USER MOD reduce.3.24.130724 H: found=0, std=0, add=801, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 799 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 92 LYS NZ :NH3+ -145:sc= 0.0295 (180deg=0) USER MOD Set 1.2: A 95 HIS : no HE2:sc= -1.8 X(o=-1.8,f=-1.4) USER MOD Set 2.1: A 14 SER OG : rot 180:sc= -0.898 USER MOD Set 2.2: A 25 GLN : amide:sc= 0 K(o=-0.9,f=-2.1!) USER MOD Single : A 1 MET CE :methyl -152:sc= -0.258 (180deg=-1.59!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0166 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A -1 GLY N :NH3+ -110:sc= 0.0645 (180deg=0) USER MOD Single : A 11 CYS SG : rot -165:sc= -7.16! USER MOD Single : A 17 CYS SG : rot 180:sc= -0.147 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 32 SER OG : rot -160:sc= -1.09 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0211 USER MOD Single : A 44 ASN : amide:sc= -1.27 K(o=-1.3,f=-1.8) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 52 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.47 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.326 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.32) USER MOD Single : A 78 HIS : no HD1:sc= -0.0202 X(o=-0.02,f=-0.02) USER MOD Single : A 79 THR OG1 : rot -145:sc= -0.669 USER MOD Single : A 86 ASN : amide:sc= -2.65! C(o=-2.6!,f=-3.9!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 49:sc= 0.244 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.115 K(o=-0.11,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 96.008 3.399 -7.427 1.00 0.00 N ATOM 2 CA GLY A -1 96.616 4.705 -7.809 1.00 0.00 C ATOM 3 C GLY A -1 96.482 5.692 -6.649 1.00 0.00 C ATOM 4 O GLY A -1 95.602 5.565 -5.816 1.00 0.00 O ATOM 0 H1 GLY A -1 96.758 2.689 -7.306 1.00 0.00 H new ATOM 0 H2 GLY A -1 95.486 3.507 -6.534 1.00 0.00 H new ATOM 0 H3 GLY A -1 95.355 3.088 -8.174 1.00 0.00 H new ATOM 0 HA2 GLY A -1 97.667 4.568 -8.063 1.00 0.00 H new ATOM 0 HA3 GLY A -1 96.122 5.102 -8.696 1.00 0.00 H new ATOM 10 N ALA A 0 97.351 6.672 -6.590 1.00 0.00 N ATOM 11 CA ALA A 0 97.283 7.679 -5.484 1.00 0.00 C ATOM 12 C ALA A 0 95.953 8.435 -5.541 1.00 0.00 C ATOM 13 O ALA A 0 95.421 8.846 -4.526 1.00 0.00 O ATOM 14 CB ALA A 0 98.452 8.637 -5.729 1.00 0.00 C ATOM 0 H ALA A 0 98.105 6.818 -7.261 1.00 0.00 H new ATOM 0 HA ALA A 0 97.346 7.210 -4.502 1.00 0.00 H new ATOM 0 HB1 ALA A 0 98.463 9.403 -4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 0 99.389 8.081 -5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 0 98.337 9.110 -6.704 1.00 0.00 H new ATOM 20 N MET A 1 95.417 8.619 -6.722 1.00 0.00 N ATOM 21 CA MET A 1 94.115 9.342 -6.865 1.00 0.00 C ATOM 22 C MET