13.047 2.713 1.00 0.00 O ATOM 1115 CB ALA A 78 7.048 -13.914 3.284 1.00 0.00 C ATOM 0 H ALA A 78 7.592 -14.758 5.590 1.00 0.00 H new ATOM 0 HA ALA A 78 8.631 -15.344 2.910 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.173 -13.398 2.332 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.255 -14.656 3.193 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.782 -13.192 4.056 1.00 0.00 H new ATOM 1121 N LEU A 79 9.962 -13.224 4.936 1.00 0.00 N ATOM 1122 CA LEU A 79 10.879 -12.107 5.130 1.00 0.00 C ATOM 1123 C LEU A 79 12.129 -12.289 4.275 1.00 0.00 C ATOM 1124 O LEU A 79 12.473 -11.415 3.484 1.00 0.00 O ATOM 1125 CB LEU A 79 11.185 -11.955 6.626 1.00 0.00 C ATOM 1126 CG LEU A 79 11.982 -10.690 6.980 1.00 0.00 C ATOM 1127 CD1 LEU A 79 11.175 -9.411 6.749 1.00 0.00 C ATOM 1128 CD2 LEU A 79 12.373 -10.752 8.460 1.00 0.00 C ATOM 0 H LEU A 79 9.733 -13.721 5.797 1.00 0.00 H new ATOM 0 HA LEU A 79 10.418 -11.177 4.797 1.00 0.00 H new ATOM 0 HB2 LEU A 79 10.245 -11.945 7.179 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.743 -12.829 6.962 1.00 0.00 H new ATOM 0 HG LEU A 79 12.858 -10.659 6.332 1.00 0.00 H new ATOM 0 HD11 LEU A 79 11.782 -8.545 7.014 1.00 0.00 H new ATOM 0 HD12 LEU A 79 10.889 -9.346 5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.279 -9.429 7.369 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.940 -9.859 8.724 1.00 0.00 H new ATOM 0 HD22 LEU A 79 11.473 -10.805 9.072 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.985 -11.636 8.638 1.00 0.00 H new ATOM 1140 N ASP A 80 12.778 -13.450 4.376 1.00 0.00 N ATOM 1141 CA ASP A 80 13.974 -13.746 3.587 1.00 0.00 C ATOM 1142 C ASP A 80 13.674 -13.798 2.084 1.00 0.00 C ATOM 1143 O ASP A 80 14.533 -13.497 1.259 1.00 0.00 O ATOM 1144 CB ASP A 80 14.597 -15.070 4.049 1.00 0.00 C ATOM 1145 CG ASP A 80 16.119 -14.960 4.125 1.00 0.00 C ATOM 1146 OD1 ASP A 80 16.813 -15.129 3.102 1.00 0.00 O ATOM 1147 OD2 ASP A 80 16.621 -14.650 5.235 1.00 0.00 O ATOM 0 H ASP A 80 12.493 -14.204 5.000 1.00 0.00 H new ATOM 0 HA ASP A 80 14.683 -12.935 3.750 1.00 0.00 H new ATOM 0 HB2 ASP A 80 14.199 -15.342 5.027 1.00 0.00 H new ATOM 0 HB3 ASP A 80 14.320 -15.867 3.359 1.00 0.00 H new ATOM 1152 N ARG A 81 12.432 -14.138 1.719 1.00 0.00 N ATOM 1153 CA ARG A 81 11.937 -14.178 0.356 1.00 0.00 C ATOM 1154 C ARG A 81 12.069 -12.793 -0.277 1.00 0.00 C ATOM 1155 O ARG A 81 12.779 -12.660 -1.271 1.00 0.00 O ATOM 1156 CB ARG A 81 10.488 -14.717 0.371 1.00 0.00 C ATOM 1157 CG ARG A 81 10.274 -15.963 -0.486 1.00 0.00 C ATOM 1158 CD ARG A 81 10.127 -17.228 0.370 1.00 0.00 C ATOM 1159 NE ARG A 81 8.736 -17.496 0.749 1.00 0.00 N ATOM 1160 CZ ARG A 81 8.249 -18.595 1.335 1.00 0.00 C ATOM 1161 NH1 ARG A 81 9.033 -19.468 1.965 1.00 0.00 N ATOM 1162 NH2 ARG A 81 6.947 -18.820 1.255 1.00 0.00 N ATOM 0 H ARG A 81 11.722 -14.402 2.402 1.00 0.00 H new ATOM 0 