USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 777 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 58 SER OG : rot -27:sc= 0.302 USER MOD Set 1.2: A 68 HIS : no HD1:sc= 0.826 K(o=3.2,f=-1.7!) USER MOD Set 1.3: A 81 THR OG1 : rot 119:sc= 1.61 USER MOD Set 1.4: A 84 ASN : amide:sc= 0.498 K(o=3.2,f=-3.8!) USER MOD Set 2.1: A 72 LYS NZ :NH3+ -153:sc= 0.326 (180deg=0) USER MOD Set 2.2: A 79 TYR OH : rot 180:sc= 0.304 USER MOD Set 3.1: A 2 LYS NZ :NH3+ -141:sc= 0.287 (180deg=0.00458) USER MOD Set 3.2: A 57 TYR OH : rot 30:sc= 0.0469 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 176:sc= 0.807 (180deg=0.584) USER MOD Single : A 3 SER OG : rot -7:sc= 0.73 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -170:sc= -0.219 USER MOD Single : A 23 ASN : amide:sc= 1.14 K(o=1.1,f=-0.16) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.0894 X(o=-0.089,f=-0.48) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.875 USER MOD Single : A 30 SER OG : rot 91:sc= 1.26 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -164:sc= -0.0244 (180deg=-0.226) USER MOD Single : A 39 SER OG : rot 79:sc= 0.281 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -102:sc= 1.28 USER MOD Single : A 49 ASN : amide:sc= -0.522 K(o=-0.52,f=-2.5!) USER MOD Single : A 60 TYR OH : rot -149:sc= 1.08 USER MOD Single : A 64 GLN : amide:sc= -1.97! K(o=-2!,f=-0.97) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 152:sc= -0.604 (180deg=-1.97!) USER MOD Single : A 75 HIS : no HD1:sc= -1.73 K(o=-1.7,f=-0.69) USER MOD Single : A 83 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0692) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.0148 X(o=-0.015,f=-0.02) USER MOD Single : A 97 THR OG1 : rot 41:sc= 0.0174 USER MOD Single : A 98 ASN : amide:sc= -0.243 X(o=-0.24,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.585 5.927 -7.706 1.00 0.00 N ATOM 2 CA MET A 1 -15.950 6.643 -8.838 1.00 0.00 C ATOM 3 C MET A 1 -14.455 6.810 -8.596 1.00 0.00 C ATOM 4 O MET A 1 -13.631 6.192 -9.272 1.00 0.00 O ATOM 5 CB MET A 1 -16.587 8.020 -9.038 1.00 0.00 C ATOM 6 CG MET A 1 -18.098 7.988 -9.165 1.00 0.00 C ATOM 7 SD MET A 1 -18.663 6.876 -10.461 1.00 0.00 S ATOM 8 CE MET A 1 -20.434 7.075 -10.309 1.00 0.00 C ATOM 0 H1 MET A 1 -17.613 5.882 -7.856 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.201 4.962 -7.646 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.387 6.434 -6.820 1.00 0.00 H new ATOM 0 HA MET A 1 -16.105 6.046 -9.736 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.317 8.660 -8.198 1.00 0.00 H new ATOM 0 HB3 MET A 1 -16.167 8.477 -9.934 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.532 7.680 -8.214 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.462 8.994 -9.371 1.00 0.00 H new ATOM 0 HE1 MET A 1 -20.935 6.449 -11.047 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.749 6.779 -9.308 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.699 8.119 -10.479 1.00 0.00 H new ATOM 18 N LYS A 2 -14.106 7.654 -7.634 1.00 0.00 N ATOM 19 CA LYS A 2 -12.712 7.889 -7.298 1.00 0.00 C ATOM 20 C LYS A 2 -12.427 7.373 -5.893 1.00 0.00 C ATOM 21 O LYS A 2 -11.431 6.685 -5.667 1.00 0.00 O ATOM 22 CB LYS A 2 -12.392 9.386 -7.401 1.00 0.00 C ATOM 23 CG LYS A 2 -10.909 9.710 -7.333 1.00 0.00 C ATOM 24 CD LYS A 2 -10.157 9.102 -8.506 1.00 0.00 C ATOM 25 CE LYS A 2 -10.634 9.662 -9.841 1.00 0.00 C ATOM 26 NZ LYS A 2 -9.934 9.025 -10.988 1.00 0.00 N ATOM 0 H LYS A 2 -14.771 8.187 -7.073 1.00 0.00 H new ATOM 0 HA LYS A 2 -12.076 7.353 -8.002 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -12.794 9.769 -8.339 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -12.905 9.912 -6.596 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -10.770 10.791 -7.330 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -10.495 9.333 -6.398 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -9.090 9.295 -8.392 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -10.288 8.020 -8.499 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -11.708 9.505 -9.938 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -10.466 10.739 -9.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -9.733 9.742 -11.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -9.041 8.605 -10.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -10.538 8.282 -11.394 1.00 0.00 H new ATOM 40 N SER A 3 -13.321 7.714 -4.966 1.00 0.00 N ATOM 41 CA SER A 3 -13.253 7.244 -3.584 1.00 0.00 C ATOM 42 C SER A 3 -11.938 7.653 -2.908 1.00 0.00 C ATOM 43 O SER A 3 -10.998 6.864 -2.808 1.00 0.00 O ATOM 44 CB SER A 3 -13.437 5.723 -3.529 1.00 0.00 C ATOM 45 OG SER A 3 -14.646 5.330 -4.169 1.00 0.00 O ATOM 0 H SER A 3 -14.115 8.326 -5.153 1.00 0.00 H new ATOM 0 HA SER A 3 -14.065 7.719 -3.033 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.591 5.233 -4.011 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.447 5.392 -2.491 1.00 0.00 H new ATOM 0 HG SER A 3 -15.165 6.127 -4.406 1.00 0.00 H new ATOM 51 N SER A 4 -11.879 8.898 -2.455 1.00 0.00 N ATOM 52 CA SER A 4 -10.691 9.413 -1.791 1.00 0.00 C ATOM 53 C SER A 4 -10.827 9.294 -0.277 1.00 0.00 C ATOM 54 O SER A 4 -11.683 9.935 0.330 1.00 0.00 O ATOM 55 CB SER A 4 -10.464 10.871 -2.188 1.00 0.00 C ATOM 56 OG SER A 4 -10.413 11.009 -3.598 1.00 0.00 O ATOM 0 H SER A 4 -12.642 9.570 -2.536 1.00 0.00 H new ATOM 0 HA SER A 4 -9.832 8.820 -2.105 1.00 0.00 H new ATOM 0 HB2 SER A 4 -11.266 11.491 -1.787 1.00 0.00 H new ATOM 0 HB3 SER A 4 -9.533 11.231 -1.749 1.00 0.00 H new ATOM 0 HG SER A 4 -10.269 11.950 -3.830 1.00 0.00 H new ATOM 62 N ILE A 5 -9.988 8.458 0.320 1.00 0.00 N ATOM 63 CA ILE A 5 -10.004 8.239 1.761 1.00 0.00 C ATOM 64 C ILE A 5 -8.604 8.453 2.336 1.00 0.00 C ATOM 65 O ILE A 5 -7.627 7.960 1.774 1.00 0.00 O ATOM 66 CB ILE A 5 -10.480 6.804 2.093 1.00 0.00 C ATOM 67 CG1 ILE A 5 -11.823 6.512 1.417 1.00 0.00 C ATOM 68 CG2 ILE A 5 -10.594 6.608 3.601 1.00 0.00 C ATOM 69 CD1 ILE A 5 -12.301 5.088 1.604 1.00 0.00 C ATOM 0 H ILE A 5 -9.281 7.916 -0.177 1.00 0.00 H new ATOM 0 HA ILE A 5 -10.698 8.952 2.207 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.738 6.104 1.709 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -12.575 7.194 1.814 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -11.736 6.720 0.351 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -10.930 5.593 3.812 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -9.621 6.771 4.064 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -11.313 7.320 4.007 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -13.257 4.956 1.098 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -11.569 4.400 1.181 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -12.422 4.881 2.667 1.00 0.00 H new ATOM 81 N PRO A 6 -8.484 9.205 3.446 1.00 0.00 N ATOM 82 CA PRO A 6 -7.194 9.448 4.103 1.00 0.00 C ATOM 83 C PRO A 6 -6.591 8.176 4.695 1.00 0.00 C ATOM 84 O PRO A 6 -7.307 7.228 5.037 1.00 0.00 O ATOM 85 CB PRO A 6 -7.530 10.444 5.216 1.00 0.00 C ATOM 86 CG PRO A 6 -8.993 10.286 5.455 1.00 0.00 C ATOM 87 CD PRO A 6 -9.593 9.882 4.138 1.00 0.00 C ATOM 0 HA PRO A 6 -6.450 9.816 3.397 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.958 10.232 6.120 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.288 11.464 4.918 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -9.183 9.530 6.217 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -9.432 11.217 5.813 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -10.447 9.218 4.273 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -9.948 10.747 3.577 1.00 0.00 H new ATOM 95 N ILE A 7 -5.272 8.174 4.837 1.00 0.00 N ATOM 96 CA ILE A 7 -4.548 7.006 5.330 1.00 0.00 C ATOM 97 C ILE A 7 -4.942 6.663 6.766 1.00 0.00 C ATOM 98 O ILE A 7 -4.882 5.506 7.168 1.00 0.00 O ATOM 99 CB ILE A 7 -3.016 7.211 5.237 1.00 0.00 C ATOM 100 CG1 ILE A 7 -2.270 5.936 5.643 1.00 0.00 C ATOM 101 CG2 ILE A 7 -2.575 8.384 6.098 1.00 0.00 C ATOM 102 CD1 ILE A 7 -2.639 4.731 4.807 1.00 0.00 C ATOM 0 H ILE A 7 -4.677 8.973 4.617 1.00 0.00 H new ATOM 0 HA ILE A 7 -4.826 6.169 4.689 1.00 0.00 H new ATOM 0 HB ILE A 7 -2.769 7.436 4.199 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.197 6.110 5.562 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -2.479 5.720 6.691 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.495 8.509 6.017 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -3.072 9.292 5.758 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -2.841 8.193 7.138 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -2.074 3.864 5.149 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -3.706 4.531 4.908 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -2.404 4.928 3.761 1.00 0.00 H new ATOM 114 N THR A 8 -5.389 7.666 7.516 1.00 0.00 N ATOM 115 CA THR A 8 -5.774 7.470 8.910 1.00 0.00 C ATOM 116 C THR A 8 -6.936 6.476 9.025 1.00 0.00 C ATOM 117 O THR A 8 -7.181 5.902 10.089 1.00 0.00 O ATOM 118 CB THR A 8 -6.151 8.817 9.577 1.00 0.00 C ATOM 119 OG1 THR A 8 -6.353 8.640 10.985 1.00 0.00 O ATOM 120 CG2 THR A 8 -7.405 9.412 8.954 1.00 0.00 C ATOM 0 H THR A 8 -5.494 8.624 7.181 1.00 0.00 H new ATOM 0 HA THR A 8 -4.913 7.055 9.435 1.00 0.00 H new ATOM 0 HB THR A 8 -5.323 9.507 9.414 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.589 9.500 11.392 1.00 0.00 H new ATOM 0 HG21 THR A 8 -7.642 10.356 9.444 1.00 0.00 H new ATOM 0 HG22 THR A 8 -7.235 9.587 7.892 1.00 0.00 H new ATOM 0 HG23 THR A 8 -8.237 8.719 9.079 1.00 0.00 H new ATOM 128 N GLU A 9 -7.639 6.267 7.919 1.00 0.00 N ATOM 129 CA GLU A 9 -8.737 5.319 7.875 1.00 0.00 C ATOM 130 C GLU A 9 -8.306 4.030 7.183 1.00 0.00 C ATOM 131 O GLU A 9 -8.558 2.930 7.679 1.00 0.00 O ATOM 132 CB GLU A 9 -9.928 5.933 7.139 1.00 0.00 C ATOM 133 CG GLU A 9 -10.540 7.115 7.866 1.00 0.00 C ATOM 134 CD GLU A 9 -11.175 6.710 9.178 1.00 0.00 C ATOM 135 OE1 GLU A 9 -12.369 6.360 9.180 1.00 0.00 O ATOM 136 OE2 GLU A 9 -10.482 6.725 10.215 1.00 0.00 O ATOM 0 H GLU A 9 -7.464 6.747 7.036 1.00 0.00 H new ATOM 0 HA GLU A 9 -9.031 5.082 8.898 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.608 6.252 6.147 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -10.692 5.168 6.997 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.770 7.864 8.052 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -11.291 7.582 7.229 1.00 0.00 H new ATOM 143 N VAL A 10 -7.634 4.174 6.050 1.00 0.00 N ATOM 144 CA VAL A 10 -7.267 3.026 5.232 1.00 0.00 C ATOM 145 C VAL A 10 -6.219 2.152 5.916 1.00 0.00 C ATOM 146 O VAL A 10 -6.257 0.932 5.787 1.00 0.00 O ATOM 147 CB VAL A 10 -6.757 3.466 3.843 1.00 0.00 C ATOM 148 CG1 VAL A 10 -6.348 2.261 3.008 1.00 0.00 C ATOM 149 CG2 VAL A 10 -7.822 4.275 3.121 1.00 0.00 C ATOM 0 H VAL A 10 -7.332 5.074 5.676 1.00 0.00 H new ATOM 0 HA VAL A 10 -8.173 2.433 5.102 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.878 4.094 3.986 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.992 2.597 2.034 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.552 1.719 3.518 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.207 1.603 2.873 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.448 4.578 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.717 3.667 2.994 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.065 5.161 3.707 1.00 0.00 H new ATOM 159 N LEU A 11 -5.305 2.774 6.657 1.00 0.00 N ATOM 160 CA LEU A 11 -4.238 2.049 7.345 1.00 0.00 C ATOM 161 C LEU A 11 -4.789 0.909 8.225 1.00 0.00 C ATOM 162 O LEU A 11 -4.471 -0.259 7.981 1.00 0.00 O ATOM 163 CB LEU A 11 -3.384 3.032 8.165 1.00 0.00 C ATOM 164 CG LEU A 11 -2.544 2.413 9.284 1.00 0.00 C ATOM 165 CD1 LEU A 11 -1.534 1.426 8.728 1.00 0.00 C ATOM 166 CD2 LEU A 11 -1.845 3.502 10.085 1.00 0.00 C ATOM 0 H LEU A 11 -5.282 3.784 6.797 