A 1 93.317 8.745 -8.028 1.00 0.00 C ATOM 23 O MET A 1 93.879 8.199 -8.960 1.00 0.00 O ATOM 24 CB MET A 1 94.475 10.806 -7.161 1.00 0.00 C ATOM 25 CG MET A 1 95.139 11.465 -5.942 1.00 0.00 C ATOM 26 SD MET A 1 93.983 11.502 -4.547 1.00 0.00 S ATOM 27 CE MET A 1 92.741 12.574 -5.311 1.00 0.00 C ATOM 0 H MET A 1 95.828 8.298 -7.599 1.00 0.00 H new ATOM 0 HA MET A 1 93.503 9.258 -5.967 1.00 0.00 H new ATOM 0 HB2 MET A 1 95.149 10.853 -8.017 1.00 0.00 H new ATOM 0 HB3 MET A 1 93.575 11.358 -7.433 1.00 0.00 H new ATOM 0 HG2 MET A 1 96.038 10.913 -5.665 1.00 0.00 H new ATOM 0 HG3 MET A 1 95.452 12.479 -6.192 1.00 0.00 H new ATOM 0 HE1 MET A 1 92.212 13.128 -4.536 1.00 0.00 H new ATOM 0 HE2 MET A 1 93.231 13.274 -5.987 1.00 0.00 H new ATOM 0 HE3 MET A 1 92.030 11.966 -5.871 1.00 0.00 H new ATOM 37 N GLY A 2 92.011 8.847 -7.975 1.00 0.00 N ATOM 38 CA GLY A 2 91.158 8.298 -9.073 1.00 0.00 C ATOM 39 C GLY A 2 91.389 6.781 -9.204 1.00 0.00 C ATOM 40 O GLY A 2 91.836 6.322 -10.236 1.00 0.00 O ATOM 0 H GLY A 2 91.497 9.290 -7.213 1.00 0.00 H new ATOM 0 HA2 GLY A 2 90.107 8.498 -8.864 1.00 0.00 H new ATOM 0 HA3 GLY A 2 91.396 8.794 -10.014 1.00 0.00 H new ATOM 44 N PRO A 3 91.078 6.035 -8.156 1.00 0.00 N ATOM 45 CA PRO A 3 91.239 4.560 -8.218 1.00 0.00 C ATOM 46 C PRO A 3 90.227 3.955 -9.197 1.00 0.00 C ATOM 47 O PRO A 3 89.216 3.409 -8.796 1.00 0.00 O ATOM 48 CB PRO A 3 90.957 4.093 -6.790 1.00 0.00 C ATOM 49 CG PRO A 3 90.173 5.196 -6.155 1.00 0.00 C ATOM 50 CD PRO A 3 90.562 6.475 -6.845 1.00 0.00 C ATOM 0 HA PRO A 3 92.226 4.257 -8.567 1.00 0.00 H new ATOM 0 HB2 PRO A 3 90.394 3.160 -6.787 1.00 0.00 H new ATOM 0 HB3 PRO A 3 91.884 3.908 -6.248 1.00 0.00 H new ATOM 0 HG2 PRO A 3 89.103 5.015 -6.256 1.00 0.00 H new ATOM 0 HG3 PRO A 3 90.387 5.255 -5.088 1.00 0.00 H new ATOM 0 HD2 PRO A 3 89.708 7.143 -6.957 1.00 0.00 H new ATOM 0 HD3 PRO A 3 91.320 7.018 -6.280 1.00 0.00 H new ATOM 58 N THR A 4 90.497 4.052 -10.476 1.00 0.00 N ATOM 59 CA THR A 4 89.551 3.499 -11.496 1.00 0.00 C ATOM 60 C THR A 4 89.954 2.077 -11.916 1.00 0.00 C ATOM 61 O THR A 4 89.484 1.572 -12.920 1.00 0.00 O ATOM 62 CB THR A 4 89.654 4.453 -12.688 1.00 0.00 C ATOM 63 OG1 THR A 4 90.997 4.486 -13.151 1.00 0.00 O ATOM 64 CG2 THR A 4 89.222 5.859 -12.265 1.00 0.00 C ATOM 0 H THR A 4 91.334 4.492 -10.859 1.00 0.00 H new ATOM 0 HA THR A 4 88.536 3.428 -11.104 1.00 0.00 H new ATOM 0 HB THR A 4 89.001 4.104 -13.488 1.00 0.00 H new ATOM 0 HG1 THR A 4 91.065 5.095 -13.916 1.00 0.00 H new ATOM 0 HG21 THR A 4 89.297 6.535 -13.117 1.00 0.00 H new ATOM 0 HG22 THR A 4 88.191 5.832 -11.913 1.00 0.00 H new ATOM 0 HG23 THR A 4 89.870 6.213 -11.463 1.00 