HA ARG A 81 12.526 -14.855 -0.263 1.00 0.00 H new ATOM 0 HB2 ARG A 81 10.208 -14.945 1.399 1.00 0.00 H new ATOM 0 HB3 ARG A 81 9.817 -13.932 0.024 1.00 0.00 H new ATOM 0 HG2 ARG A 81 9.382 -15.833 -1.098 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.115 -16.083 -1.169 1.00 0.00 H new ATOM 0 HD2 ARG A 81 10.520 -18.082 -0.181 1.00 0.00 H new ATOM 0 HD3 ARG A 81 10.731 -17.124 1.271 1.00 0.00 H new ATOM 0 HE ARG A 81 8.062 -16.759 0.542 1.00 0.00 H new ATOM 0 HH11 ARG A 81 10.039 -19.309 2.012 1.00 0.00 H new ATOM 0 HH12 ARG A 81 8.627 -20.296 2.401 1.00 0.00 H new ATOM 0 HH21 ARG A 81 6.346 -18.164 0.757 1.00 0.00 H new ATOM 0 HH22 ARG A 81 6.545 -19.650 1.692 1.00 0.00 H new ATOM 1176 N TYR A 82 11.446 -11.749 0.283 1.00 0.00 N ATOM 1177 CA TYR A 82 11.564 -10.402 -0.279 1.00 0.00 C ATOM 1178 C TYR A 82 13.022 -9.897 -0.231 1.00 0.00 C ATOM 1179 O TYR A 82 13.414 -9.073 -1.061 1.00 0.00 O ATOM 1180 CB TYR A 82 10.646 -9.422 0.472 1.00 0.00 C ATOM 1181 CG TYR A 82 9.149 -9.675 0.362 1.00 0.00 C ATOM 1182 CD1 TYR A 82 8.519 -10.523 1.287 1.00 0.00 C ATOM 1183 CD2 TYR A 82 8.367 -9.017 -0.611 1.00 0.00 C ATOM 1184 CE1 TYR A 82 7.139 -10.770 1.217 1.00 0.00 C ATOM 1185 CE2 TYR A 82 6.976 -9.236 -0.672 1.00 0.00 C ATOM 1186 CZ TYR A 82 6.359 -10.127 0.237 1.00 0.00 C ATOM 1187 OH TYR A 82 5.015 -10.340 0.209 1.00 0.00 O ATOM 0 H TYR A 82 10.861 -11.811 1.116 1.00 0.00 H new ATOM 0 HA TYR A 82 11.255 -10.453 -1.323 1.00 0.00 H new ATOM 0 HB2 TYR A 82 10.918 -9.440 1.527 1.00 0.00 H new ATOM 0 HB3 TYR A 82 10.850 -8.415 0.107 1.00 0.00 H new ATOM 0 HD1 TYR A 82 9.105 -10.992 2.064 1.00 0.00 H new ATOM 0 HD2 TYR A 82 8.836 -8.343 -1.312 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.676 -11.453 1.914 1.00 0.00 H new ATOM 0 HE2 TYR A 82 6.381 -8.723 -1.413 1.00 0.00 H new ATOM 0 HH TYR A 82 4.657 -10.059 -0.659 1.00 0.00 H new ATOM 1197 N ARG A 83 13.844 -10.381 0.710 1.00 0.00 N ATOM 1198 CA ARG A 83 15.263 -10.018 0.812 1.00 0.00 C ATOM 1199 C ARG A 83 16.152 -10.638 -0.270 1.00 0.00 C ATOM 1200 O ARG A 83 17.259 -10.140 -0.491 1.00 0.00 O ATOM 1201 CB ARG A 83 15.774 -10.340 2.223 1.00 0.00 C ATOM 1202 CG ARG A 83 15.158 -9.381 3.268 1.00 0.00 C ATOM 1203 CD ARG A 83 16.088 -9.131 4.462 1.00 0.00 C ATOM 1204 NE ARG A 83 15.625 -9.793 5.688 1.00 0.00 N ATOM 1205 CZ ARG A 83 15.812 -11.066 6.033 1.00 0.00 C ATOM 1206 NH1 ARG A 83 16.489 -11.876 5.223 1.00 0.00 N ATOM 1207 NH2 ARG A 83 15.323 -11.504 7.184 1.00 0.00 N ATOM 0 H ARG A 83 13.540 -11.040 1.427 1.00 0.00 H new ATOM 0 HA ARG A 83 15.329 -8.945 0.634 1.00 0.00 H new ATOM 0 HB2 ARG A 83 15.524 -11.370 2.478 1.00 0.00 H new ATOM 0 HB3 ARG A 83 16.861 -10.260 2.247 1.00 0.00 H new ATOM 0 HG2 ARG A 83 14.924 -8.430 2.789 1.00 0.00 H new ATOM 0 HG3 ARG A 83 14.217 -9.797 3.627 1.00 0.00 H new ATOM 0 HD2 ARG A 83 17.089 -9.486 4.218 1.00 