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.605 1.579 6.592 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.716 3.559 7.484 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.045 3.779 8.604 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.213 1.867 9.948 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.951 1.002 9.546 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.057 0.627 8.203 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -0.867 1.939 8.035 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -1.251 3.046 10.877 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -1.193 4.076 9.427 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.590 4.165 10.525 1.00 0.00 H new ATOM 178 N PRO A 12 -5.612 1.209 9.253 1.00 0.00 N ATOM 179 CA PRO A 12 -6.179 0.174 10.126 1.00 0.00 C ATOM 180 C PRO A 12 -7.174 -0.740 9.409 1.00 0.00 C ATOM 181 O PRO A 12 -7.303 -1.915 9.753 1.00 0.00 O ATOM 182 CB PRO A 12 -6.885 0.972 11.227 1.00 0.00 C ATOM 183 CG PRO A 12 -7.154 2.304 10.624 1.00 0.00 C ATOM 184 CD PRO A 12 -6.025 2.561 9.674 1.00 0.00 C ATOM 0 HA PRO A 12 -5.404 -0.498 10.495 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -7.810 0.485 11.536 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -6.258 1.060 12.115 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -8.112 2.311 10.103 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -7.203 3.077 11.391 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -6.345 3.165 8.825 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -5.208 3.097 10.157 1.00 0.00 H new ATOM 192 N ARG A 13 -7.874 -0.210 8.409 1.00 0.00 N ATOM 193 CA ARG A 13 -8.882 -0.988 7.700 1.00 0.00 C ATOM 194 C ARG A 13 -8.258 -1.854 6.601 1.00 0.00 C ATOM 195 O ARG A 13 -8.961 -2.602 5.920 1.00 0.00 O ATOM 196 CB ARG A 13 -9.933 -0.064 7.086 1.00 0.00 C ATOM 197 CG ARG A 13 -10.657 0.819 8.092 1.00 0.00 C ATOM 198 CD ARG A 13 -11.760 1.620 7.418 1.00 0.00 C ATOM 199 NE ARG A 13 -12.220 2.747 8.231 1.00 0.00 N ATOM 200 CZ ARG A 13 -13.506 3.019 8.468 1.00 0.00 C ATOM 201 NH1 ARG A 13 -14.454 2.163 8.113 1.00 0.00 N ATOM 202 NH2 ARG A 13 -13.850 4.144 9.081 1.00 0.00 N ATOM 0 H ARG A 13 -7.762 0.747 8.075 1.00 0.00 H new ATOM 0 HA ARG A 13 -9.355 -1.647 8.428 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -9.451 0.572 6.343 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -10.668 -0.671 6.557 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -11.082 0.202 8.883 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -9.946 1.497 8.564 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -11.398 1.993 6.460 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.603 0.962 7.207 1.00 0.00 H new ATOM 0 HE ARG A 13 -11.516 3.361 8.641 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -14.204 1.287 7.654 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -15.433 2.380 8.299 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -13.131 4.806 9.374 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -14.833 4.347 9.260 1.00 0.00 H new ATOM 216 N ALA A 14 -6.945 -1.755 6.433 1.00 0.00 N ATOM 217 CA ALA A 14 -6.253 -2.487 5.379 1.00 0.00 C ATOM 218 C ALA A 14 -5.878 -3.893 5.828 1.00 0.00 C ATOM 219 O ALA A 14 -5.598 -4.131 7.003 1.00 0.00 O ATOM 220 CB ALA A 14 -5.008 -1.735 4.934 1.00 0.00 C ATOM 0 H ALA A 14 -6.338 -1.175 7.013 1.00 0.00 H new ATOM 0 HA ALA A 14 -6.939 -2.572 4.536 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.505 -2.297 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -5.292 -0.754 4.554 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -4.333 -1.615 5.782 1.00 0.00 H new ATOM 226 N VAL A 15 -5.869 -4.816 4.877 1.00 0.00 N ATOM 227 CA VAL A 15 -5.514 -6.202 5.144 1.00 0.00 C ATOM 228 C VAL A 15 -4.234 -6.584 4.407 1.00 0.00 C ATOM 229 O VAL A 15 -3.773 -7.721 4.476 1.00 0.00 O ATOM 230 CB VAL A 15 -6.648 -7.166 4.738 1.00 0.00 C ATOM 231 CG1 VAL A 15 -7.847 -7.005 5.658 1.00 0.00 C ATOM 232 CG2 VAL A 15 -7.054 -6.938 3.287 1.00 0.00 C ATOM 0 H VAL A 15 -6.106 -4.626 3.903 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.352 -6.291 6.218 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.277 -8.186 4.835 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -8.635 -7.694 5.353 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.550 -7.223 6.684 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.217 -5.982 5.597 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.855 -7.628 3.021 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.402 -5.913 3.163 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.196 -7.110 2.638 1.00 0.00 H new ATOM 242 N GLY A 16 -3.671 -5.627 3.687 1.00 0.00 N ATOM 243 CA GLY A 16 -2.428 -5.859 2.986 1.00 0.00 C ATOM 244 C GLY A 16 -1.801 -4.562 2.546 1.00 0.00 C ATOM 245 O GLY A 16 -2.482 -3.539 2.489 1.00 0.00 O ATOM 0 H GLY A 16 -4.056 -4.689 3.576 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.737 -6.399 3.634 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.610 -6.491 2.117 1.00 0.00 H new ATOM 249 N SER A 17 -0.516 -4.581 2.249 1.00 0.00 N ATOM 250 CA SER A 17 0.161 -3.381 1.800 1.00 0.00 C ATOM 251 C SER A 17 1.342 -3.711 0.899 1.00 0.00 C ATOM 252 O SER A 17 2.047 -4.702 1.104 1.00 0.00 O ATOM 253 CB SER A 17 0.617 -2.541 2.999 1.00 0.00 C ATOM 254 OG SER A 17 1.422 -3.300 3.890 1.00 0.00 O ATOM 0 H SER A 17 0.077 -5.409 2.310 1.00 0.00 H new ATOM 0 HA SER A 17 -0.550 -2.798 1.214 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.179 -1.676 2.646 1.00 0.00 H new ATOM 0 HB3 SER A 17 -0.255 -2.159 3.530 1.00 0.00 H new ATOM 0 HG SER A 17 1.698 -2.736 4.643 1.00 0.00 H new ATOM 260 N LEU A 18 1.532 -2.880 -0.109 1.00 0.00 N ATOM 261 CA LEU A 18 2.666 -2.999 -1.001 1.00 0.00 C ATOM 262 C LEU A 18 3.578 -1.802 -0.832 1.00 0.00 C ATOM 263 O LEU A 18 3.173 -0.664 -1.061 1.00 0.00 O ATOM 264 CB LEU A 18 2.211 -3.099 -2.454 1.00 0.00 C ATOM 265 CG LEU A 18 2.065 -4.518 -3.001 1.00 0.00 C ATOM 266 CD1 LEU A 18 1.457 -4.492 -4.395 1.00 0.00 C ATOM 267 CD2 LEU A 18 3.420 -5.209 -3.034 1.00 0.00 C ATOM 0 H LEU A 18 0.905 -2.106 -0.331 1.00 0.00 H new ATOM 0 HA LEU A 18 3.207 -3.911 -0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 18 1.252 -2.590 -2.552 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.924 -2.559 -3.078 1.00 0.00 H new ATOM 0 HG LEU A 18 1.399 -5.076 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.360 -5.511 -4.769 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.473 -4.026 -4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.102 -3.920 -5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.304 -6.220 -3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.099 -4.647 -3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.829 -5.256 -2.025 1.00 0.00 H new ATOM 279 N THR A 19 4.800 -2.059 -0.421 1.00 0.00 N ATOM 280 CA THR A 19 5.761 -1.002 -0.194 1.00 0.00 C ATOM 281 C THR A 19 6.595 -0.769 -1.449 1.00 0.00 C ATOM 282 O THR A 19 7.303 -1.663 -1.908 1.00 0.00 O ATOM 283 CB THR A 19 6.685 -1.351 0.987 1.00 0.00 C ATOM 284 OG1 THR A 19 5.900 -1.814 2.098 1.00 0.00 O ATOM 285 CG2 THR A 19 7.508 -0.144 1.412 1.00 0.00 C ATOM 0 H THR A 19 5.154 -2.998 -0.236 1.00 0.00 H new ATOM 0 HA THR A 19 5.214 -0.091 0.047 1.00 0.00 H new ATOM 0 HB THR A 19 7.368 -2.138 0.665 1.00 0.00 H new ATOM 0 HG1 THR A 19 6.468 -1.884 2.893 1.00 0.00 H new ATOM 0 HG21 THR A 19 8.152 -0.419 2.248 1.00 0.00 H new ATOM 0 HG22 THR A 19 8.122 0.190 0.576 1.00 0.00 H new ATOM 0 HG23 THR A 19 6.841 0.662 1.717 1.00 0.00 H new ATOM 293 N PHE A 20 6.480 0.422 -2.013 1.00 0.00 N ATOM 294 CA PHE A 20 7.230 0.798 -3.201 1.00 0.00 C ATOM 295 C PHE A 20 8.233 1.899 -2.876 1.00 0.00 C ATOM 296 O PHE A 20 8.052 2.678 -1.934 1.00 0.00 O ATOM 297 CB PHE A 20 6.289 1.283 -4.313 1.00 0.00 C ATOM 298 CG PHE A 20 5.578 0.196 -5.063 1.00 0.00 C ATOM 299 CD1 PHE A 20 4.587 -0.559 -4.461 1.00 0.00 C ATOM 300 CD2 PHE A 20 5.888 -0.047 -6.390 1.00 0.00 C ATOM 301 CE1 PHE A 20 3.923 -1.541 -5.172 1.00 0.00 C ATOM 302 CE2 PHE A 20 5.229 -1.030 -7.100 1.00 0.00 C ATOM 303 CZ PHE A 20 4.245 -1.775 -6.489 1.00 0.00 C ATOM 0 H PHE A 20 5.865 1.155 -1.661 1.00 0.00 H new ATOM 0 HA PHE A 20 7.764 -0.087 -3.548 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.545 1.947 -3.874 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.866 1.876 -5.023 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.330 -0.380 -3.427 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.654 0.539 -6.875 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.151 -2.125 -4.693 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.485 -1.215 -8.133 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.726 -2.543 -7.044 1.00 0.00 H new ATOM 313 N ASP A 21 9.291 1.953 -3.658 1.00 0.00 N ATOM 314 CA ASP A 21 10.315 2.975 -3.508 1.00 0.00 C ATOM 315 C ASP A 21 9.963 4.188 -4.364 1.00 0.00 C ATOM 316 O ASP A 21 9.045 4.123 -5.179 1.00 0.00 O ATOM 317 CB ASP A 21 11.674 2.396 -3.922 1.00 0.00 C ATOM 318 CG ASP A 21 12.825 3.350 -3.692 1.00 0.00 C ATOM 319 OD1 ASP A 21 13.322 3.429 -2.552 1.00 0.00 O ATOM 320 OD2 ASP A 21 13.242 4.020 -4.655 1.00 0.00 O ATOM 0 H ASP A 21 9.468 1.293 -4.415 1.00 0.00 H new ATOM 0 HA ASP A 21 10.369 3.293 -2.467 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.855 1.477 -3.364 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.640 2.126 -4.978 1.00 0.00 H new ATOM 325 N GLU A 22 10.685 5.293 -4.180 1.00 0.00 N ATOM 326 CA GLU A 22 10.474 6.484 -4.987 1.00 0.00 C ATOM 327 C GLU A 22 10.811 6.194 -6.448 1.00 0.00 C ATOM 328 O GLU A 22 10.293 6.837 -7.358 1.00 0.00 O ATOM 329 CB GLU A 22 11.321 7.646 -4.462 1.00 0.00 C ATOM 330 CG GLU A 22 12.817 7.369 -4.439 1.00 0.00 C ATOM 331 CD GLU A 22 13.627 8.587 -4.051 1.00 0.00 C ATOM 332 OE1 GLU A 22 13.990 9.378 -4.946 1.00 0.00 O ATOM 333 OE2 GLU A 22 13.907 8.767 -2.850 1.00 0.00 O ATOM 0 H GLU A 22 11.420 5.384 -3.478 1.00 0.00 H new ATOM 0 HA GLU A 22 9.424 6.769 -4.920 1.00 0.00 H new ATOM 0 HB2 GLU A 22 11.135 8.524 -5.080 1.00 0.00 H new ATOM 0 HB3 GLU A 22 10.993 7.892 -3.452 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.023 6.561 -3.737 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.134 7.024 -5.423 1.00 0.00 H new ATOM 340 N ASN A 23 11.669 5.200 -6.659 1.00 0.00 N ATOM 341 CA ASN A 23 12.027 4.752 -7.995 1.00 0.00 C ATOM 342 C ASN A 23 10.980 3.780 -8.538 1.00 0.00 C ATOM 343 O ASN A 23 11.186 3.148 -9.572 1.00 0.00 O ATOM 344 CB ASN A 23 13.399 4.078 -7.974 1.00 0.00 C ATOM 345 CG ASN A 23 14.530 5.049 -7.688 1.00 0.00 C ATOM 346 OD1 ASN A 23 15.120 5.622 -8.607 1.00 0.00 O ATOM 347 ND2 ASN A 23 14.842 5.241 -6.415 1.00 0.00 N ATOM 0 H ASN A 23 12.132 4.686 -5.910 1.00 0.00 H new ATOM 0 HA ASN A 23 12.065 5.623 -8.649 1.00 0.00 H new ATOM 0 HB2 ASN A 23 13.401 3.293 -7.218 1.00 0.00 H new ATOM 0 HB3 ASN A 23 13.576 3.595 -8.935 1.00 0.00 H new ATOM 0 HD21 ASN A 23 15.595 5.882 -6.166 1.00 0.00 H new ATOM 0 HD22 ASN A 23 14.329 4.747 -5.684 1.00 0.00 H new ATOM 354 N TYR A 24 9.859 3.675 -7.819 1.00 0.00 N ATOM 355 CA TYR A 24 8.737 2.813 -8.201 1.00 0.00 C ATOM 356 C TYR A 24 9.141 1.344 -8.206 1.00 0.00 C ATOM 357 O TYR A 24 8.584 0.529 -8.943 1.00 0.00 O ATOM 358 CB TYR A 24 8.176 3.237 -9.560 1.00 0.00 C ATOM 359 CG TYR A 24 7.703 4.671 -9.570 1.00 0.00 C ATOM 360 CD1 TYR A 24 6.529 5.038 -8.926 1.00 0.00 C ATOM 361 CD2 TYR A 24 8.444 5.658 -10.203 1.00 0.00 C ATOM 362 CE1 TYR A 24 6.104 6.351 -8.917 1.00 0.00 C ATOM 363 CE2 TYR A 24 8.027 6.975 -10.195 1.00 0.00 C ATOM 364 CZ TYR A 24 6.856 7.316 -9.551 1.00 0.00 C ATOM 365 OH TYR A 24 6.440 8.626 -9.538 1.00 0.00 O ATOM 0 H TYR A 24 9.704 4.188 -6.951 1.00 0.00 H new ATOM 0 HA TYR A 24 7.951 2.930 -7.455 1.00 0.00 H new ATOM 0 HB2 TYR A 