0.00 H new ATOM 72 N ASP A 5 90.815 1.428 -11.162 1.00 0.00 N ATOM 73 CA ASP A 5 91.281 0.060 -11.551 1.00 0.00 C ATOM 74 C ASP A 5 90.217 -0.988 -11.206 1.00 0.00 C ATOM 75 O ASP A 5 89.493 -0.852 -10.238 1.00 0.00 O ATOM 76 CB ASP A 5 92.555 -0.180 -10.736 1.00 0.00 C ATOM 77 CG ASP A 5 93.629 0.839 -11.136 1.00 0.00 C ATOM 78 OD1 ASP A 5 93.621 1.271 -12.277 1.00 0.00 O ATOM 79 OD2 ASP A 5 94.441 1.172 -10.289 1.00 0.00 O ATOM 0 H ASP A 5 91.213 1.789 -10.295 1.00 0.00 H new ATOM 0 HA ASP A 5 91.464 -0.018 -12.623 1.00 0.00 H new ATOM 0 HB2 ASP A 5 92.338 -0.094 -9.671 1.00 0.00 H new ATOM 0 HB3 ASP A 5 92.921 -1.193 -10.906 1.00 0.00 H new ATOM 84 N GLN A 6 90.123 -2.029 -11.997 1.00 0.00 N ATOM 85 CA GLN A 6 89.103 -3.097 -11.735 1.00 0.00 C ATOM 86 C GLN A 6 89.478 -3.971 -10.527 1.00 0.00 C ATOM 87 O GLN A 6 88.721 -4.841 -10.138 1.00 0.00 O ATOM 88 CB GLN A 6 89.066 -3.941 -13.011 1.00 0.00 C ATOM 89 CG GLN A 6 88.590 -3.077 -14.182 1.00 0.00 C ATOM 90 CD GLN A 6 88.596 -3.904 -15.471 1.00 0.00 C ATOM 91 OE1 GLN A 6 89.285 -4.902 -15.567 1.00 0.00 O ATOM 92 NE2 GLN A 6 87.851 -3.529 -16.474 1.00 0.00 N ATOM 0 H GLN A 6 90.710 -2.187 -12.816 1.00 0.00 H new ATOM 0 HA GLN A 6 88.135 -2.658 -11.495 1.00 0.00 H new ATOM 0 HB2 GLN A 6 90.057 -4.344 -13.222 1.00 0.00 H new ATOM 0 HB3 GLN A 6 88.398 -4.792 -12.878 1.00 0.00 H new ATOM 0 HG2 GLN A 6 87.586 -2.701 -13.984 1.00 0.00 H new ATOM 0 HG3 GLN A 6 89.239 -2.209 -14.293 1.00 0.00 H new ATOM 0 HE21 GLN A 6 87.273 -2.692 -16.395 1.00 0.00 H new ATOM 0 HE22 GLN A 6 87.847 -4.072 -17.337 1.00 0.00 H new ATOM 101 N ASP A 7 90.628 -3.754 -9.938 1.00 0.00 N ATOM 102 CA ASP A 7 91.023 -4.554 -8.735 1.00 0.00 C ATOM 103 C ASP A 7 90.132 -4.195 -7.537 1.00 0.00 C ATOM 104 O ASP A 7 89.966 -4.985 -6.625 1.00 0.00 O ATOM 105 CB ASP A 7 92.493 -4.203 -8.463 1.00 0.00 C ATOM 106 CG ASP A 7 92.639 -2.702 -8.193 1.00 0.00 C ATOM 107 OD1 ASP A 7 92.014 -2.220 -7.263 1.00 0.00 O ATOM 108 OD2 ASP A 7 93.380 -2.061 -8.919 1.00 0.00 O ATOM 0 H ASP A 7 91.311 -3.058 -10.237 1.00 0.00 H new ATOM 0 HA ASP A 7 90.901 -5.624 -8.901 1.00 0.00 H new ATOM 0 HB2 ASP A 7 92.857 -4.771 -7.607 1.00 0.00 H new ATOM 0 HB3 ASP A 7 93.106 -4.487 -9.318 1.00 0.00 H new ATOM 113 N TRP A 8 89.560 -3.010 -7.534 1.00 0.00 N ATOM 114 CA TRP A 8 88.696 -2.591 -6.388 1.00 0.00 C ATOM 115 C TRP A 8 87.303 -3.226 -6.475 1.00 0.00 C ATOM 116 O TRP A 8 86.563 -3.206 -5.513 1.00 0.00 O ATOM 117 CB TRP A 8 88.590 -1.071 -6.475 1.00 0.00 C ATOM 118 CG TRP A 8 89.659 -0.352 -5.715 1.00 0.00 C ATOM 119 CD1 TRP A 8 90.324 0.739 -6.167 1.00 0.00 C ATOM 120 CD2 TRP A 8 90.200 -0.646 -4.391 1.00 