0.00 H new ATOM 0 HD3 ARG A 83 16.164 -8.058 4.640 1.00 0.00 H new ATOM 0 HE ARG A 83 15.103 -9.215 6.347 1.00 0.00 H new ATOM 0 HH11 ARG A 83 16.862 -11.521 4.342 1.00 0.00 H new ATOM 0 HH12 ARG A 83 16.635 -12.852 5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 83 14.810 -10.869 7.795 1.00 0.00 H new ATOM 0 HH22 ARG A 83 15.460 -12.477 7.459 1.00 0.00 H new ATOM 1221 N ARG A 84 15.704 -11.684 -0.976 1.00 0.00 N ATOM 1222 CA ARG A 84 16.498 -12.299 -2.047 1.00 0.00 C ATOM 1223 C ARG A 84 16.032 -11.916 -3.452 1.00 0.00 C ATOM 1224 O ARG A 84 16.718 -12.216 -4.430 1.00 0.00 O ATOM 1225 CB ARG A 84 16.589 -13.805 -1.807 1.00 0.00 C ATOM 1226 CG ARG A 84 15.385 -14.598 -2.328 1.00 0.00 C ATOM 1227 CD ARG A 84 15.147 -15.815 -1.435 1.00 0.00 C ATOM 1228 NE ARG A 84 14.309 -16.809 -2.117 1.00 0.00 N ATOM 1229 CZ ARG A 84 13.920 -18.000 -1.657 1.00 0.00 C ATOM 1230 NH1 ARG A 84 14.117 -18.354 -0.390 1.00 0.00 N ATOM 1231 NH2 ARG A 84 13.341 -18.829 -2.515 1.00 0.00 N ATOM 0 H ARG A 84 14.795 -12.122 -0.825 1.00 0.00 H new ATOM 0 HA ARG A 84 17.508 -11.892 -2.005 1.00 0.00 H new ATOM 0 HB2 ARG A 84 17.493 -14.184 -2.284 1.00 0.00 H new ATOM 0 HB3 ARG A 84 16.693 -13.985 -0.737 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.498 -13.965 -2.341 1.00 0.00 H new ATOM 0 HG3 ARG A 84 15.564 -14.917 -3.355 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.102 -16.264 -1.163 1.00 0.00 H new ATOM 0 HD3 ARG A 84 14.666 -15.503 -0.508 1.00 0.00 H new ATOM 0 HE ARG A 84 13.986 -16.560 -3.052 1.00 0.00 H new ATOM 0 HH11 ARG A 84 14.575 -17.709 0.254 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.810 -19.270 -0.063 1.00 0.00 H new ATOM 0 HH21 ARG A 84 13.208 -18.547 -3.486 1.00 0.00 H new ATOM 0 HH22 ARG A 84 13.029 -19.749 -2.204 1.00 0.00 H new ATOM 1245 N ASP A 85 14.883 -11.255 -3.552 1.00 0.00 N ATOM 1246 CA ASP A 85 14.267 -10.857 -4.811 1.00 0.00 C ATOM 1247 C ASP A 85 15.170 -9.936 -5.616 1.00 0.00 C ATOM 1248 O ASP A 85 15.925 -9.160 -5.037 1.00 0.00 O ATOM 1249 CB ASP A 85 12.996 -10.076 -4.511 1.00 0.00 C ATOM 1250 CG ASP A 85 12.203 -9.895 -5.792 1.00 0.00 C ATOM 1251 OD1 ASP A 85 11.669 -10.899 -6.296 1.00 0.00 O ATOM 1252 OD2 ASP A 85 12.183 -8.779 -6.351 1.00 0.00 O ATOM 0 H ASP A 85 14.340 -10.974 -2.735 1.00 0.00 H new ATOM 0 HA ASP A 85 14.072 -11.765 -5.382 1.00 0.00 H new ATOM 0 HB2 ASP A 85 12.396 -10.606 -3.771 1.00 0.00 H new ATOM 0 HB3 ASP A 85 13.245 -9.105 -4.084 1.00 0.00 H new ATOM 1257 N TYR A 86 15.057 -9.953 -6.942 1.00 0.00 N ATOM 1258 CA TYR A 86 15.814 -9.065 -7.807 1.00 0.00 C ATOM 1259 C TYR A 86 15.522 -7.592 -7.501 1.00 0.00 C ATOM 1260 O TYR A 86 16.446 -6.807 -7.293 1.00 0.00 O ATOM 1261 CB TYR A 86 15.493 -9.417 -9.264 1.00 0.00 C ATOM 1262 CG TYR A 86 16.520 -8.875 -10.229 1.00 0.00 C ATOM 1263 CD1 TYR A 86 17.829 -9.377 -10.167 1.00 0.00 C ATOM 1264 