24 8.943 3.106 -10.323 1.00 0.00 H new ATOM 0 HB3 TYR A 24 7.346 2.583 -9.827 1.00 0.00 H new ATOM 0 HD1 TYR A 24 5.940 4.285 -8.425 1.00 0.00 H new ATOM 0 HD2 TYR A 24 9.360 5.393 -10.710 1.00 0.00 H new ATOM 0 HE1 TYR A 24 5.186 6.621 -8.415 1.00 0.00 H new ATOM 0 HE2 TYR A 24 8.615 7.734 -10.690 1.00 0.00 H new ATOM 0 HH TYR A 24 7.083 9.178 -10.029 1.00 0.00 H new ATOM 375 N ASN A 25 10.097 1.014 -7.353 1.00 0.00 N ATOM 376 CA ASN A 25 10.538 -0.361 -7.189 1.00 0.00 C ATOM 377 C ASN A 25 9.776 -1.006 -6.045 1.00 0.00 C ATOM 378 O ASN A 25 9.625 -0.400 -4.985 1.00 0.00 O ATOM 379 CB ASN A 25 12.039 -0.414 -6.894 1.00 0.00 C ATOM 380 CG ASN A 25 12.882 0.182 -8.000 1.00 0.00 C ATOM 381 OD1 ASN A 25 12.526 0.120 -9.177 1.00 0.00 O ATOM 382 ND2 ASN A 25 14.006 0.774 -7.627 1.00 0.00 N ATOM 0 H ASN A 25 10.585 1.685 -6.760 1.00 0.00 H new ATOM 0 HA ASN A 25 10.343 -0.902 -8.115 1.00 0.00 H new ATOM 0 HB2 ASN A 25 12.240 0.119 -5.965 1.00 0.00 H new ATOM 0 HB3 ASN A 25 12.336 -1.451 -6.737 1.00 0.00 H new ATOM 0 HD21 ASN A 25 14.614 1.201 -8.326 1.00 0.00 H new ATOM 0 HD22 ASN A 25 14.264 0.803 -6.641 1.00 0.00 H new ATOM 389 N LEU A 26 9.278 -2.215 -6.257 1.00 0.00 N ATOM 390 CA LEU A 26 8.582 -2.937 -5.208 1.00 0.00 C ATOM 391 C LEU A 26 9.588 -3.377 -4.148 1.00 0.00 C ATOM 392 O LEU A 26 10.514 -4.137 -4.433 1.00 0.00 O ATOM 393 CB LEU A 26 7.839 -4.145 -5.799 1.00 0.00 C ATOM 394 CG LEU A 26 6.702 -4.718 -4.940 1.00 0.00 C ATOM 395 CD1 LEU A 26 5.884 -5.707 -5.750 1.00 0.00 C ATOM 396 CD2 LEU A 26 7.242 -5.396 -3.692 1.00 0.00 C ATOM 0 H LEU A 26 9.344 -2.714 -7.144 1.00 0.00 H new ATOM 0 HA LEU A 26 7.843 -2.286 -4.742 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.428 -3.857 -6.766 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.564 -4.938 -5.984 1.00 0.00 H new ATOM 0 HG LEU A 26 6.066 -3.889 -4.629 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.081 -6.107 -5.132 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.458 -5.203 -6.617 1.00 0.00 H new ATOM 0 HD13 LEU A 26 6.526 -6.522 -6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.413 -5.791 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.905 -6.212 -3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.796 -4.672 -3.095 1.00 0.00 H new ATOM 408 N LEU A 27 9.410 -2.881 -2.936 1.00 0.00 N ATOM 409 CA LEU A 27 10.326 -3.171 -1.843 1.00 0.00 C ATOM 410 C LEU A 27 9.795 -4.301 -0.971 1.00 0.00 C ATOM 411 O LEU A 27 10.483 -5.293 -0.729 1.00 0.00 O ATOM 412 CB LEU A 27 10.530 -1.922 -0.983 1.00 0.00 C ATOM 413 CG LEU A 27 11.077 -0.699 -1.719 1.00 0.00 C ATOM 414 CD1 LEU A 27 11.108 0.502 -0.790 1.00 0.00 C ATOM 415 CD2 LEU A 27 12.464 -0.985 -2.276 1.00 0.00 C ATOM 0 H LEU A 27 8.634 -2.271 -2.681 1.00 0.00 H new ATOM 0 HA LEU A 27 11.278 -3.479 -2.275 1.00 0.00 H new ATOM 0 HB2 LEU A 27 9.576 -1.655 -0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 27 11.212 -2.170 -0.169 1.00 0.00 H new ATOM 0 HG LEU A 27 10.416 -0.472 -2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 27 11.500 1.367 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.098 0.718 -0.441 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.749 0.284 0.065 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.836 -0.102 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.140 -1.236 -1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.411 -1.822 -2.973 1.00 0.00 H new ATOM 427 N ASP A 28 8.561 -4.152 -0.515 1.00 0.00 N ATOM 428 CA ASP A 28 7.983 -5.085 0.443 1.00 0.00 C ATOM 429 C ASP A 28 6.554 -5.454 0.063 1.00 0.00 C ATOM 430 O ASP A 28 5.794 -4.612 -0.410 1.00 0.00 O ATOM 431 CB ASP A 28 8.012 -4.469 1.845 1.00 0.00 C ATOM 432 CG ASP A 28 7.276 -5.299 2.875 1.00 0.00 C ATOM 433 OD1 ASP A 28 7.828 -6.328 3.317 1.00 0.00 O ATOM 434 OD2 ASP A 28 6.152 -4.916 3.261 1.00 0.00 O ATOM 0 H ASP A 28 7.939 -3.393 -0.793 1.00 0.00 H new ATOM 0 HA ASP A 28 8.578 -5.998 0.433 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.048 -4.346 2.160 1.00 0.00 H new ATOM 0 HB3 ASP A 28 7.570 -3.473 1.807 1.00 0.00 H new ATOM 439 N THR A 29 6.211 -6.717 0.248 1.00 0.00 N ATOM 440 CA THR A 29 4.859 -7.192 0.022 1.00 0.00 C ATOM 441 C THR A 29 4.321 -7.842 1.293 1.00 0.00 C ATOM 442 O THR A 29 4.837 -8.869 1.732 1.00 0.00 O ATOM 443 CB THR A 29 4.831 -8.217 -1.127 1.00 0.00 C ATOM 444 OG1 THR A 29 5.534 -7.687 -2.259 1.00 0.00 O ATOM 445 CG2 THR A 29 3.402 -8.554 -1.522 1.00 0.00 C ATOM 0 H THR A 29 6.861 -7.440 0.558 1.00 0.00 H new ATOM 0 HA THR A 29 4.234 -6.341 -0.248 1.00 0.00 H new ATOM 0 HB THR A 29 5.316 -9.132 -0.786 1.00 0.00 H new ATOM 0 HG1 THR A 29 5.518 -8.340 -2.989 1.00 0.00 H new ATOM 0 HG21 THR A 29 3.411 -9.280 -2.335 1.00 0.00 H new ATOM 0 HG22 THR A 29 2.877 -8.976 -0.665 1.00 0.00 H new ATOM 0 HG23 THR A 29 2.892 -7.648 -1.850 1.00 0.00 H new ATOM 453 N SER A 30 3.295 -7.247 1.884 1.00 0.00 N ATOM 454 CA SER A 30 2.760 -7.745 3.142 1.00 0.00 C ATOM 455 C SER A 30 1.246 -7.912 3.079 1.00 0.00 C ATOM 456 O SER A 30 0.554 -7.184 2.361 1.00 0.00 O ATOM 457 CB SER A 30 3.139 -6.799 4.283 1.00 0.00 C ATOM 458 OG SER A 30 4.547 -6.739 4.453 1.00 0.00 O ATOM 0 H SER A 30 2.819 -6.424 1.515 1.00 0.00 H new ATOM 0 HA SER A 30 3.196 -8.727 3.327 1.00 0.00 H new ATOM 0 HB2 SER A 30 2.752 -5.801 4.076 1.00 0.00 H new ATOM 0 HB3 SER A 30 2.672 -7.136 5.209 1.00 0.00 H new ATOM 0 HG SER A 30 4.911 -6.009 3.910 1.00 0.00 H new ATOM 464 N GLY A 31 0.744 -8.887 3.823 1.00 0.00 N ATOM 465 CA GLY A 31 -0.686 -9.101 3.915 1.00 0.00 C ATOM 466 C GLY A 31 -1.263 -9.746 2.673 1.00 0.00 C ATOM 467 O GLY A 31 -0.576 -10.489 1.969 1.00 0.00 O ATOM 0 H GLY A 31 1.307 -9.539 4.369 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -0.900 -9.731 4.779 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -1.182 -8.145 4.086 1.00 0.00 H new ATOM 471 N VAL A 32 -2.522 -9.441 2.391 1.00 0.00 N ATOM 472 CA VAL A 32 -3.220 -10.004 1.237 1.00 0.00 C ATOM 473 C VAL A 32 -2.560 -9.572 -0.076 1.00 0.00 C ATOM 474 O VAL A 32 -2.767 -10.185 -1.123 1.00 0.00 O ATOM 475 CB VAL A 32 -4.706 -9.586 1.236 1.00 0.00 C ATOM 476 CG1 VAL A 32 -5.472 -10.278 0.121 1.00 0.00 C ATOM 477 CG2 VAL A 32 -5.337 -9.896 2.582 1.00 0.00 C ATOM 0 H VAL A 32 -3.087 -8.801 2.949 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.157 -11.089 1.316 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.756 -8.512 1.059 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.515 -9.963 0.147 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.035 -10.010 -0.841 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.416 -11.358 0.257 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.385 -9.597 2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.267 -10.966 2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -4.812 -9.348 3.365 1.00 0.00 H new ATOM 487 N ALA A 33 -1.733 -8.535 -0.008 1.00 0.00 N ATOM 488 CA ALA A 33 -1.036 -8.032 -1.187 1.00 0.00 C ATOM 489 C ALA A 33 -0.093 -9.088 -1.763 1.00 0.00 C ATOM 490 O ALA A 33 0.361 -8.971 -2.898 1.00 0.00 O ATOM 491 CB ALA A 33 -0.271 -6.764 -0.845 1.00 0.00 C ATOM 0 H ALA A 33 -1.528 -8.025 0.852 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.781 -7.799 -1.948 1.00 0.00 H new ATOM 0 HB1 ALA A 33 0.244 -6.399 -1.733 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -0.967 -6.003 -0.491 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.459 -6.979 -0.065 1.00 0.00 H new ATOM 497 N LYS A 34 0.198 -10.116 -0.972 1.00 0.00 N ATOM 498 CA LYS A 34 1.060 -11.201 -1.412 1.00 0.00 C ATOM 499 C LYS A 34 0.338 -12.114 -2.398 1.00 0.00 C ATOM 500 O LYS A 34 0.938 -12.599 -3.359 1.00 0.00 O ATOM 501 CB LYS A 34 1.539 -12.019 -0.215 1.00 0.00 C ATOM 502 CG LYS A 34 2.370 -11.231 0.782 1.00 0.00 C ATOM 503 CD LYS A 34 2.822 -12.106 1.940 1.00 0.00 C ATOM 504 CE LYS A 34 1.642 -12.622 2.750 1.00 0.00 C ATOM 505 NZ LYS A 34 2.067 -13.530 3.845 1.00 0.00 N ATOM 0 H LYS A 34 -0.153 -10.218 -0.020 1.00 0.00 H new ATOM 0 HA LYS A 34 1.920 -10.758 -1.915 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.672 -12.433 0.299 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.128 -12.862 -0.577 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.241 -10.810 0.280 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.786 -10.393 1.163 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.396 -12.949 1.556 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.487 -11.536 2.589 1.00 0.00 H new ATOM 0 HE2 LYS A 34 1.096 -11.778 3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 34 0.953 -13.149 2.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.230 -13.857 4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.565 -14.350 3.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.704 -13.021 4.491 1.00 0.00 H new ATOM 519 N VAL A 35 -0.950 -12.347 -2.160 1.00 0.00 N ATOM 520 CA VAL A 35 -1.730 -13.243 -3.007 1.00 0.00 C ATOM 521 C VAL A 35 -2.366 -12.473 -4.164 1.00 0.00 C ATOM 522 O VAL A 35 -2.750 -13.056 -5.180 1.00 0.00 O ATOM 523 CB VAL A 35 -2.824 -13.986 -2.206 1.00 0.00 C ATOM 524 CG1 VAL A 35 -2.199 -14.781 -1.070 1.00 0.00 C ATOM 525 CG2 VAL A 35 -3.873 -13.023 -1.672 1.00 0.00 C ATOM 0 H VAL A 35 -1.473 -11.929 -1.391 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.042 -13.988 -3.406 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.325 -14.677 -2.884 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.981 -15.299 -0.515 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.500 -15.511 -1.478 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.667 -14.104 -0.402 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.627 -13.579 -1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.398 -12.295 -1.014 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.348 -12.504 -2.505 1.00 0.00 H new ATOM 535 N ILE A 36 -2.467 -11.163 -3.999 1.00 0.00 N ATOM 536 CA ILE A 36 -2.949 -10.284 -5.051 1.00 0.00 C ATOM 537 C ILE A 36 -1.852 -10.072 -6.091 1.00 0.00 C ATOM 538 O ILE A 36 -0.673 -9.981 -5.745 1.00 0.00 O ATOM 539 CB ILE A 36 -3.404 -8.930 -4.456 1.00 0.00 C ATOM 540 CG1 ILE A 36 -4.702 -9.114 -3.664 1.00 0.00 C ATOM 541 CG2 ILE A 36 -3.585 -7.880 -5.543 1.00 0.00 C ATOM 542 CD1 ILE A 36 -5.055 -7.930 -2.791 1.00 0.00 C ATOM 0 H ILE A 36 -2.218 -10.681 -3.135 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.808 -10.748 -5.536 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.624 -8.576 -3.782 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.520 -9.297 -4.361 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.612 -10.002 -3.038 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.905 -6.941 -5.092 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -2.640 -7.729 -6.064 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.340 -8.217 -6.253 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.986 -8.133 -2.261 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.256 -7.759 -2.069 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -5.178 -7.043 -3.413 1.00 0.00 H new ATOM 554 N GLU A 37 -2.231 -10.035 -7.363 1.00 0.00 N ATOM 555 CA GLU A 37 -1.265 -9.844 -8.433 1.00 0.00 C ATOM 556 C GLU A 37 -0.662 -8.444 -8.370 1.00 0.00 C ATOM 557 O GLU A 37 -1.378 -7.451 -8.222 1.00 0.00 O ATOM 558 CB GLU A 37 -1.906 -10.100 -9.798 1.00 0.00 C ATOM 559 CG GLU A 37 -3.191 -9.326 -10.035 1.00 0.00 C ATOM 560 CD GLU A 37 -3.816 -9.652 -11.371 1.00 0.00 C ATOM 561 OE1 GLU A 37 -4.357 -10.767 -11.520 1.00 0.00 O ATOM 562 OE2 GLU A 37 -3.745 -8.810 -12.289 1.00 0.00 O ATOM 0 H GLU A 37 -3.197 -10.134 -7.676 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.461 -10.567 -8.298 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.190 -9.841 -10.578 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.113 -11.166 -9.896 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.901 -9.551 -9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.984 -8.257 -9.984 1.00 0.00 H new ATOM 569 N LYS A 38 0.659 -8.386 -8.481 1.00 0.00 N ATOM 570 CA LYS A 38 1.404 -7.142 -8.325 1.00 0.00 C ATOM 571 C LYS A 38 0.932 -6.079 -9.305 1.00 0.00 C ATOM 572 O LYS A 38 0.803 -4.917 -8.935 1.00 0.00 O ATOM 573 CB LYS A 38 2.906 -7.395 -8.495 1.00 0.00 C ATOM 574 CG LYS A 38 3.605 -7.862 -7.222 1.00 0.00 C ATOM 575 CD LYS A 38 2.905 -9.049 -6.575 1.00 0.00 C ATOM 576 CE LYS A 38 3.709 -9.607 -5.414 1.00 0.00 C ATOM 577 NZ LYS A 38 4.975 -10.238 -5.873 1.00 0.00 N ATOM 0 H LYS A 38 1.244 -9.198 -8.681 1.00 0.00 H new ATOM 0 HA LYS A 38 1.218 -6.769 -7.318 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.052 -8.144 -9.273 1.00 0.00 H new ATOM 0 HB3 LYS A 38 3.381 -6.478 -8.843 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.634 -8.134 -7.455 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.647 -7.037 -6.511 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.920 -8.743 -6.223 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.749 -9.830 -7.319 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.936 -8.806 -4.711 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.110 -10.342 -4.