0.00 C ATOM 121 NE1 TRP A 8 91.244 1.142 -5.213 1.00 0.00 N ATOM 122 CE2 TRP A 8 91.221 0.331 -4.100 1.00 0.00 C ATOM 123 CE3 TRP A 8 89.921 -1.660 -3.400 1.00 0.00 C ATOM 124 CZ2 TRP A 8 91.948 0.310 -2.870 1.00 0.00 C ATOM 125 CZ3 TRP A 8 90.649 -1.685 -2.161 1.00 0.00 C ATOM 126 CH2 TRP A 8 91.662 -0.702 -1.900 1.00 0.00 C ATOM 0 H TRP A 8 89.657 -2.318 -8.277 1.00 0.00 H new ATOM 0 HA TRP A 8 89.127 -2.916 -5.441 1.00 0.00 H new ATOM 0 HB2 TRP A 8 88.636 -0.771 -7.522 1.00 0.00 H new ATOM 0 HB3 TRP A 8 87.616 -0.761 -6.097 1.00 0.00 H new ATOM 0 HD1 TRP A 8 90.162 1.219 -7.121 1.00 0.00 H new ATOM 0 HE1 TRP A 8 91.865 1.944 -5.322 1.00 0.00 H new ATOM 0 HE3 TRP A 8 89.161 -2.403 -3.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 92.708 1.052 -2.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 90.433 -2.445 -1.425 1.00 0.00 H new ATOM 0 HH2 TRP A 8 92.209 -0.726 -0.969 1.00 0.00 H new ATOM 137 N ILE A 9 86.930 -3.794 -7.603 1.00 0.00 N ATOM 138 CA ILE A 9 85.508 -4.253 -7.779 1.00 0.00 C ATOM 139 C ILE A 9 85.117 -5.226 -6.652 1.00 0.00 C ATOM 140 O ILE A 9 85.847 -6.142 -6.324 1.00 0.00 O ATOM 141 CB ILE A 9 85.460 -4.948 -9.154 1.00 0.00 C ATOM 142 CG1 ILE A 9 85.838 -3.957 -10.274 1.00 0.00 C ATOM 143 CG2 ILE A 9 84.047 -5.488 -9.419 1.00 0.00 C ATOM 144 CD1 ILE A 9 84.890 -2.751 -10.269 1.00 0.00 C ATOM 0 H ILE A 9 87.542 -3.959 -8.402 1.00 0.00 H new ATOM 0 HA ILE A 9 84.803 -3.423 -7.733 1.00 0.00 H new ATOM 0 HB ILE A 9 86.175 -5.771 -9.147 1.00 0.00 H new ATOM 0 HG12 ILE A 9 86.865 -3.620 -10.137 1.00 0.00 H new ATOM 0 HG13 ILE A 9 85.793 -4.458 -11.241 1.00 0.00 H new ATOM 0 HG21 ILE A 9 84.021 -5.978 -10.392 1.00 0.00 H new ATOM 0 HG22 ILE A 9 83.781 -6.207 -8.644 1.00 0.00 H new ATOM 0 HG23 ILE A 9 83.334 -4.663 -9.409 1.00 0.00 H new ATOM 0 HD11 ILE A 9 85.172 -2.063 -11.066 1.00 0.00 H new ATOM 0 HD12 ILE A 9 83.867 -3.092 -10.429 1.00 0.00 H new ATOM 0 HD13 ILE A 9 84.956 -2.240 -9.308 1.00 0.00 H new ATOM 156 N GLY A 10 83.964 -5.019 -6.067 1.00 0.00 N ATOM 157 CA GLY A 10 83.514 -5.880 -4.934 1.00 0.00 C ATOM 158 C GLY A 10 84.079 -5.397 -3.585 1.00 0.00 C ATOM 159 O GLY A 10 83.791 -5.992 -2.560 1.00 0.00 O ATOM 0 H GLY A 10 83.310 -4.282 -6.330 1.00 0.00 H new ATOM 0 HA2 GLY A 10 82.425 -5.883 -4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 10 83.829 -6.908 -5.112 1.00 0.00 H new ATOM 163 N CYS A 11 84.873 -4.339 -3.558 1.00 0.00 N ATOM 164 CA CYS A 11 85.384 -3.827 -2.239 1.00 0.00 C ATOM 165 C CYS A 11 84.347 -2.895 -1.584 1.00 0.00 C ATOM 166 O CYS A 11 83.526 -2.304 -2.260 1.00 0.00 O ATOM 167 CB CYS A 11 86.739 -3.125 -2.539 1.00 0.00 C ATOM 168 SG CYS