CD2 TYR A 86 16.201 -7.854 -11.144 1.00 0.00 C ATOM 1265 CE1 TYR A 86 18.820 -8.867 -11.014 1.00 0.00 C ATOM 1266 CE2 TYR A 86 17.195 -7.330 -11.989 1.00 0.00 C ATOM 1267 CZ TYR A 86 18.512 -7.838 -11.925 1.00 0.00 C ATOM 1268 OH TYR A 86 19.503 -7.319 -12.696 1.00 0.00 O ATOM 0 H TYR A 86 14.435 -10.587 -7.444 1.00 0.00 H new ATOM 0 HA TYR A 86 16.880 -9.204 -7.627 1.00 0.00 H new ATOM 0 HB2 TYR A 86 15.437 -10.500 -9.369 1.00 0.00 H new ATOM 0 HB3 TYR A 86 14.511 -9.020 -9.523 1.00 0.00 H new ATOM 0 HD1 TYR A 86 18.073 -10.159 -9.463 1.00 0.00 H new ATOM 0 HD2 TYR A 86 15.192 -7.473 -11.197 1.00 0.00 H new ATOM 0 HE1 TYR A 86 19.823 -9.264 -10.969 1.00 0.00 H new ATOM 0 HE2 TYR A 86 16.953 -6.541 -12.685 1.00 0.00 H new ATOM 0 HH TYR A 86 19.135 -6.619 -13.274 1.00 0.00 H new ATOM 1278 N PHE A 87 14.243 -7.223 -7.449 1.00 0.00 N ATOM 1279 CA PHE A 87 13.783 -5.863 -7.216 1.00 0.00 C ATOM 1280 C PHE A 87 13.781 -5.592 -5.718 1.00 0.00 C ATOM 1281 O PHE A 87 14.493 -4.699 -5.261 1.00 0.00 O ATOM 1282 CB PHE A 87 12.384 -5.688 -7.829 1.00 0.00 C ATOM 1283 CG PHE A 87 11.619 -4.454 -7.380 1.00 0.00 C ATOM 1284 CD1 PHE A 87 12.067 -3.162 -7.714 1.00 0.00 C ATOM 1285 CD2 PHE A 87 10.429 -4.604 -6.640 1.00 0.00 C ATOM 1286 CE1 PHE A 87 11.307 -2.037 -7.344 1.00 0.00 C ATOM 1287 CE2 PHE A 87 9.674 -3.484 -6.266 1.00 0.00 C ATOM 1288 CZ PHE A 87 10.098 -2.200 -6.642 1.00 0.00 C ATOM 0 H PHE A 87 13.478 -7.886 -7.572 1.00 0.00 H new ATOM 0 HA PHE A 87 14.449 -5.143 -7.692 1.00 0.00 H new ATOM 0 HB2 PHE A 87 12.484 -5.657 -8.914 1.00 0.00 H new ATOM 0 HB3 PHE A 87 11.789 -6.569 -7.589 1.00 0.00 H new ATOM 0 HD1 PHE A 87 12.994 -3.034 -8.254 1.00 0.00 H new ATOM 0 HD2 PHE A 87 10.096 -5.592 -6.358 1.00 0.00 H new ATOM 0 HE1 PHE A 87 11.652 -1.046 -7.599 1.00 0.00 H new ATOM 0 HE2 PHE A 87 8.769 -3.609 -5.690 1.00 0.00 H new ATOM 0 HZ PHE A 87 9.497 -1.338 -6.393 1.00 0.00 H new ATOM 1298 N TRP A 88 13.000 -6.358 -4.942 1.00 0.00 N ATOM 1299 CA TRP A 88 12.663 -6.005 -3.562 1.00 0.00 C ATOM 1300 C TRP A 88 13.879 -5.869 -2.628 1.00 0.00 C ATOM 1301 O TRP A 88 13.745 -5.197 -1.601 1.00 0.00 O ATOM 1302 CB TRP A 88 11.593 -6.945 -2.976 1.00 0.00 C ATOM 1303 CG TRP A 88 10.212 -6.811 -3.547 1.00 0.00 C ATOM 1304 CD1 TRP A 88 9.669 -7.525 -4.560 1.00 0.00 C ATOM 1305 CD2 TRP A 88 9.175 -5.873 -3.143 1.00 0.00 C ATOM 1306 NE1 TRP A 88 8.370 -7.113 -4.797 1.00 0.00 N ATOM 1307 CE2 TRP A 88 8.015 -6.093 -3.946 1.00 0.00 C ATOM 1308 CE3 TRP A 88 9.111 -4.841 -2.184 1.00 0.00 C ATOM 1309 CZ2 TRP A 88 6.849 -5.335 -3.794 1.00 0.00 C ATOM 1310 CZ3 TRP A 88 7.945 -4.070 -2.027 1.00 0.00 C ATOM 1311 CH2 TRP A 88 6.812 -4.326 -2.821 1.00 0.00 C ATOM 0 H TRP A 88 12.587 -7.236 -5.256 1.00 0.00 H new ATOM 0 HA TRP A 88 12.236 -5.004 -3.620 1.00 0.00 H new ATOM 0 HB2 TRP A 88 11.925 -7.973 -3.118 1.00 0.00 H new ATOM 0 HB3 TRP A 88 11.538 -6.774 -1.901 1.00 0.00 H new ATOM 0 HD1 TRP A 88 10.178 -8.306 -5.106 1.00 0.00 H new ATOM 0 HE1 TRP A 88 7.757 -7.512 -5.508 1.00 0.00 H new ATOM 0 HE3 TRP A 88 9.970 -4.640 -1.