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.360 -10.836 -5.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 4.787 -10.823 -6.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 5.664 -9.498 -6.114 1.00 0.00 H new ATOM 591 N SER A 39 0.681 -6.484 -10.551 1.00 0.00 N ATOM 592 CA SER A 39 0.111 -5.592 -11.561 1.00 0.00 C ATOM 593 C SER A 39 1.036 -4.401 -11.872 1.00 0.00 C ATOM 594 O SER A 39 2.062 -4.207 -11.217 1.00 0.00 O ATOM 595 CB SER A 39 -1.258 -5.096 -11.076 1.00 0.00 C ATOM 596 OG SER A 39 -2.109 -6.183 -10.747 1.00 0.00 O ATOM 0 H SER A 39 0.865 -7.430 -10.886 1.00 0.00 H new ATOM 0 HA SER A 39 -0.002 -6.153 -12.488 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.128 -4.455 -10.204 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.723 -4.488 -11.852 1.00 0.00 H new ATOM 0 HG SER A 39 -1.864 -6.535 -9.866 1.00 0.00 H new ATOM 602 N PRO A 40 0.700 -3.596 -12.900 1.00 0.00 N ATOM 603 CA PRO A 40 1.415 -2.352 -13.202 1.00 0.00 C ATOM 604 C PRO A 40 1.010 -1.223 -12.253 1.00 0.00 C ATOM 605 O PRO A 40 0.776 -0.090 -12.679 1.00 0.00 O ATOM 606 CB PRO A 40 0.985 -2.018 -14.642 1.00 0.00 C ATOM 607 CG PRO A 40 0.177 -3.184 -15.110 1.00 0.00 C ATOM 608 CD PRO A 40 -0.365 -3.838 -13.876 1.00 0.00 C ATOM 0 HA PRO A 40 2.493 -2.464 -13.088 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.399 -1.100 -14.671 1.00 0.00 H new ATOM 0 HB3 PRO A 40 1.853 -1.862 -15.283 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -0.631 -2.860 -15.766 1.00 0.00 H new ATOM 0 HG3 PRO A 40 0.792 -3.880 -15.681 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -1.311 -3.396 -13.564 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -0.545 -4.903 -14.026 1.00 0.00 H new ATOM 616 N ILE A 41 0.958 -1.536 -10.962 1.00 0.00 N ATOM 617 CA ILE A 41 0.521 -0.583 -9.952 1.00 0.00 C ATOM 618 C ILE A 41 1.443 0.629 -9.896 1.00 0.00 C ATOM 619 O ILE A 41 0.988 1.742 -9.657 1.00 0.00 O ATOM 620 CB ILE A 41 0.435 -1.233 -8.552 1.00 0.00 C ATOM 621 CG1 ILE A 41 -0.655 -2.300 -8.536 1.00 0.00 C ATOM 622 CG2 ILE A 41 0.167 -0.189 -7.476 1.00 0.00 C ATOM 623 CD1 ILE A 41 -0.842 -2.959 -7.186 1.00 0.00 C ATOM 0 H ILE A 41 1.216 -2.450 -10.590 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.477 -0.255 -10.244 1.00 0.00 H new ATOM 0 HB ILE A 41 1.395 -1.701 -8.335 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -1.598 -1.848 -8.843 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.413 -3.065 -9.274 1.00 0.00 H new ATOM 0 HG21 ILE A 41 0.112 -0.676 -6.502 1.00 0.00 H new ATOM 0 HG22 ILE A 41 0.974 0.543 -7.470 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.777 0.314 -7.684 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -1.633 -3.706 -7.252 1.00 0.00 H new ATOM 0 HD12 ILE A 41 0.088 -3.441 -6.885 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.116 -2.205 -6.448 1.00 0.00 H new ATOM 635 N ALA A 42 2.728 0.413 -10.148 1.00 0.00 N ATOM 636 CA ALA A 42 3.708 1.498 -10.097 1.00 0.00 C ATOM 637 C ALA A 42 3.337 2.621 -11.063 1.00 0.00 C ATOM 638 O ALA A 42 3.559 3.800 -10.777 1.00 0.00 O ATOM 639 CB ALA A 42 5.104 0.974 -10.397 1.00 0.00 C ATOM 0 H ALA A 42 3.118 -0.498 -10.389 1.00 0.00 H new ATOM 0 HA ALA A 42 3.702 1.908 -9.087 1.00 0.00 H new ATOM 0 HB1 ALA A 42 5.818 1.796 -10.354 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.375 0.219 -9.659 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.120 0.531 -11.393 1.00 0.00 H new ATOM 645 N GLU A 43 2.740 2.249 -12.191 1.00 0.00 N ATOM 646 CA GLU A 43 2.288 3.220 -13.181 1.00 0.00 C ATOM 647 C GLU A 43 1.129 4.035 -12.614 1.00 0.00 C ATOM 648 O GLU A 43 1.010 5.240 -12.848 1.00 0.00 O ATOM 649 CB GLU A 43 1.837 2.499 -14.452 1.00 0.00 C ATOM 650 CG GLU A 43 1.740 3.401 -15.669 1.00 0.00 C ATOM 651 CD GLU A 43 3.101 3.745 -16.237 1.00 0.00 C ATOM 652 OE1 GLU A 43 3.719 4.719 -15.771 1.00 0.00 O ATOM 653 OE2 GLU A 43 3.558 3.027 -17.151 1.00 0.00 O ATOM 0 H GLU A 43 2.557 1.278 -12.443 1.00 0.00 H new ATOM 0 HA GLU A 43 3.114 3.889 -13.424 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.535 1.690 -14.666 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.864 2.041 -14.273 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.142 2.910 -16.436 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.219 4.319 -15.398 1.00 0.00 H new ATOM 660 N ILE A 44 0.278 3.375 -11.851 1.00 0.00 N ATOM 661 CA ILE A 44 -0.866 4.036 -11.256 1.00 0.00 C ATOM 662 C ILE A 44 -0.419 4.844 -10.039 1.00 0.00 C ATOM 663 O ILE A 44 -1.026 5.858 -9.697 1.00 0.00 O ATOM 664 CB ILE A 44 -1.962 3.031 -10.845 1.00 0.00 C ATOM 665 CG1 ILE A 44 -2.161 1.971 -11.937 1.00 0.00 C ATOM 666 CG2 ILE A 44 -3.274 3.766 -10.584 1.00 0.00 C ATOM 667 CD1 ILE A 44 -2.605 2.536 -13.271 1.00 0.00 C ATOM 0 H ILE A 44 0.358 2.383 -11.629 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.293 4.701 -12.006 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.646 2.530 -9.930 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.226 1.428 -12.077 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.901 1.247 -11.596 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.042 3.048 -10.295 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.132 4.489 -9.781 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.586 4.286 -11.490 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.723 1.724 -13.989 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -3.556 3.054 -13.148 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -1.855 3.237 -13.637 1.00 0.00 H new ATOM 679 N ILE A 45 0.665 4.400 -9.404 1.00 0.00 N ATOM 680 CA ILE A 45 1.219 5.091 -8.249 1.00 0.00 C ATOM 681 C ILE A 45 1.675 6.492 -8.629 1.00 0.00 C ATOM 682 O ILE A 45 1.362 7.458 -7.934 1.00 0.00 O ATOM 683 CB ILE A 45 2.401 4.316 -7.618 1.00 0.00 C ATOM 684 CG1 ILE A 45 1.906 3.011 -6.995 1.00 0.00 C ATOM 685 CG2 ILE A 45 3.109 5.172 -6.573 1.00 0.00 C ATOM 686 CD1 ILE A 45 3.006 2.177 -6.372 1.00 0.00 C ATOM 0 H ILE A 45 1.177 3.560 -9.675 1.00 0.00 H new ATOM 0 HA ILE A 45 0.423 5.155 -7.508 1.00 0.00 H new ATOM 0 HB ILE A 45 3.117 4.077 -8.405 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.162 3.242 -6.233 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.404 2.420 -7.762 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.937 4.609 -6.141 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.492 6.077 -7.043 1.00 0.00 H new ATOM 0 HG23 ILE A 45 2.405 5.442 -5.786 1.00 0.00 H new ATOM 0 HD11 ILE A 45 2.578 1.267 -5.951 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.739 1.914 -7.134 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.493 2.749 -5.582 1.00 0.00 H new ATOM 698 N ARG A 46 2.402 6.599 -9.738 1.00 0.00 N ATOM 699 CA ARG A 46 2.877 7.892 -10.212 1.00 0.00 C ATOM 700 C ARG A 46 1.708 8.783 -10.619 1.00 0.00 C ATOM 701 O ARG A 46 1.684 9.972 -10.296 1.00 0.00 O ATOM 702 CB ARG A 46 3.855 7.723 -11.378 1.00 0.00 C ATOM 703 CG ARG A 46 3.337 6.856 -12.507 1.00 0.00 C ATOM 704 CD ARG A 46 4.351 6.712 -13.627 1.00 0.00 C ATOM 705 NE ARG A 46 4.617 7.975 -14.315 1.00 0.00 N ATOM 706 CZ ARG A 46 5.068 8.050 -15.568 1.00 0.00 C ATOM 707 NH1 ARG A 46 5.142 6.954 -16.316 1.00 0.00 N ATOM 708 NH2 ARG A 46 5.395 9.225 -16.092 1.00 0.00 N ATOM 0 H ARG A 46 2.673 5.808 -10.322 1.00 0.00 H new ATOM 0 HA ARG A 46 3.407 8.375 -9.391 1.00 0.00 H new ATOM 0 HB2 ARG A 46 4.101 8.708 -11.776 1.00 0.00 H new ATOM 0 HB3 ARG A 46 4.782 7.291 -11.000 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.083 5.869 -12.119 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.418 7.288 -12.904 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.284 6.322 -13.219 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.988 5.980 -14.348 1.00 0.00 H new ATOM 0 HE ARG A 46 4.449 8.845 -13.810 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.854 6.054 -15.932 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.487 7.013 -17.274 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.302 10.075 -15.536 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.740 9.278 -17.051 1.00 0.00 H new ATOM 722 N LYS A 47 0.729 8.197 -11.304 1.00 0.00 N ATOM 723 CA LYS A 47 -0.464 8.938 -11.702 1.00 0.00 C ATOM 724 C LYS A 47 -1.200 9.456 -10.469 1.00 0.00 C ATOM 725 O LYS A 47 -1.525 10.640 -10.374 1.00 0.00 O ATOM 726 CB LYS A 47 -1.388 8.057 -12.550 1.00 0.00 C ATOM 727 CG LYS A 47 -0.741 7.571 -13.836 1.00 0.00 C ATOM 728 CD LYS A 47 -1.684 6.704 -14.656 1.00 0.00 C ATOM 729 CE LYS A 47 -0.977 6.131 -15.876 1.00 0.00 C ATOM 730 NZ LYS A 47 -1.896 5.348 -16.746 1.00 0.00 N ATOM 0 H LYS A 47 0.738 7.219 -11.593 1.00 0.00 H new ATOM 0 HA LYS A 47 -0.157 9.791 -12.307 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -1.699 7.195 -11.960 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.290 8.618 -12.795 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.428 8.429 -14.431 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.158 7.003 -13.597 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.066 5.892 -14.038 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.543 7.295 -14.973 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.538 6.944 -16.454 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -0.156 5.492 -15.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.370 4.978 -17.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.296 4.555 -16.