A 11 86.539 -1.442 -3.216 1.00 0.00 S ATOM 0 H CYS A 11 85.183 -3.819 -4.379 1.00 0.00 H new ATOM 0 HA CYS A 11 85.543 -4.629 -1.518 1.00 0.00 H new ATOM 0 HB2 CYS A 11 87.326 -3.074 -1.622 1.00 0.00 H new ATOM 0 HB3 CYS A 11 87.306 -3.730 -3.247 1.00 0.00 H new ATOM 0 HG CYS A 11 87.663 -1.047 -3.735 1.00 0.00 H new ATOM 174 N ALA A 12 84.388 -2.767 -0.281 1.00 0.00 N ATOM 175 CA ALA A 12 83.362 -1.944 0.433 1.00 0.00 C ATOM 176 C ALA A 12 83.837 -0.494 0.553 1.00 0.00 C ATOM 177 O ALA A 12 84.874 -0.229 1.133 1.00 0.00 O ATOM 178 CB ALA A 12 83.243 -2.582 1.817 1.00 0.00 C ATOM 0 H ALA A 12 85.090 -3.198 0.321 1.00 0.00 H new ATOM 0 HA ALA A 12 82.408 -1.923 -0.094 1.00 0.00 H new ATOM 0 HB1 ALA A 12 82.507 -2.036 2.407 1.00 0.00 H new ATOM 0 HB2 ALA A 12 82.927 -3.620 1.713 1.00 0.00 H new ATOM 0 HB3 ALA A 12 84.210 -2.546 2.319 1.00 0.00 H new ATOM 184 N VAL A 13 83.089 0.441 0.015 1.00 0.00 N ATOM 185 CA VAL A 13 83.516 1.875 0.075 1.00 0.00 C ATOM 186 C VAL A 13 82.333 2.777 0.445 1.00 0.00 C ATOM 187 O VAL A 13 81.184 2.412 0.274 1.00 0.00 O ATOM 188 CB VAL A 13 84.037 2.205 -1.329 1.00 0.00 C ATOM 189 CG1 VAL A 13 85.224 1.299 -1.656 1.00 0.00 C ATOM 190 CG2 VAL A 13 82.930 1.981 -2.368 1.00 0.00 C ATOM 0 H VAL A 13 82.203 0.273 -0.462 1.00 0.00 H new ATOM 0 HA VAL A 13 84.279 2.039 0.835 1.00 0.00 H new ATOM 0 HB VAL A 13 84.349 3.249 -1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 13 85.596 1.532 -2.654 1.00 0.00 H new ATOM 0 HG12 VAL A 13 86.017 1.461 -0.926 1.00 0.00 H new ATOM 0 HG13 VAL A 13 84.907 0.257 -1.621 1.00 0.00 H new ATOM 0 HG21 VAL A 13 83.310 2.218 -3.362 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.611 0.939 -2.341 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.082 2.626 -2.141 1.00 0.00 H new ATOM 200 N SER A 14 82.617 3.952 0.952 1.00 0.00 N ATOM 201 CA SER A 14 81.533 4.935 1.245 1.00 0.00 C ATOM 202 C SER A 14 81.754 6.195 0.415 1.00 0.00 C ATOM 203 O SER A 14 82.875 6.632 0.232 1.00 0.00 O ATOM 204 CB SER A 14 81.661 5.239 2.737 1.00 0.00 C ATOM 205 OG SER A 14 80.768 6.289 3.082 1.00 0.00 O ATOM 0 H SER A 14 83.559 4.272 1.176 1.00 0.00 H new ATOM 0 HA SER A 14 80.541 4.554 1.000 1.00 0.00 H new ATOM 0 HB2 SER A 14 81.435 4.347 3.322 1.00 0.00 H new ATOM 0 HB3 SER A 14 82.686 5.525 2.975 1.00 0.00 H new ATOM 0 HG SER A 14 80.847 6.485 4.039 1.00 0.00 H new ATOM 211 N ILE A 15 80.695 6.781 -0.087 1.00 0.00 N ATOM 212 CA ILE A 15 80.851 7.921 -1.039 1.00 0.00 C ATOM 213 C ILE A 15 80.104 9.145 -0.509 1.00 0.00 C ATOM 214 O ILE A 15 78.906 9.099 -0.288 1.00 0.00 O ATOM 215 CB ILE A 15 80.228 7.460 -2.374 1.00 0.00 C ATOM 216 CG1 ILE A 15 80.744 