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 5.988 -5.525 -4.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 7.919 -3.278 -1.293 1.00 0.00 H new ATOM 0 HH2 TRP A 88 5.913 -3.745 -2.681 1.00 0.00 H new ATOM 1322 N GLN A 89 15.072 -6.365 -2.998 1.00 0.00 N ATOM 1323 CA GLN A 89 16.344 -6.018 -2.374 1.00 0.00 C ATOM 1324 C GLN A 89 16.491 -4.524 -2.114 1.00 0.00 C ATOM 1325 O GLN A 89 16.828 -4.127 -1.001 1.00 0.00 O ATOM 1326 CB GLN A 89 17.474 -6.449 -3.326 1.00 0.00 C ATOM 1327 CG GLN A 89 17.971 -7.859 -3.026 1.00 0.00 C ATOM 1328 CD GLN A 89 19.061 -8.265 -4.019 1.00 0.00 C ATOM 1329 OE1 GLN A 89 20.222 -7.873 -3.916 1.00 0.00 O ATOM 1330 NE2 GLN A 89 18.711 -9.053 -5.016 1.00 0.00 N ATOM 0 H GLN A 89 15.172 -7.035 -3.760 1.00 0.00 H new ATOM 0 HA GLN A 89 16.389 -6.527 -1.411 1.00 0.00 H new ATOM 0 HB2 GLN A 89 17.118 -6.402 -4.355 1.00 0.00 H new ATOM 0 HB3 GLN A 89 18.304 -5.747 -3.244 1.00 0.00 H new ATOM 0 HG2 GLN A 89 18.362 -7.905 -2.009 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.141 -8.563 -3.080 1.00 0.00 H new ATOM 0 HE21 GLN A 89 17.747 -9.375 -5.097 1.00 0.00 H new ATOM 0 HE22 GLN A 89 19.404 -9.340 -5.707 1.00 0.00 H new ATOM 1339 N THR A 90 16.225 -3.695 -3.121 1.00 0.00 N ATOM 1340 CA THR A 90 16.447 -2.260 -3.013 1.00 0.00 C ATOM 1341 C THR A 90 15.669 -1.648 -1.831 1.00 0.00 C ATOM 1342 O THR A 90 16.165 -0.720 -1.190 1.00 0.00 O ATOM 1343 CB THR A 90 16.148 -1.615 -4.382 1.00 0.00 C ATOM 1344 OG1 THR A 90 16.783 -0.358 -4.491 1.00 0.00 O ATOM 1345 CG2 THR A 90 14.655 -1.475 -4.660 1.00 0.00 C ATOM 0 H THR A 90 15.854 -3.996 -4.022 1.00 0.00 H new ATOM 0 HA THR A 90 17.490 -2.051 -2.774 1.00 0.00 H new ATOM 0 HB THR A 90 16.551 -2.291 -5.136 1.00 0.00 H new ATOM 0 HG1 THR A 90 16.583 0.035 -5.366 1.00 0.00 H new ATOM 0 HG21 THR A 90 14.508 -1.015 -5.637 1.00 0.00 H new ATOM 0 HG22 THR A 90 14.189 -2.460 -4.649 1.00 0.00 H new ATOM 0 HG23 THR A 90 14.199 -0.850 -3.893 1.00 0.00 H new ATOM 1353 N TYR A 91 14.503 -2.198 -1.480 1.00 0.00 N ATOM 1354 CA TYR A 91 13.632 -1.700 -0.417 1.00 0.00 C ATOM 1355 C TYR A 91 13.889 -2.393 0.934 1.00 0.00 C ATOM 1356 O TYR A 91 13.061 -2.301 1.842 1.00 0.00 O ATOM 1357 CB TYR A 91 12.166 -1.830 -0.865 1.00 0.00 C ATOM 1358 CG TYR A 91 11.725 -0.764 -1.853 1.00 0.00 C ATOM 1359 CD1 TYR A 91 11.335 0.508 -1.382 1.00 0.00 C ATOM 1360 CD2 TYR A 91 11.608 -1.057 -3.224 1.00 0.00 C ATOM 1361 CE1 TYR A 91 10.833 1.482 -2.267 1.00 0.00 C ATOM 1362 CE2 TYR A 91 11.124 -0.081 -4.112 1.00 0.00 C ATOM 1363 CZ TYR A 91 10.721 1.186 -3.642 1.00 0.00 C ATOM 1364 OH TYR A 91 10.130 2.054 -4.503 1.00 0.00 O ATOM 0 H TYR A 91 14.130 -3.027 -1.943 1.00 0.00 H new ATOM 0 HA TYR A 91 13.861 -0.648 -0.247 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.020 -2.811 -1.316 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.523 -1.785 0.014 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.423 0.737 -0.330 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.890 -2.032 -3.594 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.535 2.451 -1.895 1.00 0.00 H new ATOM 0 HE2 TYR A 91 11.060 -0.304 -5.167 1.00 0.00 H new ATOM 0 HH TYR A 91 10.146 1.679 -5.408 1.00 0.00 H new ATOM 1374 N ALA A 92 15.014 -3.094 1.122 1.00 0.00 N ATOM 1375 CA ALA A 92 15.303 -3.841 2.338 1.00 0.00 C ATOM 1376 C ALA A 92 15.413 -2.929 3.565 1.00 0.00 C ATOM 1377 O ALA A 92 15.220 -3.390 4.691 1.00 0.00 O ATOM 1378 CB ALA A 92 16.588 -4.645 2.152 1.00 0.00 C ATOM 0 H ALA A 92 15.753 -3.155 0.422 1.00 0.00 H new ATOM 0 HA ALA A 92 14.469 -4.519 2.520 1.00 0.00 H new ATOM 0 HB1 ALA A 92 16.803 -5.203 3.063 1.00 0.00 H new ATOM 0 HB2 ALA A 92 16.466 -5.340 1.321 1.00 0.00 H new ATOM 0 HB3 ALA A 92 17.414 -3.967 1.939 1.00 0.00 H new ATOM 1384 N ALA A 93 15.663 -1.632 3.357 1.00 0.00 N ATOM 1385 CA ALA A 93 15.658 -0.623 4.403 1.00 0.00 C ATOM 1386 C ALA A 93 14.259 -0.363 4.978 1.00 0.00 C ATOM 1387 O ALA A 93 14.134 0.360 5.959 1.00 0.00 O ATOM 1388 CB ALA A 93 16.253 0.692 3.884 1.00 0.00 C ATOM 0 H ALA A 93 15.878 -1.254 2.434 1.00 0.00 H new ATOM 0 HA ALA A 93 16.274 -1.016 5.212 1.00 0.00 H new ATOM 0 HB1 ALA A 93 16.241 1.436 4.680 1.00 0.00 H new ATOM 0 HB2 ALA A 93 17.280 0.524 3.560 1.00 0.00 H new ATOM 0 HB3 ALA A 93 15.661 1.052 3.042 1.00 0.00 H new ATOM 1394 N TRP A 94 13.205 -0.920 4.382 1.00 0.00 N ATOM 1395 CA TRP A 94 11.838 -0.757 4.842 1.00 0.00 C ATOM 1396 C TRP A 94 11.172 -2.124 5.017 1.00 0.00 C ATOM 1397 O TRP A 94 9.946 -2.196 4.983 1.00 0.00 O ATOM 1398 CB TRP A 94 11.063 0.154 3.874 1.00 0.00 C ATOM 1399 CG TRP A 94 11.598 1.541 3.683 1.00 0.00 C ATOM 1400 CD1 TRP A 94 11.184 2.643 4.346 1.00 0.00 C ATOM 1401 CD2 TRP A 94 12.605 2.014 2.744 1.00 0.00 C ATOM 1402 NE1 TRP A 94 11.844 3.761 3.867 1.00 0.00 N ATOM 1403 CE2 TRP A 94 12.802 3.412 2.944 1.00 0.00 C ATOM 1404 CE3 TRP A 94 13.347 1.400 1.717 1.00 0.00 C ATOM 1405 CZ2 TRP A 94 13.729 4.151 2.196 1.00 0.00 C ATOM 1406 CZ3 TRP A 94 14.256 2.136 0.932 1.00 0.00 C ATOM 1407 CH2 TRP A 94 14.453 3.506 1.178 1.00 0.00 C ATOM 0 H TRP A 94 13.285 -1.507 3.551 1.00 0.00 H new ATOM 0 HA TRP A 94 11.834 -0.272 5.818 1.00 0.00 H new ATOM 0 HB2 TRP A 94 11.029 -0.335 2.900 1.00 0.00 H new ATOM 0 HB3 TRP A 94 10.035 0.231 4.228 1.00 0.00 H new ATOM 0 HD1 TRP A 94 10.446 2.650 5.134 1.00 0.00 H new ATOM 0 HE1 TRP A 94 11.646 4.718 4.160 1.00 0.00 H new ATOM 0 HE3 TRP A 94 13.217 0.345 1.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 13.885 5.200 2.