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.666 5.962 -17.080 1.00 0.00 H new ATOM 744 N SER A 48 -1.414 8.572 -9.502 1.00 0.00 N ATOM 745 CA SER A 48 -2.111 8.933 -8.278 1.00 0.00 C ATOM 746 C SER A 48 -1.273 9.893 -7.444 1.00 0.00 C ATOM 747 O SER A 48 -1.800 10.663 -6.653 1.00 0.00 O ATOM 748 CB SER A 48 -2.420 7.683 -7.463 1.00 0.00 C ATOM 749 OG SER A 48 -3.083 6.710 -8.249 1.00 0.00 O ATOM 0 H SER A 48 -1.113 7.598 -9.544 1.00 0.00 H new ATOM 0 HA SER A 48 -3.044 9.427 -8.549 1.00 0.00 H new ATOM 0 HB2 SER A 48 -1.494 7.265 -7.068 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.041 7.948 -6.607 1.00 0.00 H new ATOM 0 HG SER A 48 -4.040 6.717 -8.040 1.00 0.00 H new ATOM 755 N ASN A 49 0.038 9.836 -7.621 1.00 0.00 N ATOM 756 CA ASN A 49 0.946 10.716 -6.896 1.00 0.00 C ATOM 757 C ASN A 49 0.716 12.163 -7.304 1.00 0.00 C ATOM 758 O ASN A 49 0.778 13.071 -6.481 1.00 0.00 O ATOM 759 CB ASN A 49 2.400 10.313 -7.161 1.00 0.00 C ATOM 760 CG ASN A 49 3.403 11.325 -6.638 1.00 0.00 C ATOM 761 OD1 ASN A 49 3.756 11.312 -5.464 1.00 0.00 O ATOM 762 ND2 ASN A 49 3.886 12.191 -7.517 1.00 0.00 N ATOM 0 H ASN A 49 0.499 9.189 -8.261 1.00 0.00 H new ATOM 0 HA ASN A 49 0.747 10.620 -5.829 1.00 0.00 H new ATOM 0 HB2 ASN A 49 2.593 9.346 -6.697 1.00 0.00 H new ATOM 0 HB3 ASN A 49 2.546 10.187 -8.234 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.579 12.881 -7.226 1.00 0.00 H new ATOM 0 HD22 ASN A 49 3.565 12.168 -8.485 1.00 0.00 H new ATOM 769 N ALA A 50 0.434 12.362 -8.581 1.00 0.00 N ATOM 770 CA ALA A 50 0.149 13.689 -9.100 1.00 0.00 C ATOM 771 C ALA A 50 -1.276 14.100 -8.752 1.00 0.00 C ATOM 772 O ALA A 50 -1.600 15.285 -8.695 1.00 0.00 O ATOM 773 CB ALA A 50 0.361 13.722 -10.608 1.00 0.00 C ATOM 0 H ALA A 50 0.396 11.619 -9.279 1.00 0.00 H new ATOM 0 HA ALA A 50 0.835 14.399 -8.638 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.144 14.722 -10.984 1.00 0.00 H new ATOM 0 HB2 ALA A 50 1.396 13.465 -10.836 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.305 13.003 -11.085 1.00 0.00 H new ATOM 779 N GLU A 51 -2.124 13.106 -8.527 1.00 0.00 N ATOM 780 CA GLU A 51 -3.526 13.344 -8.201 1.00 0.00 C ATOM 781 C GLU A 51 -3.724 13.749 -6.739 1.00 0.00 C ATOM 782 O GLU A 51 -4.532 14.630 -6.440 1.00 0.00 O ATOM 783 CB GLU A 51 -4.348 12.087 -8.491 1.00 0.00 C ATOM 784 CG GLU A 51 -4.428 11.730 -9.967 1.00 0.00 C ATOM 785 CD GLU A 51 -5.263 12.712 -10.759 1.00 0.00 C ATOM 786 OE1 GLU A 51 -4.744 13.784 -11.133 1.00 0.00 O ATOM 787 OE2 GLU A 51 -6.451 12.424 -11.011 1.00 0.00 O ATOM 0 H GLU A 51 -1.864 12.120 -8.564 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.864 14.172 -8.825 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.914 11.248 -7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.358 12.228 -8.106 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.421 11.696 -10.384 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.851 10.731 -10.073 1.00 0.00 H new ATOM 794 N LEU A 52 -2.995 13.112 -5.829 1.00 0.00 N ATOM 795 CA LEU A 52 -3.282 13.252 -4.403 1.00 0.00 C ATOM 796 C LEU A 52 -2.028 13.297 -3.536 1.00 0.00 C ATOM 797 O LEU A 52 -0.905 13.208 -4.030 1.00 0.00 O ATOM 798 CB LEU A 52 -4.174 12.089 -3.953 1.00 0.00 C ATOM 799 CG LEU A 52 -3.670 10.687 -4.317 1.00 0.00 C ATOM 800 CD1 LEU A 52 -2.437 10.296 -3.518 1.00 0.00 C ATOM 801 CD2 LEU A 52 -4.764 9.673 -4.103 1.00 0.00 C ATOM 0 H LEU A 52 -2.209 12.500 -6.048 1.00 0.00 H new ATOM 0 HA LEU A 52 -3.788 14.208 -4.271 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.292 12.143 -2.871 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.164 12.224 -4.389 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.387 10.706 -5.369 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.116 9.296 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.635 11.007 -3.716 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.675 10.305 -2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.396 8.681 -4.364 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.070 9.683 -3.057 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.618 9.921 -4.733 1.00 0.00 H new ATOM 813 N GLY A 53 -2.251 13.406 -2.230 1.00 0.00 N ATOM 814 CA GLY A 53 -1.175 13.308 -1.265 1.00 0.00 C ATOM 815 C GLY A 53 -1.443 12.227 -0.228 1.00 0.00 C ATOM 816 O GLY A 53 -0.979 11.094 -0.369 1.00 0.00 O ATOM 0 H GLY A 53 -3.172 13.563 -1.820 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -0.241 13.091 -1.783 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -1.047 14.268 -0.765 1.00 0.00 H new ATOM 820 N ARG A 54 -2.211 12.573 0.804 1.00 0.00 N ATOM 821 CA ARG A 54 -2.546 11.635 1.883 1.00 0.00 C ATOM 822 C ARG A 54 -3.841 10.878 1.606 1.00 0.00 C ATOM 823 O ARG A 54 -4.385 10.219 2.495 1.00 0.00 O ATOM 824 CB ARG A 54 -2.676 12.381 3.211 1.00 0.00 C ATOM 825 CG ARG A 54 -1.421 12.350 4.068 1.00 0.00 C ATOM 826 CD ARG A 54 -0.213 12.887 3.319 1.00 0.00 C ATOM 827 NE ARG A 54 0.983 12.944 4.160 1.00 0.00 N ATOM 828 CZ ARG A 54 2.222 12.758 3.702 1.00 0.00 C ATOM 829 NH1 ARG A 54 2.420 12.441 2.429 1.00 0.00 N ATOM 830 NH2 ARG A 54 3.264 12.872 4.518 1.00 0.00 N ATOM 0 H ARG A 54 -2.617 13.502 0.919 1.00 0.00 H new ATOM 0 HA ARG A 54 -1.734 10.910 1.938 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -2.938 13.419 3.008 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -3.501 11.949 3.778 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.582 12.941 4.970 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -1.225 11.327 4.388 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -0.015 12.255 2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -0.437 13.885 2.942 1.00 0.00 H new ATOM 0 HE ARG A 54 0.862 13.137 5.154 1.00 0.00 H new ATOM 0 HH11 ARG A 54 1.624 12.339 1.799 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.368 12.299 2.080 1.00 0.00 H new ATOM 0 HH21 ARG A 54 3.119 13.103 5.501 1.00 0.00 H new ATOM 0 HH22 ARG A 54 4.209 12.729 4.162 1.00 0.00 H new ATOM 844 N LEU A 55 -4.334 10.982 0.384 1.00 0.00 N ATOM 845 CA LEU A 55 -5.556 10.285 -0.005 1.00 0.00 C ATOM 846 C LEU A 55 -5.213 8.949 -0.651 1.00 0.00 C ATOM 847 O LEU A 55 -4.109 8.769 -1.166 1.00 0.00 O ATOM 848 CB LEU A 55 -6.402 11.131 -0.971 1.00 0.00 C ATOM 849 CG LEU A 55 -7.081 12.372 -0.370 1.00 0.00 C ATOM 850 CD1 LEU A 55 -7.862 12.005 0.884 1.00 0.00 C ATOM 851 CD2 LEU A 55 -6.068 13.471 -0.074 1.00 0.00 C ATOM 0 H LEU A 55 -3.911 11.540 -0.357 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.144 10.112 0.897 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.763 11.454 -1.793 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.174 10.492 -1.400 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.782 12.758 -1.110 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.334 12.898 1.293 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.628 11.271 0.634 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.183 11.582 1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.581 14.334 0.350 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.329 13.103 0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.568 13.764 -0.997 1.00 0.00 H new ATOM 863 N GLY A 56 -6.154 8.017 -0.612 1.00 0.00 N ATOM 864 CA GLY A 56 -5.913 6.701 -1.169 1.00 0.00 C ATOM 865 C GLY A 56 -6.644 6.458 -2.470 1.00 0.00 C ATOM 866 O GLY A 56 -7.806 6.047 -2.473 1.00 0.00 O ATOM 0 H GLY A 56 -7.080 8.148 -0.205 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -4.843 6.574 -1.333 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -6.216 5.946 -0.444 1.00 0.00 H new ATOM 870 N TYR A 57 -5.955 6.702 -3.574 1.00 0.00 N ATOM 871 CA TYR A 57 -6.494 6.437 -4.903 1.00 0.00 C ATOM 872 C TYR A 57 -6.602 4.937 -5.108 1.00 0.00 C ATOM 873 O TYR A 57 -5.614 4.220 -4.950 1.00 0.00 O ATOM 874 CB TYR A 57 -5.566 7.038 -5.967 1.00 0.00 C ATOM 875 CG TYR A 57 -6.103 7.034 -7.385 1.00 0.00 C ATOM 876 CD1 TYR A 57 -6.198 5.861 -8.121 1.00 0.00 C ATOM 877 CD2 TYR A 57 -6.482 8.223 -7.996 1.00 0.00 C ATOM 878 CE1 TYR A 57 -6.659 5.871 -9.424 1.00 0.00 C ATOM 879 CE2 TYR A 57 -6.947 8.239 -9.296 1.00 0.00 C ATOM 880 CZ TYR A 57 -7.034 7.061 -10.004 1.00 0.00 C ATOM 881 OH TYR A 57 -7.491 7.075 -11.303 1.00 0.00 O ATOM 0 H TYR A 57 -5.011 7.087 -3.577 1.00 0.00 H new ATOM 0 HA TYR A 57 -7.481 6.890 -4.993 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.340 8.067 -5.686 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -4.624 6.490 -5.953 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -5.907 4.925 -7.668 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.412 9.149 -7.445 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -6.725 4.950 -9.984 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.241 9.171 -9.755 1.00 0.00 H new ATOM 0 HH TYR A 57 -7.931 6.223 -11.504 1.00 0.00 H new ATOM 891 N SER A 58 -7.790 4.459 -5.432 1.00 0.00 N ATOM 892 CA SER A 58 -7.968 3.048 -5.711 1.00 0.00 C ATOM 893 C SER A 58 -7.257 2.686 -7.012 1.00 0.00 C ATOM 894 O SER A 58 -7.704 3.044 -8.102 1.00 0.00 O ATOM 895 CB SER A 58 -9.457 2.718 -5.792 1.00 0.00 C ATOM 896 OG SER A 58 -10.125 3.143 -4.614 1.00 0.00 O ATOM 0 H SER A 58 -8.637 5.022 -5.508 1.00 0.00 H new ATOM 0 HA SER A 58 -7.531 2.459 -4.904 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.897 3.205 -6.662 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.591 1.645 -5.926 1.00 0.00 H new ATOM 0 HG SER A 58 -9.495 3.145 -3.863 1.00 0.00 H new ATOM 902 N VAL A 59 -6.148 1.973 -6.882 1.00 0.00 N ATOM 903 CA VAL A 59 -5.310 1.642 -8.024 1.00 0.00 C ATOM 904 C VAL A 59 -5.579 0.225 -8.508 1.00 0.00 C ATOM 905 O VAL A 59 -5.352 -0.102 -9.671 1.00 0.00 O ATOM 906 CB VAL A 59 -3.809 1.793 -7.683 1.00 0.00 C ATOM 907 CG1 VAL A 59 -3.507 3.213 -7.236 1.00 0.00 C ATOM 908 CG2 VAL A 59 -3.386 0.798 -6.610 1.00 0.00 C ATOM 0 H VAL A 59 -5.807 1.611 -5.992 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.562 2.343 -8.819 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.236 1.580 -8.585 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.447 3.302 -7.000 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.760 3.908 -8.037 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.097 3.449 -6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.326 0.928 -6.391 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.967 0.970 -5.704 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.561 -0.217 -6.966 1.00 0.00 H new ATOM 918 N TYR A 60 -6.064 -0.614 -7.608 1.00 0.00 N ATOM 919 CA TYR A 60 -6.361 -1.991 -7.947 1.00 0.00 C ATOM 920 C TYR A 60 -7.684 -2.409 -7.327 1.00 0.00 C ATOM 921 O TYR A 60 -7.783 -2.559 -6.116 1.00 0.00 O ATOM 922 CB TYR A 60 -5.230 -2.903 -7.454 1.00 0.00 C ATOM 923 CG TYR A 60 -5.426 -4.367 -7.779 1.00 0.00 C ATOM 924 CD1 TYR A 60 -4.964 -4.899 -8.976 1.00 0.00 C ATOM 925 CD2 TYR A 60 -6.072 -5.219 -6.891 1.00 0.00 C ATOM 926 CE1 TYR A 60 -5.140 -6.236 -9.276 1.00 0.00 C ATOM 927 CE2 TYR A 60 -6.249 -6.554 -7.185 1.00 0.00 C ATOM 928 CZ TYR A 60 -5.782 -7.060 -8.378 1.00 0.00 C ATOM 929 OH TYR A 60 -5.960 -8.392 -8.675 1.00 0.00 O ATOM 0 H TYR A 60 -6.259 -0.364 -6.639 1.00 0.00 H new ATOM 0 HA TYR A 60 -6.441 -2.082 -9.030 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -4.291 -2.568 -7.894 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -5.134 -2.792 -6.374 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -4.459 -4.257 -9.683 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -6.442 -4.828 -5.954 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.775 -6.634 -10.212 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -6.752 -7.201 -6.482 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.787 -8.712 -8.258 1.00 0.00 H new ATOM 939 N GLU A 61 -8.703 -2.571 -8.148 1.00 0.00 N ATOM 940 CA GLU A 61 -9.983 -3.042 -7.653 1.00 0.00 C ATOM 941 C GLU A 61 -10.239 -4.455 -8.152 1.00 0.00 C ATOM 942 O GLU A 61 -10.387 -4.686 -9.354 1.00 0.00 O ATOM 943 CB GLU A 61 -11.126 -2.117 -8.078 1.00 0.00 C ATOM 944 CG GLU A 61 -12.464 -2.519 -7.477 1.00 0.00 C ATOM 945 CD GLU A 61 -13.617 -1.665 -7.957 1.00 0.00 C ATOM 946 OE1 GLU A 61 -14.136 -1.935 -9.059 1.00 0.00 O ATOM 947 OE2 GLU A 61 -14.026 -0.741 -7.225 1.00 0.00 O ATOM 0 H GLU A 61 -8.672 -2.386 -9.151 1.00 0.00 H new ATOM 0 HA GLU A 61 -9.945 -3.041 -6.564 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.891 -1.095 -7.779 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.205 -2.121 -9.165 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.666 -3.561 -7.723 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.401 -2.454 -6.391 1.00 0.00 H new ATOM 954 N ASP A 62 -10.270 -5.395 -7.226 1.00 0.00 N ATOM 955 CA ASP A 62 -10.503 -6.785 -7.556 1.00 0.00 C ATOM 956 C ASP A 62 -11.890 -7.166 -7.067 1.00 0.00 C ATOM 957 O ASP A 62 -12.666 -6.295 -6.684 1.00 