6.062 -2.794 1.00 0.00 C ATOM 217 CG2 ILE A 15 80.588 8.470 -3.468 1.00 0.00 C ATOM 218 CD1 ILE A 15 82.277 6.020 -2.801 1.00 0.00 C ATOM 0 H ILE A 15 79.732 6.519 0.122 1.00 0.00 H new ATOM 0 HA ILE A 15 81.898 8.196 -1.164 1.00 0.00 H new ATOM 0 HB ILE A 15 79.148 7.399 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE A 15 80.359 5.307 -2.108 1.00 0.00 H new ATOM 0 HG13 ILE A 15 80.366 5.814 -3.786 1.00 0.00 H new ATOM 0 HG21 ILE A 15 80.152 8.152 -4.415 1.00 0.00 H new ATOM 0 HG22 ILE A 15 80.197 9.452 -3.200 1.00 0.00 H new ATOM 0 HG23 ILE A 15 81.672 8.526 -3.569 1.00 0.00 H new ATOM 0 HD11 ILE A 15 82.612 5.027 -3.099 1.00 0.00 H new ATOM 0 HD12 ILE A 15 82.658 6.759 -3.506 1.00 0.00 H new ATOM 0 HD13 ILE A 15 82.652 6.245 -1.802 1.00 0.00 H new ATOM 230 N ALA A 16 80.805 10.231 -0.310 1.00 0.00 N ATOM 231 CA ALA A 16 80.144 11.487 0.144 1.00 0.00 C ATOM 232 C ALA A 16 79.908 12.401 -1.058 1.00 0.00 C ATOM 233 O ALA A 16 80.839 12.938 -1.628 1.00 0.00 O ATOM 234 CB ALA A 16 81.130 12.126 1.122 1.00 0.00 C ATOM 0 H ALA A 16 81.814 10.300 -0.444 1.00 0.00 H new ATOM 0 HA ALA A 16 79.176 11.308 0.612 1.00 0.00 H new ATOM 0 HB1 ALA A 16 80.713 13.059 1.501 1.00 0.00 H new ATOM 0 HB2 ALA A 16 81.311 11.445 1.954 1.00 0.00 H new ATOM 0 HB3 ALA A 16 82.070 12.330 0.609 1.00 0.00 H new ATOM 240 N CYS A 17 78.670 12.570 -1.446 1.00 0.00 N ATOM 241 CA CYS A 17 78.345 13.479 -2.586 1.00 0.00 C ATOM 242 C CYS A 17 77.968 14.858 -2.044 1.00 0.00 C ATOM 243 O CYS A 17 77.731 15.018 -0.860 1.00 0.00 O ATOM 244 CB CYS A 17 77.148 12.847 -3.311 1.00 0.00 C ATOM 245 SG CYS A 17 77.541 11.153 -3.833 1.00 0.00 S ATOM 0 H CYS A 17 77.864 12.114 -1.018 1.00 0.00 H new ATOM 0 HA CYS A 17 79.191 13.603 -3.262 1.00 0.00 H new ATOM 0 HB2 CYS A 17 76.280 12.838 -2.652 1.00 0.00 H new ATOM 0 HB3 CYS A 17 76.883 13.449 -4.180 1.00 0.00 H new ATOM 0 HG CYS A 17 76.515 10.637 -4.442 1.00 0.00 H new ATOM 251 N ASP A 18 77.907 15.854 -2.896 1.00 0.00 N ATOM 252 CA ASP A 18 77.586 17.239 -2.419 1.00 0.00 C ATOM 253 C ASP A 18 76.210 17.251 -1.738 1.00 0.00 C ATOM 254 O ASP A 18 75.462 16.295 -1.816 1.00 0.00 O ATOM 255 CB ASP A 18 77.588 18.123 -3.670 1.00 0.00 C ATOM 256 CG ASP A 18 78.989 18.146 -4.291 1.00 0.00 C ATOM 257 OD1 ASP A 18 79.952 18.002 -3.553 1.00 0.00 O ATOM 258 OD2 ASP A 18 79.076 18.308 -5.497 1.00 0.00 O ATOM 0 H ASP A 18 78.065 15.769 -3.900 1.00 0.00 H new ATOM 0 HA ASP A 18 78.308 17.598 -1.686 1.00 0.00 H new ATOM 0 HB2 ASP A 18 76.866 17.745 -4.394 1.00 0.00 H new ATOM 0 HB3 ASP A 18 77.279 19.136 -3.411 1.00 0.00 H new ATOM 263 N GLU A 19 75.878 18.327 -1.071 1.00 0.00 N ATOM 264 CA GLU A 