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 14.803 1.647 0.139 1.00 0.00 H new ATOM 0 HH2 TRP A 94 15.162 4.064 0.584 1.00 0.00 H new ATOM 1418 N ILE A 95 11.927 -3.220 5.169 1.00 0.00 N ATOM 1419 CA ILE A 95 11.372 -4.571 5.215 1.00 0.00 C ATOM 1420 C ILE A 95 11.666 -5.177 6.590 1.00 0.00 C ATOM 1421 O ILE A 95 12.802 -5.532 6.914 1.00 0.00 O ATOM 1422 CB ILE A 95 11.820 -5.382 3.972 1.00 0.00 C ATOM 1423 CG1 ILE A 95 11.025 -4.858 2.747 1.00 0.00 C ATOM 1424 CG2 ILE A 95 11.593 -6.896 4.122 1.00 0.00 C ATOM 1425 CD1 ILE A 95 11.532 -5.339 1.385 1.00 0.00 C ATOM 0 H ILE A 95 12.942 -3.190 5.263 1.00 0.00 H new ATOM 0 HA ILE A 95 10.285 -4.578 5.133 1.00 0.00 H new ATOM 0 HB ILE A 95 12.894 -5.242 3.848 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.983 -5.158 2.855 1.00 0.00 H new ATOM 0 HG13 ILE A 95 11.046 -3.768 2.760 1.00 0.00 H new ATOM 0 HG21 ILE A 95 11.927 -7.405 3.218 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.159 -7.266 4.977 1.00 0.00 H new ATOM 0 HG23 ILE A 95 10.532 -7.091 4.277 1.00 0.00 H new ATOM 0 HD11 ILE A 95 10.910 -4.917 0.596 1.00 0.00 H new ATOM 0 HD12 ILE A 95 12.564 -5.016 1.246 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.484 -6.427 1.343 1.00 0.00 H new ATOM 1437 N GLN A 96 10.619 -5.279 7.412 1.00 0.00 N ATOM 1438 CA GLN A 96 10.623 -5.891 8.740 1.00 0.00 C ATOM 1439 C GLN A 96 9.576 -7.009 8.838 1.00 0.00 C ATOM 1440 O GLN A 96 8.695 -7.088 7.972 1.00 0.00 O ATOM 1441 CB GLN A 96 10.400 -4.827 9.832 1.00 0.00 C ATOM 1442 CG GLN A 96 9.465 -3.669 9.486 1.00 0.00 C ATOM 1443 CD GLN A 96 9.333 -2.754 10.693 1.00 0.00 C ATOM 1444 OE1 GLN A 96 10.063 -1.781 10.819 1.00 0.00 O ATOM 1445 NE2 GLN A 96 8.438 -3.073 11.612 1.00 0.00 N ATOM 0 H GLN A 96 9.700 -4.918 7.155 1.00 0.00 H new ATOM 0 HA GLN A 96 11.603 -6.341 8.900 1.00 0.00 H new ATOM 0 HB2 GLN A 96 10.008 -5.327 10.718 1.00 0.00 H new ATOM 0 HB3 GLN A 96 11.370 -4.411 10.104 1.00 0.00 H new ATOM 0 HG2 GLN A 96 9.856 -3.113 8.634 1.00 0.00 H new ATOM 0 HG3 GLN A 96 8.486 -4.051 9.195 1.00 0.00 H new ATOM 0 HE21 GLN A 96 7.842 -3.890 11.481 1.00 0.00 H new ATOM 0 HE22 GLN A 96 8.344 -2.502 12.452 1.00 0.00 H new ATOM 1454 N PRO A 97 9.657 -7.870 9.869 1.00 0.00 N ATOM 1455 CA PRO A 97 8.645 -8.884 10.127 1.00 0.00 C ATOM 1456 C PRO A 97 7.302 -8.269 10.558 1.00 0.00 C ATOM 1457 O PRO A 97 7.213 -7.105 10.976 1.00 0.00 O ATOM 1458 CB PRO A 97 9.235 -9.800 11.207 1.00 0.00 C ATOM 1459 CG PRO A 97 10.245 -8.908 11.922 1.00 0.00 C ATOM 1460 CD PRO A 97 10.762 -8.008 10.808 1.00 0.00 C ATOM 0 HA PRO A 97 8.413 -9.444 9.221 1.00 0.00 H new ATOM 0 HB2 PRO A 97 8.466 -10.162 11.890 1.00 0.00 H new ATOM 0 HB3 PRO A 97 9.713 -10.677 10.771 1.00 0.00 H new ATOM 0 HG2 PRO A 97 9.779 -8.332 12.722 1.00 0.00 H new ATOM 0 HG3 PRO A 97 11.048 -9.490 12.375 1.00 0.00 H new ATOM 0 HD2 PRO A 97 11.068 -7.037 11.199 1.00 0.00 H new