0.00 O ATOM 958 CB ASP A 62 -9.434 -7.663 -6.900 1.00 0.00 C ATOM 959 CG ASP A 62 -9.314 -9.031 -7.543 1.00 0.00 C ATOM 960 OD1 ASP A 62 -10.042 -9.951 -7.130 1.00 0.00 O ATOM 961 OD2 ASP A 62 -8.488 -9.192 -8.464 1.00 0.00 O ATOM 0 H ASP A 62 -10.135 -5.217 -6.231 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.444 -6.935 -8.634 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -8.471 -7.156 -6.956 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -9.670 -7.784 -5.843 1.00 0.00 H new ATOM 966 N ALA A 63 -12.203 -8.448 -7.052 1.00 0.00 N ATOM 967 CA ALA A 63 -13.519 -8.890 -6.640 1.00 0.00 C ATOM 968 C ALA A 63 -13.599 -9.039 -5.126 1.00 0.00 C ATOM 969 O ALA A 63 -14.684 -9.037 -4.550 1.00 0.00 O ATOM 970 CB ALA A 63 -13.880 -10.197 -7.328 1.00 0.00 C ATOM 0 H ALA A 63 -11.566 -9.198 -7.320 1.00 0.00 H new ATOM 0 HA ALA A 63 -14.240 -8.130 -6.939 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -14.872 -10.515 -7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -13.877 -10.052 -8.408 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -13.150 -10.962 -7.062 1.00 0.00 H new ATOM 976 N GLN A 64 -12.447 -9.163 -4.481 1.00 0.00 N ATOM 977 CA GLN A 64 -12.412 -9.311 -3.031 1.00 0.00 C ATOM 978 C GLN A 64 -11.871 -8.052 -2.360 1.00 0.00 C ATOM 979 O GLN A 64 -12.421 -7.591 -1.357 1.00 0.00 O ATOM 980 CB GLN A 64 -11.564 -10.515 -2.602 1.00 0.00 C ATOM 981 CG GLN A 64 -11.946 -11.829 -3.272 1.00 0.00 C ATOM 982 CD GLN A 64 -11.365 -11.991 -4.666 1.00 0.00 C ATOM 983 OE1 GLN A 64 -11.995 -12.584 -5.540 1.00 0.00 O ATOM 984 NE2 GLN A 64 -10.147 -11.511 -4.872 1.00 0.00 N ATOM 0 H GLN A 64 -11.532 -9.164 -4.933 1.00 0.00 H new ATOM 0 HA GLN A 64 -13.441 -9.476 -2.711 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -10.517 -10.302 -2.820 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -11.647 -10.635 -1.522 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -11.609 -12.657 -2.648 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -13.032 -11.895 -3.330 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -9.657 -11.025 -4.121 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -9.700 -11.628 -5.781 1.00 0.00 H new ATOM 993 N TYR A 65 -10.800 -7.488 -2.910 1.00 0.00 N ATOM 994 CA TYR A 65 -10.098 -6.397 -2.242 1.00 0.00 C ATOM 995 C TYR A 65 -9.839 -5.229 -3.188 1.00 0.00 C ATOM 996 O TYR A 65 -9.961 -5.362 -4.408 1.00 0.00 O ATOM 997 CB TYR A 65 -8.769 -6.896 -1.666 1.00 0.00 C ATOM 998 CG TYR A 65 -8.906 -8.138 -0.817 1.00 0.00 C ATOM 999 CD1 TYR A 65 -9.254 -8.054 0.525 1.00 0.00 C ATOM 1000 CD2 TYR A 65 -8.709 -9.396 -1.366 1.00 0.00 C ATOM 1001 CE1 TYR A 65 -9.395 -9.191 1.296 1.00 0.00 C ATOM 1002 CE2 TYR A 65 -8.854 -10.538 -0.605 1.00 0.00 C ATOM 1003 CZ TYR A 65 -9.197 -10.431 0.725 1.00 0.00 C ATOM 1004 OH TYR A 65 -9.342 -11.565 1.486 1.00 0.00 O ATOM 0 H TYR A 65 -10.402 -7.765 -3.808 1.00 0.00 H new ATOM 0 HA TYR A 65 -10.738 -6.043 -1.434 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -8.081 -7.101 -2.486 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -8.322 -6.103 -1.066 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -9.417 -7.085 0.972 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.437 -9.484 -2.408 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -9.659 -9.110 2.340 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.699 -11.510 -1.050 1.00 0.00 H new ATOM 0 HH TYR A 65 -9.169 -12.355 0.932 1.00 0.00 H new ATOM 1014 N ILE A 66 -9.480 -4.090 -2.605 1.00 0.00 N ATOM 1015 CA ILE A 66 -9.204 -2.876 -3.351 1.00 0.00 C ATOM 1016 C ILE A 66 -7.940 -2.202 -2.810 1.00 0.00 C ATOM 1017 O ILE A 66 -7.843 -1.908 -1.618 1.00 0.00 O ATOM 1018 CB ILE A 66 -10.383 -1.887 -3.253 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -11.662 -2.521 -3.798 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -10.063 -0.605 -4.008 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -12.896 -1.668 -3.592 1.00 0.00 C ATOM 0 H ILE A 66 -9.373 -3.987 -1.596 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.059 -3.151 -4.396 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.541 -1.642 -2.203 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.537 -2.713 -4.864 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.813 -3.487 -3.316 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.905 0.083 -3.930 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.175 -0.142 -3.579 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.880 -0.837 -5.057 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -13.766 -2.181 -4.003 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -13.046 -1.497 -2.526 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -12.766 -0.711 -4.098 1.00 0.00 H new ATOM 1033 N GLY A 67 -6.985 -1.962 -3.692 1.00 0.00 N ATOM 1034 CA GLY A 67 -5.738 -1.337 -3.296 1.00 0.00 C ATOM 1035 C GLY A 67 -5.754 0.158 -3.523 1.00 0.00 C ATOM 1036 O GLY A 67 -6.321 0.636 -4.503 1.00 0.00 O ATOM 0 H GLY A 67 -7.050 -2.190 -4.684 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -5.549 -1.541 -2.242 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.916 -1.780 -3.859 1.00 0.00 H new ATOM 1040 N HIS A 68 -5.131 0.898 -2.617 1.00 0.00 N ATOM 1041 CA HIS A 68 -5.110 2.357 -2.684 1.00 0.00 C ATOM 1042 C HIS A 68 -3.675 2.864 -2.556 1.00 0.00 C ATOM 1043 O HIS A 68 -2.969 2.497 -1.618 1.00 0.00 O ATOM 1044 CB HIS A 68 -5.962 2.968 -1.558 1.00 0.00 C ATOM 1045 CG HIS A 68 -7.305 2.327 -1.365 1.00 0.00 C ATOM 1046 ND1 HIS A 68 -8.460 2.769 -1.981 1.00 0.00 N ATOM 1047 CD2 HIS A 68 -7.672 1.269 -0.602 1.00 0.00 C ATOM 1048 CE1 HIS A 68 -9.475 2.010 -1.601 1.00 0.00 C ATOM 1049 NE2 HIS A 68 -9.020 1.095 -0.765 1.00 0.00 N ATOM 0 H HIS A 68 -4.628 0.510 -1.819 1.00 0.00 H new ATOM 0 HA HIS A 68 -5.525 2.658 -3.646 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -5.405 2.901 -0.623 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -6.108 4.028 -1.766 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.021 0.673 0.020 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -10.501 2.120 -1.920 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -9.583 0.374 -0.313 1.00 0.00 H new ATOM 1058 N ALA A 69 -3.242 3.703 -3.493 1.00 0.00 N ATOM 1059 CA ALA A 69 -1.882 4.239 -3.459 1.00 0.00 C ATOM 1060 C ALA A 69 -1.783 5.440 -2.532 1.00 0.00 C ATOM 1061 O ALA A 69 -2.480 6.437 -2.719 1.00 0.00 O ATOM 1062 CB ALA A 69 -1.421 4.649 -4.849 1.00 0.00 C ATOM 0 H ALA A 69 -3.806 4.025 -4.279 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.238 3.444 -3.083 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.407 5.044 -4.794 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.437 3.781 -5.508 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.088 5.416 -5.242 1.00 0.00 H new ATOM 1068 N PHE A 70 -0.879 5.360 -1.572 1.00 0.00 N ATOM 1069 CA PHE A 70 -0.648 6.450 -0.643 1.00 0.00 C ATOM 1070 C PHE A 70 0.762 6.986 -0.772 1.00 0.00 C ATOM 1071 O PHE A 70 1.711 6.231 -0.994 1.00 0.00 O ATOM 1072 CB PHE A 70 -0.887 5.997 0.794 1.00 0.00 C ATOM 1073 CG PHE A 70 -2.333 5.923 1.160 1.00 0.00 C ATOM 1074 CD1 PHE A 70 -2.976 7.030 1.677 1.00 0.00 C ATOM 1075 CD2 PHE A 70 -3.049 4.754 0.987 1.00 0.00 C ATOM 1076 CE1 PHE A 70 -4.309 6.973 2.020 1.00 0.00 C ATOM 1077 CE2 PHE A 70 -4.382 4.689 1.326 1.00 0.00 C ATOM 1078 CZ PHE A 70 -5.015 5.801 1.844 1.00 0.00 C ATOM 0 H PHE A 70 -0.288 4.543 -1.415 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.352 7.244 -0.891 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.433 5.017 0.938 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -0.383 6.685 1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.428 7.951 1.814 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -2.558 3.882 0.582 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.801 7.845 2.426 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.931 3.770 1.187 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.060 5.754 2.111 1.00 0.00 H new ATOM 1088 N LYS A 71 0.888 8.297 -0.669 1.00 0.00 N ATOM 1089 CA LYS A 71 2.193 8.932 -0.618 1.00 0.00 C ATOM 1090 C LYS A 71 2.736 8.874 0.805 1.00 0.00 C ATOM 1091 O LYS A 71 2.055 9.258 1.759 1.00 0.00 O ATOM 1092 CB LYS A 71 2.119 10.384 -1.099 1.00 0.00 C ATOM 1093 CG LYS A 71 2.273 10.570 -2.607 1.00 0.00 C ATOM 1094 CD LYS A 71 1.067 10.069 -3.394 1.00 0.00 C ATOM 1095 CE LYS A 71 1.181 8.593 -3.744 1.00 0.00 C ATOM 1096 NZ LYS A 71 -0.046 8.084 -4.413 1.00 0.00 N ATOM 0 H LYS A 71 0.101 8.944 -0.619 1.00 0.00 H new ATOM 0 HA LYS A 71 2.866 8.393 -1.284 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.162 10.805 -0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 71 2.896 10.958 -0.595 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.428 11.627 -2.823 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.165 10.042 -2.944 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.161 10.233 -2.811 1.00 0.00 H new ATOM 0 HD3 LYS A 71 0.966 10.651 -4.310 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.040 8.440 -4.397 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.364 8.018 -2.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.203 7.290 -5.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -0.724 7.760 -3.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -0.476 8.845 -4.976 1.00 0.00 H new ATOM 1110 N LYS A 72 3.952 8.374 0.941 1.00 0.00 N ATOM 1111 CA LYS A 72 4.584 8.221 2.243 1.00 0.00 C ATOM 1112 C LYS A 72 5.844 9.072 2.300 1.00 0.00 C ATOM 1113 O LYS A 72 6.203 9.709 1.310 1.00 0.00 O ATOM 1114 CB LYS A 72 4.940 6.750 2.489 1.00 0.00 C ATOM 1115 CG LYS A 72 3.784 5.788 2.258 1.00 0.00 C ATOM 1116 CD LYS A 72 2.651 6.001 3.249 1.00 0.00 C ATOM 1117 CE LYS A 72 3.085 5.701 4.673 1.00 0.00 C ATOM 1118 NZ LYS A 72 1.972 5.888 5.637 1.00 0.00 N ATOM 0 H LYS A 72 4.527 8.064 0.158 1.00 0.00 H new ATOM 0 HA LYS A 72 3.889 8.548 3.016 1.00 0.00 H new ATOM 0 HB2 LYS A 72 5.767 6.472 1.835 1.00 0.00 H new ATOM 0 HB3 LYS A 72 5.293 6.639 3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 72 3.406 5.915 1.244 1.00 0.00 H new ATOM 0 HG3 LYS A 72 4.146 4.763 2.337 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.301 7.031 3.185 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.810 5.361 2.983 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.451 4.676 4.734 1.00 0.00 H new ATOM 0 HE3 LYS A 72 3.916 6.352 4.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.359 6.128 6.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.355 6.658 5.