19 74.720 18.309 -0.113 1.00 0.00 C ATOM 265 C GLU A 19 73.432 17.817 -0.787 1.00 0.00 C ATOM 266 O GLU A 19 72.614 17.167 -0.161 1.00 0.00 O ATOM 267 CB GLU A 19 74.553 19.761 0.346 1.00 0.00 C ATOM 268 CG GLU A 19 75.780 20.192 1.159 1.00 0.00 C ATOM 269 CD GLU A 19 75.897 19.348 2.436 1.00 0.00 C ATOM 270 OE1 GLU A 19 74.889 18.814 2.876 1.00 0.00 O ATOM 271 OE2 GLU A 19 76.997 19.249 2.954 1.00 0.00 O ATOM 0 H GLU A 19 76.359 19.224 -1.146 1.00 0.00 H new ATOM 0 HA GLU A 19 74.910 17.627 0.716 1.00 0.00 H new ATOM 0 HB2 GLU A 19 74.430 20.414 -0.518 1.00 0.00 H new ATOM 0 HB3 GLU A 19 73.651 19.860 0.951 1.00 0.00 H new ATOM 0 HG2 GLU A 19 76.682 20.079 0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 19 75.700 21.248 1.419 1.00 0.00 H new ATOM 278 N VAL A 20 73.245 18.122 -2.048 1.00 0.00 N ATOM 279 CA VAL A 20 71.971 17.733 -2.736 1.00 0.00 C ATOM 280 C VAL A 20 71.966 16.225 -3.036 1.00 0.00 C ATOM 281 O VAL A 20 70.918 15.616 -3.153 1.00 0.00 O ATOM 282 CB VAL A 20 71.945 18.553 -4.034 1.00 0.00 C ATOM 283 CG1 VAL A 20 70.676 18.229 -4.831 1.00 0.00 C ATOM 284 CG2 VAL A 20 71.959 20.046 -3.697 1.00 0.00 C ATOM 0 H VAL A 20 73.917 18.622 -2.631 1.00 0.00 H new ATOM 0 HA VAL A 20 71.093 17.931 -2.121 1.00 0.00 H new ATOM 0 HB VAL A 20 72.822 18.301 -4.631 1.00 0.00 H new ATOM 0 HG11 VAL A 20 70.664 18.814 -5.750 1.00 0.00 H new ATOM 0 HG12 VAL A 20 70.662 17.167 -5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 20 69.798 18.475 -4.233 1.00 0.00 H new ATOM 0 HG21 VAL A 20 71.941 20.627 -4.619 1.00 0.00 H new ATOM 0 HG22 VAL A 20 71.084 20.291 -3.096 1.00 0.00 H new ATOM 0 HG23 VAL A 20 72.863 20.284 -3.136 1.00 0.00 H new ATOM 294 N LEU A 21 73.126 15.626 -3.161 1.00 0.00 N ATOM 295 CA LEU A 21 73.200 14.162 -3.455 1.00 0.00 C ATOM 296 C LEU A 21 73.260 13.328 -2.163 1.00 0.00 C ATOM 297 O LEU A 21 73.047 12.129 -2.191 1.00 0.00 O ATOM 298 CB LEU A 21 74.489 14.010 -4.254 1.00 0.00 C ATOM 299 CG LEU A 21 74.346 14.712 -5.607 1.00 0.00 C ATOM 300 CD1 LEU A 21 75.679 14.658 -6.354 1.00 0.00 C ATOM 301 CD2 LEU A 21 73.271 14.007 -6.441 1.00 0.00 C ATOM 0 H LEU A 21 74.029 16.092 -3.071 1.00 0.00 H new ATOM 0 HA LEU A 21 72.321 13.807 -3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 21 75.324 14.437 -3.699 1.00 0.00 H new ATOM 0 HB3 LEU A 21 74.712 12.954 -4.404 1.00 0.00 H new ATOM 0 HG LEU A 21 74.059 15.751 -5.445 1.00 0.00 H new ATOM 0 HD11 LEU A 21 75.577 15.158 -7.317 1.00 0.00 H new ATOM 0 HD12 LEU A 21 76.447 15.159 -5.765 1.00 0.00 H new ATOM 0 HD13 LEU A 21 75.965 13.618 -6.513 1.00 0.00 H new ATOM 0 HD21 LEU A 21 73.171 14.508 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 