ATOM 0 HD3 PRO A 97 11.635 -8.446 10.324 1.00 0.00 H new ATOM 1468 N MET A 98 6.247 -9.077 10.471 1.00 0.00 N ATOM 1469 CA MET A 98 4.970 -8.850 11.128 1.00 0.00 C ATOM 1470 C MET A 98 5.094 -9.176 12.613 1.00 0.00 C ATOM 1471 O MET A 98 6.136 -9.617 13.102 1.00 0.00 O ATOM 1472 CB MET A 98 3.867 -9.721 10.500 1.00 0.00 C ATOM 1473 CG MET A 98 3.406 -9.210 9.142 1.00 0.00 C ATOM 1474 SD MET A 98 1.661 -9.549 8.802 1.00 0.00 S ATOM 1475 CE MET A 98 1.791 -10.480 7.261 1.00 0.00 C ATOM 0 H MET A 98 6.263 -9.936 9.921 1.00 0.00 H new ATOM 0 HA MET A 98 4.698 -7.802 11.001 1.00 0.00 H new ATOM 0 HB2 MET A 98 4.235 -10.741 10.392 1.00 0.00 H new ATOM 0 HB3 MET A 98 3.013 -9.760 11.176 1.00 0.00 H new ATOM 0 HG2 MET A 98 3.577 -8.135 9.089 1.00 0.00 H new ATOM 0 HG3 MET A 98 4.016 -9.668 8.363 1.00 0.00 H new ATOM 0 HE1 MET A 98 0.795 -10.640 6.847 1.00 0.00 H new ATOM 0 HE2 MET A 98 2.395 -9.920 6.547 1.00 0.00 H new ATOM 0 HE3 MET A 98 2.261 -11.444 7.457 1.00 0.00 H new ATOM 1485 N GLU A 99 4.009 -8.946 13.340 1.00 0.00 N ATOM 1486 CA GLU A 99 3.803 -9.405 14.699 1.00 0.00 C ATOM 1487 C GLU A 99 2.856 -10.610 14.709 1.00 0.00 C ATOM 1488 O GLU A 99 2.607 -11.251 13.677 1.00 0.00 O ATOM 1489 CB GLU A 99 3.341 -8.222 15.552 1.00 0.00 C ATOM 1490 CG GLU A 99 1.931 -7.719 15.198 1.00 0.00 C ATOM 1491 CD GLU A 99 1.750 -6.241 15.538 1.00 0.00 C ATOM 1492 OE1 GLU A 99 2.506 -5.406 14.984 1.00 0.00 O ATOM 1493 OE2 GLU A 99 0.825 -5.861 16.288 1.00 0.00 O ATOM 0 H GLU A 99 3.218 -8.412 12.980 1.00 0.00 H new ATOM 0 HA GLU A 99 4.730 -9.767 15.144 1.00 0.00 H new ATOM 0 HB2 GLU A 99 3.360 -8.513 16.602 1.00 0.00 H new ATOM 0 HB3 GLU A 99 4.050 -7.402 15.435 1.00 0.00 H new ATOM 0 HG2 GLU A 99 1.748 -7.872 14.134 1.00 0.00 H new ATOM 0 HG3 GLU A 99 1.190 -8.309 15.737 1.00 0.00 H new ATOM 1500 N GLN A 100 2.371 -10.950 15.899 1.00 0.00 N ATOM 1501 CA GLN A 100 1.620 -12.148 16.196 1.00 0.00 C ATOM 1502 C GLN A 100 0.371 -11.742 16.957 1.00 0.00 C ATOM 1503 O GLN A 100 -0.703 -12.332 16.712 1.00 0.00 O ATOM 1504 CB GLN A 100 2.560 -13.124 16.941 1.00 0.00 C ATOM 1505 CG GLN A 100 2.974 -12.721 18.369 1.00 0.00 C ATOM 1506 CD GLN A 100 2.113 -13.419 19.419 1.00 0.00 C ATOM 1507 OE1 GLN A 100 2.433 -14.516 19.870 1.00 0.00 O ATOM 1508 NE2 GLN A 100 0.986 -12.854 19.797 1.00 0.00 N ATOM 0 H GLN A 100 2.503 -10.360 16.721 1.00 0.00 H new ATOM 0 HA GLN A 100 1.273 -12.679 15.310 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.073 -14.098 16.989 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.464 -13.249 16.346 1.00 0.00 H new ATOM 0 HG2 GLN A 100 4.022 -12.973 18.530 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.885 -11.641 18.484 1.00 0.00 H new ATOM 0 HE21 GLN A 100 0.721 -11.943 19.422 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.377 -13.327 20.465 1.00 0.00 H new TER 1517 GLN A 100