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.421 5.009 5.706 1.00 0.00 H new ATOM 1132 N ALA A 73 6.518 9.070 3.443 1.00 0.00 N ATOM 1133 CA ALA A 73 7.745 9.840 3.613 1.00 0.00 C ATOM 1134 C ALA A 73 8.842 9.347 2.673 1.00 0.00 C ATOM 1135 O ALA A 73 9.543 8.377 2.969 1.00 0.00 O ATOM 1136 CB ALA A 73 8.215 9.776 5.056 1.00 0.00 C ATOM 0 H ALA A 73 6.235 8.542 4.269 1.00 0.00 H new ATOM 0 HA ALA A 73 7.528 10.878 3.360 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.132 10.356 5.166 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.445 10.188 5.708 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.406 8.739 5.331 1.00 0.00 H new ATOM 1142 N GLY A 74 8.951 9.998 1.523 1.00 0.00 N ATOM 1143 CA GLY A 74 9.965 9.645 0.548 1.00 0.00 C ATOM 1144 C GLY A 74 9.673 8.336 -0.162 1.00 0.00 C ATOM 1145 O GLY A 74 10.475 7.868 -0.967 1.00 0.00 O ATOM 0 H GLY A 74 8.348 10.773 1.246 1.00 0.00 H new ATOM 0 HA2 GLY A 74 10.045 10.443 -0.190 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.932 9.574 1.046 1.00 0.00 H new ATOM 1149 N HIS A 75 8.519 7.746 0.114 1.00 0.00 N ATOM 1150 CA HIS A 75 8.187 6.439 -0.434 1.00 0.00 C ATOM 1151 C HIS A 75 6.720 6.355 -0.818 1.00 0.00 C ATOM 1152 O HIS A 75 5.946 7.274 -0.567 1.00 0.00 O ATOM 1153 CB HIS A 75 8.539 5.330 0.561 1.00 0.00 C ATOM 1154 CG HIS A 75 9.993 4.972 0.557 1.00 0.00 C ATOM 1155 ND1 HIS A 75 10.738 4.817 1.701 1.00 0.00 N ATOM 1156 CD2 HIS A 75 10.838 4.735 -0.472 1.00 0.00 C ATOM 1157 CE1 HIS A 75 11.976 4.498 1.376 1.00 0.00 C ATOM 1158 NE2 HIS A 75 12.066 4.441 0.061 1.00 0.00 N ATOM 0 H HIS A 75 7.799 8.150 0.712 1.00 0.00 H new ATOM 0 HA HIS A 75 8.780 6.301 -1.338 1.00 0.00 H new ATOM 0 HB2 HIS A 75 8.252 5.646 1.564 1.00 0.00 H new ATOM 0 HB3 HIS A 75 7.952 4.442 0.327 1.00 0.00 H new ATOM 0 HD2 HIS A 75 10.590 4.771 -1.523 1.00 0.00 H new ATOM 0 HE1 HIS A 75 12.782 4.314 2.071 1.00 0.00 H new ATOM 0 HE2 HIS A 75 12.908 4.216 -0.470 1.00 0.00 H new ATOM 1167 N PHE A 76 6.353 5.252 -1.447 1.00 0.00 N ATOM 1168 CA PHE A 76 4.990 5.044 -1.898 1.00 0.00 C ATOM 1169 C PHE A 76 4.492 3.698 -1.408 1.00 0.00 C ATOM 1170 O PHE A 76 5.150 2.690 -1.608 1.00 0.00 O ATOM 1171 CB PHE A 76 4.938 5.090 -3.426 1.00 0.00 C ATOM 1172 CG PHE A 76 5.420 6.387 -4.011 1.00 0.00 C ATOM 1173 CD1 PHE A 76 4.653 7.536 -3.913 1.00 0.00 C ATOM 1174 CD2 PHE A 76 6.642 6.456 -4.664 1.00 0.00 C ATOM 1175 CE1 PHE A 76 5.094 8.727 -4.452 1.00 0.00 C ATOM 1176 CE2 PHE A 76 7.087 7.646 -5.205 1.00 0.00 C ATOM 1177 CZ PHE A 76 6.313 8.783 -5.099 1.00 0.00 C ATOM 0 H PHE A 76 6.987 4.481 -1.658 1.00 0.00 H new ATOM 0 HA PHE A 76 4.353 5.832 -1.495 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.542 4.275 -3.825 1.00 0.00 H new ATOM 0 HB3 PHE A 76 3.912 4.915 -3.751 1.00 0.00 H new ATOM 0 HD1 PHE A 76 3.699 7.499 -3.409 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.252 5.569 -4.750 1.00 0.00 H new ATOM 0 HE1 PHE A 76 4.486 9.616 -4.368 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.040 7.687 -5.711 1.00 0.00 H new ATOM 0 HZ PHE A 76 6.659 9.715 -5.521 1.00 0.00 H new ATOM 1187 N ILE A 77 3.344 3.672 -0.756 1.00 0.00 N ATOM 1188 CA ILE A 77 2.802 2.418 -0.260 1.00 0.00 C ATOM 1189 C ILE A 77 1.349 2.262 -0.684 1.00 0.00 C ATOM 1190 O ILE A 77 0.560 3.202 -0.591 1.00 0.00 O ATOM 1191 CB ILE A 77 2.921 2.309 1.277 1.00 0.00 C ATOM 1192 CG1 ILE A 77 4.393 2.394 1.699 1.00 0.00 C ATOM 1193 CG2 ILE A 77 2.300 1.011 1.778 1.00 0.00 C ATOM 1194 CD1 ILE A 77 4.610 2.268 3.192 1.00 0.00 C ATOM 0 H ILE A 77 2.774 4.494 -0.559 1.00 0.00 H new ATOM 0 HA ILE A 77 3.392 1.612 -0.697 1.00 0.00 H new ATOM 0 HB ILE A 77 2.377 3.141 1.724 1.00 0.00 H new ATOM 0 HG12 ILE A 77 4.952 1.607 1.193 1.00 0.00 H new ATOM 0 HG13 ILE A 77 4.804 3.345 1.361 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.396 0.957 2.862 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.245 0.983 1.505 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.814 0.163 1.325 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.675 2.338 3.412 1.00 0.00 H new ATOM 0 HD12 ILE A 77 4.080 3.070 3.706 1.00 0.00 H new ATOM 0 HD13 ILE A 77 4.231 1.305 3.535 1.00 0.00 H new ATOM 1206 N VAL A 78 1.016 1.081 -1.171 1.00 0.00 N ATOM 1207 CA VAL A 78 -0.337 0.782 -1.603 1.00 0.00 C ATOM 1208 C VAL A 78 -1.035 -0.093 -0.572 1.00 0.00 C ATOM 1209 O VAL A 78 -0.665 -1.249 -0.372 1.00 0.00 O ATOM 1210 CB VAL A 78 -0.351 0.072 -2.973 1.00 0.00 C ATOM 1211 CG1 VAL A 78 -1.776 -0.216 -3.427 1.00 0.00 C ATOM 1212 CG2 VAL A 78 0.383 0.906 -4.009 1.00 0.00 C ATOM 0 H VAL A 78 1.671 0.306 -1.278 1.00 0.00 H new ATOM 0 HA VAL A 78 -0.867 1.729 -1.703 1.00 0.00 H new ATOM 0 HB VAL A 78 0.165 -0.882 -2.866 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.755 -0.717 -4.395 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.268 -0.859 -2.697 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.326 0.721 -3.515 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.364 0.392 -4.970 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.105 1.876 -4.107 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.417 1.050 -3.694 1.00 0.00 H new ATOM 1222 N TYR A 79 -2.026 0.469 0.094 1.00 0.00 N ATOM 1223 CA TYR A 79 -2.754 -0.246 1.121 1.00 0.00 C ATOM 1224 C TYR A 79 -3.969 -0.940 0.519 1.00 0.00 C ATOM 1225 O TYR A 79 -4.802 -0.307 -0.130 1.00 0.00 O ATOM 1226 CB TYR A 79 -3.192 0.722 2.220 1.00 0.00 C ATOM 1227 CG TYR A 79 -2.045 1.326 3.008 1.00 0.00 C ATOM 1228 CD1 TYR A 79 -1.237 2.308 2.454 1.00 0.00 C ATOM 1229 CD2 TYR A 79 -1.780 0.919 4.309 1.00 0.00 C ATOM 1230 CE1 TYR A 79 -0.200 2.870 3.169 1.00 0.00 C ATOM 1231 CE2 TYR A 79 -0.742 1.475 5.033 1.00 0.00 C ATOM 1232 CZ TYR A 79 0.045 2.450 4.459 1.00 0.00 C ATOM 1233 OH TYR A 79 1.075 3.018 5.179 1.00 0.00 O ATOM 0 H TYR A 79 -2.346 1.425 -0.061 1.00 0.00 H new ATOM 0 HA TYR A 79 -2.100 -1.002 1.555 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -3.773 1.527 1.770 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.855 0.197 2.908 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -1.424 2.639 1.443 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.395 0.156 4.762 1.00 0.00 H new ATOM 0 HE1 TYR A 79 0.417 3.635 2.721 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -0.549 1.147 6.044 1.00 0.00 H new ATOM 0 HH TYR A 79 1.114 2.612 6.070 1.00 0.00 H new ATOM 1243 N PHE A 80 -4.051 -2.244 0.723 1.00 0.00 N ATOM 1244 CA PHE A 80 -5.137 -3.044 0.194 1.00 0.00 C ATOM 1245 C PHE A 80 -6.187 -3.295 1.262 1.00 0.00 C ATOM 1246 O PHE A 80 -5.906 -3.901 2.297 1.00 0.00 O ATOM 1247 CB PHE A 80 -4.602 -4.376 -0.328 1.00 0.00 C ATOM 1248 CG PHE A 80 -3.767 -4.248 -1.570 1.00 0.00 C ATOM 1249 CD1 PHE A 80 -2.417 -3.953 -1.488 1.00 0.00 C ATOM 1250 CD2 PHE A 80 -4.334 -4.427 -2.820 1.00 0.00 C ATOM 1251 CE1 PHE A 80 -1.649 -3.835 -2.631 1.00 0.00 C ATOM 1252 CE2 PHE A 80 -3.572 -4.310 -3.967 1.00 0.00 C ATOM 1253 CZ PHE A 80 -2.229 -4.015 -3.872 1.00 0.00 C ATOM 0 H PHE A 80 -3.366 -2.775 1.260 1.00 0.00 H new ATOM 0 HA PHE A 80 -5.599 -2.496 -0.627 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -4.006 -4.849 0.453 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -5.442 -5.039 -0.533 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -1.959 -3.813 -0.520 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -5.385 -4.661 -2.900 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -0.597 -3.602 -2.554 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -4.028 -4.449 -4.936 1.00 0.00 H new ATOM 0 HZ PHE A 80 -1.631 -3.925 -4.767 1.00 0.00 H new ATOM 1263 N THR A 81 -7.392 -2.821 1.012 1.00 0.00 N ATOM 1264 CA THR A 81 -8.498 -3.027 1.924 1.00 0.00 C ATOM 1265 C THR A 81 -9.506 -3.976 1.295 1.00 0.00 C ATOM 1266 O THR A 81 -9.601 -4.051 0.076 1.00 0.00 O ATOM 1267 CB THR A 81 -9.196 -1.691 2.265 1.00 0.00 C ATOM 1268 OG1 THR A 81 -9.691 -1.062 1.071 1.00 0.00 O ATOM 1269 CG2 THR A 81 -8.240 -0.745 2.965 1.00 0.00 C ATOM 0 H THR A 81 -7.630 -2.286 0.177 1.00 0.00 H new ATOM 0 HA THR A 81 -8.105 -3.456 2.846 1.00 0.00 H new ATOM 0 HB THR A 81 -10.030 -1.914 2.931 1.00 0.00 H new ATOM 0 HG1 THR A 81 -10.665 -0.972 1.129 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.754 0.188 3.195 1.00 0.00 H new ATOM 0 HG22 THR A 81 -7.888 -1.202 3.890 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.390 -0.540 2.315 1.00 0.00 H new ATOM 1277 N PRO A 82 -10.255 -4.734 2.096 1.00 0.00 N ATOM 1278 CA PRO A 82 -11.342 -5.554 1.571 1.00 0.00 C ATOM 1279 C PRO A 82 -12.407 -4.665 0.952 1.00 0.00 C ATOM 1280 O PRO A 82 -12.710 -3.617 1.516 1.00 0.00 O ATOM 1281 CB PRO A 82 -11.883 -6.282 2.804 1.00 0.00 C ATOM 1282 CG PRO A 82 -11.424 -5.469 3.969 1.00 0.00 C ATOM 1283 CD PRO A 82 -10.119 -4.851 3.556 1.00 0.00 C ATOM 0 HA PRO A 82 -11.023 -6.245 0.791 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.970 -6.351 2.775 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -11.500 -7.301 2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -12.156 -4.702 4.222 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.297 -6.093 4.854 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.966 -3.880 4.026 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.271 -5.477 3.833 1.00 0.00 H new ATOM 1291 N LYS A 83 -12.931 -5.077 -0.214 1.00 0.00 N ATOM 1292 CA LYS A 83 -13.925 -4.300 -0.972 1.00 0.00 C ATOM 1293 C LYS A 83 -14.818 -3.454 -0.077 1.00 0.00 C ATOM 1294 O LYS A 83 -15.765 -3.955 0.536 1.00 0.00 O ATOM 1295 CB LYS A 83 -14.805 -5.219 -1.816 1.00 0.00 C ATOM 1296 CG LYS A 83 -14.504 -5.169 -3.302 1.00 0.00 C ATOM 1297 CD LYS A 83 -15.528 -5.965 -4.089 1.00 0.00 C ATOM 1298 CE LYS A 83 -15.343 -5.799 -5.587 1.00 0.00 C ATOM 1299 NZ LYS A 83 -15.697 -4.435 -6.067 1.00 0.00 N ATOM 0 H LYS A 83 -12.677 -5.959 -0.658 1.00 0.00 H new ATOM 0 HA LYS A 83 -13.355 -3.630 -1.615 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -14.683 -6.244 -1.466 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -15.849 -4.950 -1.658 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -14.503 -4.133 -3.642 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -13.507 -5.567 -3.489 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -15.447 -7.020 -3.828 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -16.531 -5.644 -3.809 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.306 -6.012 -5.846 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -15.958 -6.533 -6.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -15.682 -4.418 -7.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -16.648 -4.184 -5.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -15.008 -3.748 -5.700 1.00 0.00 H new ATOM 1313 N ASN A 84 -14.489 -2.179 0.008 1.00 0.00 N ATOM 1314 CA ASN A 84 -15.232 -1.242 0.823 1.00 0.00 C ATOM 1315 C ASN A 84 -15.609 -0.022 -0.002 1.00 0.00 C ATOM 1316 O ASN A 84 -14.846 0.939 -0.115 1.00 0.00 O ATOM 1317 CB ASN A 84 -14.427 -0.839 2.076 1.00 0.00 C ATOM 1318 CG ASN A 84 -13.054 -0.248 1.771 1.00 0.00 C ATOM 1319 OD1 ASN A 84 -12.405 -0.591 0.780 1.00 0.00 O ATOM 1320 ND2 ASN A 84 -12.594 0.644 2.635 1.00 0.00 N ATOM 0 H ASN A 84 -13.699 -1.765 -0.487 1.00 0.00 H new ATOM 0 HA ASN A 84 -16.147 -1.726 1.164 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -15.005 -0.112 2.648 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -14.300 -1.716 2.711 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -11.678 1.069 2.490 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -13.156 0.906 3.445 1.00 0.00 H new ATOM 1327 N LYS A 85 -16.776 -0.083 -0.619 1.00 0.00 N ATOM 1328 CA LYS A 85 -17.266 1.028 -1.411 1.00 0.00 C ATOM 1329 C LYS A 85 -17.687 2.167 -0.492 1.00 0.00 C ATOM 1330 O LYS A 85 -18.750 2.132 0.131 1.00 0.00 O ATOM 1331 CB LYS A 85 -18.413 0.607 -2.355 1.00 0.00 C ATOM 1332 CG LYS A 85 -19.626 -0.028 -1.680 1.00 0.00 C ATOM 1333 CD LYS A 85 -19.350 -1.449 -1.218 1.00 0.00 C ATOM 1334 CE LYS A 85 -20.598 -2.096 -0.643 1.00 0.00 C ATOM 1335 NZ LYS A 85 -20.308 -3.420 -0.039 1.00 0.00 N ATOM 0 H LYS A 85 -17.400 -0.889 -0.586 1.00 0.00 H new ATOM 0 HA LYS A 85 -16.455 1.374 -2.052 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -18.746 1.486 -2.907 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -18.017 -0.097 -3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -19.922 0.579 -0.824 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -20.466 -0.031 -2.375 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -18.984 -2.042 -2.057 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -18.562 -1.442 -0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -21.032 -1.440 0.112 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -21.342 -2.212 -1.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -21.186 -3.828 0.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -19.918 -4.055 -0.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -19.617 -3.307 0.730 1.00 0.00 H new ATOM 1349 N ASN A 86 -16.805 3.146 -0.368 1.00 0.00 N ATOM 1350 CA ASN A 86 -17.049 4.297 0.486 1.00 0.00 C ATOM 1351 C ASN A 86 -18.258 5.075 -0.001 1.00 0.00 C ATOM 1352 O ASN A 86 -18.493 5.184 -1.206 1.00 0.00 O ATOM 1353 CB ASN A 86 -15.809 5.198 0.524 1.00 0.00 C ATOM 1354 CG ASN A 86 -16.028 6.483 1.307 1.00 0.00 C ATOM 1355 OD1 ASN A 86 -16.376 7.518 0.742 1.00 0.00 O ATOM 1356 ND2 ASN A 86 -15.830 6.423 2.617 1.00 0.00 N ATOM 0 H ASN A 86 -15.907 3.166 -0.852 1.00 0.00 H new ATOM 0 HA ASN A 86 -17.255 3.944 1.497 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -14.980 4.646 0.967 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -15.517 5.447 -0.496 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -15.966 7.254 3.192 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.541 5.545 3.050 1.00 0.00 H new ATOM 1363 N ARG A 87 -19.036 5.585 0.941 1.00 0.00 N ATOM 1364 CA ARG A 87 -20.196 6.396 0.619 1.00 0.00 C ATOM 1365 C ARG A 87 -19.737 7.769 0.135 1.00 0.00 C ATOM 1366 O ARG A 87 -19.822 8.759 0.862 1.00 0.00 O ATOM 1367 CB ARG A 87 -21.098 6.532 1.851 1.00 0.00 C ATOM 1368 CG ARG A 87 -22.474 7.107 1.561 1.00 0.00 C ATOM 1369 CD ARG A 87 -23.299 6.171 0.695 1.00 0.00 C ATOM 1370 NE ARG A 87 -24.691 6.605 0.596 1.00 0.00 N ATOM 1371 CZ ARG A 87 -25.556 6.142 -0.304 1.00 0.00 C ATOM 1372 NH1 ARG A 87 -25.164 5.278 -1.232 1.00 0.00 N ATOM 1373 NH2 ARG A 87 -26.816 6.552 -0.280 1.00 0.00 N ATOM 0 H ARG A 87 -18.882 5.449 1.940 1.00 0.00 H new ATOM 0 HA ARG A 87 -20.769 5.915 -0.174 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -21.217 5.550 2.309 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -20.599 7.167 2.583 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -22.997 7.292 2.499 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -22.369 8.069 1.060 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -22.863 6.120 -0.303 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -23.261 5.164 1.111 1.00 0.00 H new ATOM 0 HE ARG A 87 -25.021 7.307 1.258 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -24.194 4.964 -1.259 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -25.833 4.928 -1.918 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -27.121 7.221 0.427 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -27.480 6.199 -0.969 1.00 0.00 H new ATOM 1387 N GLU A 88 -19.218 7.810 -1.086 1.00 0.00 N ATOM 1388 CA GLU A 88 -18.653 9.030 -1.628 1.00 0.00 C ATOM 1389 C GLU A 88 -19.736 10.056 -1.933 1.00 0.00 C ATOM 1390 O GLU A 88 -20.932 9.768 -1.858 1.00 0.00 O ATOM 1391 CB GLU A 88 -17.799 8.742 -2.864 1.00 0.00 C ATOM 1392 CG GLU A 88 -18.501 7.940 -3.946 1.00 0.00 C ATOM 1393 CD GLU A 88 -17.614 7.726 -5.152 1.00 0.00 C ATOM 1394 OE1 GLU A 88 -16.825 6.759 -5.162 1.00 0.00 O ATOM 1395 OE2 GLU A 88 -17.683 8.534 -6.097 1.00 0.00 O ATOM 0 H GLU A 88 -19.179 7.009 -1.717 1.00 0.00 H new ATOM 0 HA GLU A 88 -18.001 9.458 -0.866 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -17.468 9.689 -3.289 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -16.904 8.203 -2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -18.805 6.974 -3.543 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -19.410 8.459 -4.251 1.00 0.00 H new ATOM 1402 N GLY A 89 -19.302 11.252 -2.291 1.00 0.00 N ATOM 1403 CA GLY A 89 -20.189 12.392 -2.318 1.00 0.00 C ATOM 1404 C GLY A 89 -19.925 13.251 -1.107 1.00 0.00 C ATOM 1405 O GLY A 89 -19.907 14.480 -1.179 1.00 0.00 O ATOM 0 H GLY A 89 -18.341 11.454 -2.566 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.032 12.969 -3.230 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -21.227 12.061 -2.325 1.00 0.00 H new ATOM 1409 N VAL A 90 -19.701 12.577 0.012 1.00 0.00 N ATOM 1410 CA VAL A 90 -19.215 13.209 1.224 1.00 0.00 C ATOM 1411 C VAL A 90 -17.898 12.547 1.609 1.00 0.00 C ATOM 1412 O VAL A 90 -17.878 11.577 2.363 1.00 0.00 O ATOM 1413 CB VAL A 90 -20.217 13.077 2.396 1.00 0.00 C ATOM 1414 CG1 VAL A 90 -19.767 13.914 3.585 1.00 0.00 C ATOM 1415 CG2 VAL A 90 -21.620 13.469 1.960 1.00 0.00 C ATOM 0 H VAL A 90 -19.853 11.572 0.102 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.084 14.273 1.030 1.00 0.00 H new ATOM 0 HB VAL A 90 -20.241 12.032 2.704 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -20.485 13.807 4.398 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -18.787 13.574 3.920 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -19.706 14.962 3.290 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.304 13.367 2.802 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -21.619 14.503 1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -21.944 12.818 1.148 1.00 0.00 H new ATOM 1425 N VAL A 91 -16.808 13.042 1.044 1.00 0.00 N ATOM 1426 CA VAL A 91 -15.510 12.402 1.217 1.00 0.00 C ATOM 1427 C VAL A 91 -14.873 12.774 2.552 1.00 0.00 C ATOM 1428 O VAL A 91 -14.947 13.923 2.993 1.00 0.00 O ATOM 1429 CB VAL A 91 -14.540 12.739 0.060 1.00 0.00 C ATOM 1430 CG1 VAL A 91 -15.058 12.170 -1.252 1.00 0.00 C ATOM 1431 CG2 VAL A 91 -14.323 14.239 -0.062 1.00 0.00 C ATOM 0 H VAL A 91 -16.794 13.881 0.464 1.00 0.00 H new ATOM 0 HA VAL A 91 -15.694 11.328 1.207 1.00 0.00 H new ATOM 0 HB VAL A 91 -13.578 12.279 0.287 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -14.363 12.417 -2.055 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -15.147 11.087 -1.169 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -16.035 12.598 -1.474 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.637 14.442 -0.884 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -15.277 14.730 -0.256 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -13.900 14.622 0.867 1.00 0.00 H new ATOM 1441 N PRO A 92 -14.253 11.787 3.218 1.00 0.00 N ATOM 1442 CA PRO A 92 -13.599 11.987 4.514 1.00 0.00 C ATOM 1443 C PRO A 92 -12.364 12.882 4.408 1.00 0.00 C ATOM 1444 O PRO A 92 -11.428 12.581 3.665 1.00 0.00 O ATOM 1445 CB PRO A 92 -13.201 10.569 4.941 1.00 0.00 C ATOM 1446 CG PRO A 92 -13.117 9.795 3.671 1.00 0.00 C ATOM 1447 CD PRO A 92 -14.148 10.392 2.756 1.00 0.00 C ATOM 0 HA PRO A 92 -14.254 12.489 5.226 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.247 10.568 5.468 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -13.939 10.139 5.618 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.120 9.866 3.236 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -13.314 8.737 3.844 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -13.838 10.337 1.712 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -15.102 9.871 2.833 1.00 0.00 H new ATOM 1455 N PRO A 93 -12.354 13.999 5.147 1.00 0.00 N ATOM 1456 CA PRO A 93 -11.230 14.935 5.145 1.00 0.00 C ATOM 1457 C PRO A 93 -10.031 14.399 5.923 1.00 0.00 C ATOM 1458 O PRO A 93 -10.165 13.490 6.751 1.00 0.00 O ATOM 1459 CB PRO A 93 -11.806 16.174 5.831 1.00 0.00 C ATOM 1460 CG PRO A 93 -12.869 15.646 6.731 1.00 0.00 C ATOM 1461 CD PRO A 93 -13.443 14.439 6.041 1.00 0.00 C ATOM 0 HA PRO A 93 -10.853 15.124 4.140 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -11.040 16.708 6.393 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.215 16.876 5.104 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.457 15.379 7.704 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.639 16.397 6.906 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.715 13.661 6.754 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -14.345 14.688 5.482 1.00 0.00 H new ATOM 1469 N VAL A 94 -8.862 14.965 5.652 1.00 0.00 N ATOM 1470 CA VAL A 94 -7.637 14.567 6.328 1.00 0.00 C ATOM 1471 C VAL A 94 -7.402 15.456 7.544 1.00 0.00 C ATOM 1472 O VAL A 94 -7.242 14.971 8.664 1.00 0.00 O ATOM 1473 CB VAL A 94 -6.412 14.654 5.389 1.00 0.00 C ATOM 1474 CG1 VAL A 94 -5.158 14.147 6.087 1.00 0.00 C ATOM 1475 CG2 VAL A 94 -6.661 13.875 4.103 1.00 0.00 C ATOM 0 H VAL A 94 -8.738 15.707 4.963 1.00 0.00 H new ATOM 0 HA VAL A 94 -7.756 13.529 6.640 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.259 15.702 5.131 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -4.309 14.218 5.407 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.965 14.752 6.973 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -5.301 13.107 6.382 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -5.786 13.950 3.457 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.847 12.828 4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.528 14.289 3.589 1.00 0.00 H new ATOM 1485 N GLY A 95 -7.402 16.762 7.316 1.00 0.00 N ATOM 1486 CA GLY A 95 -7.198 17.702 8.396 1.00 0.00 C ATOM 1487 C GLY A 95 -6.172 18.760 8.051 1.00 0.00 C ATOM 1488 O GLY A 95 -6.240 19.379 6.985 1.00 0.00 O ATOM 0 H GLY A 95 -7.540 17.187 6.399 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -8.145 18.183 8.639 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -6.876 17.164 9.287 1.00 0.00 H new ATOM 1492 N ILE A 96 -5.214 18.961 8.942 1.00 0.00 N ATOM 1493 CA ILE A 96 -4.178 19.963 8.748 1.00 0.00 C ATOM 1494 C ILE A 96 -2.807 19.305 8.638 1.00 0.00 C ATOM 1495 O ILE A 96 -2.027 19.614 7.734 1.00 0.00 O ATOM 1496 CB ILE A 96 -4.161 20.990 9.904 1.00 0.00 C ATOM 1497 CG1 ILE A 96 -5.512 21.707 9.999 1.00 0.00 C ATOM 1498 CG2 ILE A 96 -3.032 21.996 9.711 1.00 0.00 C ATOM 1499 CD1 ILE A 96 -5.603 22.685 11.151 1.00 0.00 C ATOM 0 H ILE A 96 -5.133 18.438 9.814 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.405 20.487 7.820 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.986 20.457 10.838 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.697 22.240 9.066 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.302 20.963 10.103 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.036 22.710 10.534 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.077 21.471 9.691 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -3.174 22.527 8.770 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.587 23.153 11.154 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.451 22.155 12.091 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -4.837 23.452 11.039 1.00 0.00 H new ATOM 1511 N THR A 97 -2.524 18.389 9.550 1.00 0.00 N ATOM 1512 CA THR A 97 -1.229 17.728 9.597 1.00 0.00 C ATOM 1513 C THR A 97 -1.381 16.209 9.632 1.00 0.00 C ATOM 1514 O THR A 97 -2.075 15.666 10.495 1.00 0.00 O ATOM 1515 CB THR A 97 -0.422 18.192 10.826 1.00 0.00 C ATOM 1516 OG1 THR A 97 -1.272 18.234 11.983 1.00 0.00 O ATOM 1517 CG2 THR A 97 0.190 19.564 10.594 1.00 0.00 C ATOM 0 H THR A 97 -3.177 18.085 10.272 1.00 0.00 H new ATOM 0 HA THR A 97 -0.692 18.004 8.690 1.00 0.00 H new ATOM 0 HB THR A 97 0.385 17.478 10.989 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.864 17.453 11.983 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.753 19.865 11.477 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.858 19.524 9.734 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.602 20.288 10.404 1.00 0.00 H new ATOM 1525 N ASN A 98 -0.746 15.533 8.686 1.00 0.00 N ATOM 1526 CA ASN A 98 -0.746 14.078 8.652 1.00 0.00 C ATOM 1527 C ASN A 98 0.544 13.576 8.014 1.00 0.00 C ATOM 1528 O ASN A 98 0.540 13.266 6.802 1.00 0.00 O ATOM 1529 CB ASN A 98 -1.953 13.548 7.869 1.00 0.00 C ATOM 1530 CG ASN A 98 -2.124 12.046 8.018 1.00 0.00 C ATOM 1531 OD1 ASN A 98 -2.892 11.573 8.855 1.00 0.00 O ATOM 1532 ND2 ASN A 98 -1.394 11.284 7.224 1.00 0.00 N ATOM 1533 OXT ASN A 98 1.571 13.527 8.721 1.00 0.00 O ATOM 0 H ASN A 98 -0.222 15.971 7.929 1.00 0.00 H new ATOM 0 HA ASN A 98 -0.813 13.711 9.676 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -2.856 14.050 8.215 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -1.835 13.795 6.814 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -1.456 10.268 7.293 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -0.768 11.711 6.541 1.00 0.00 H new TER 1540 ASN A 98