21 73.558 12.968 -6.601 1.00 0.00 H new ATOM 0 HD23 LEU A 21 72.319 14.043 -5.912 1.00 0.00 H new ATOM 313 N GLY A 22 73.546 13.945 -1.039 1.00 0.00 N ATOM 314 CA GLY A 22 73.601 13.190 0.251 1.00 0.00 C ATOM 315 C GLY A 22 74.740 12.164 0.219 1.00 0.00 C ATOM 316 O GLY A 22 75.737 12.346 -0.456 1.00 0.00 O ATOM 0 H GLY A 22 73.744 14.943 -0.962 1.00 0.00 H new ATOM 0 HA2 GLY A 22 73.749 13.883 1.079 1.00 0.00 H new ATOM 0 HA3 GLY A 22 72.651 12.684 0.425 1.00 0.00 H new ATOM 320 N VAL A 23 74.595 11.085 0.950 1.00 0.00 N ATOM 321 CA VAL A 23 75.708 10.086 1.063 1.00 0.00 C ATOM 322 C VAL A 23 75.166 8.672 0.855 1.00 0.00 C ATOM 323 O VAL A 23 74.075 8.355 1.295 1.00 0.00 O ATOM 324 CB VAL A 23 76.255 10.228 2.490 1.00 0.00 C ATOM 325 CG1 VAL A 23 77.461 9.296 2.675 1.00 0.00 C ATOM 326 CG2 VAL A 23 76.686 11.677 2.746 1.00 0.00 C ATOM 0 H VAL A 23 73.752 10.851 1.475 1.00 0.00 H new ATOM 0 HA VAL A 23 76.480 10.260 0.314 1.00 0.00 H new ATOM 0 HB VAL A 23 75.472 9.957 3.198 1.00 0.00 H new ATOM 0 HG11 VAL A 23 77.848 9.398 3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 23 77.153 8.264 2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 23 78.240 9.563 1.961 1.00 0.00 H new ATOM 0 HG21 VAL A 23 77.073 11.768 3.761 1.00 0.00 H new ATOM 0 HG22 VAL A 23 77.464 11.956 2.035 1.00 0.00 H new ATOM 0 HG23 VAL A 23 75.828 12.339 2.624 1.00 0.00 H new ATOM 336 N PHE A 24 75.918 7.825 0.194 1.00 0.00 N ATOM 337 CA PHE A 24 75.527 6.386 0.117 1.00 0.00 C ATOM 338 C PHE A 24 76.739 5.490 0.400 1.00 0.00 C ATOM 339 O PHE A 24 77.872 5.903 0.267 1.00 0.00 O ATOM 340 CB PHE A 24 75.000 6.151 -1.306 1.00 0.00 C ATOM 341 CG PHE A 24 76.048 6.267 -2.393 1.00 0.00 C ATOM 342 CD1 PHE A 24 76.804 5.108 -2.769 1.00 0.00 C ATOM 343 CD2 PHE A 24 76.303 7.528 -3.032 1.00 0.00 C ATOM 344 CE1 PHE A 24 77.808 5.205 -3.788 1.00 0.00 C ATOM 345 CE2 PHE A 24 77.311 7.623 -4.049 1.00 0.00 C ATOM 346 CZ PHE A 24 78.061 6.462 -4.429 1.00 0.00 C ATOM 0 H PHE A 24 76.781 8.068 -0.293 1.00 0.00 H new ATOM 0 HA PHE A 24 74.766 6.143 0.858 1.00 0.00 H new ATOM 0 HB2 PHE A 24 74.553 5.158 -1.355 1.00 0.00 H new ATOM 0 HB3 PHE A 24 74.205 6.869 -1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 24 76.617 4.161 -2.284 1.00 0.00 H new ATOM 0 HD2 PHE A 24 75.737 8.403 -2.748 1.00 0.00 H new ATOM 0 HE1 PHE A 24 78.374 4.330 -4.073 1.00 0.00 H new ATOM 0 HE2 PHE A 24 77.505 8.571 -4.529 1.00 0.00 H new ATOM 0 HZ PHE A 24 78.816 6.534 -5.198 1.00 0.00 H new ATOM 356 N GLN A 25 76.493 4.267 0.790 1.00 0.00 N ATOM 357 CA GLN A 25 77.605 3.294 1.004 1.00 0.00 C ATOM 358 C GLN A 25 77.217 1.944 0.399 1.00 0.00 C ATOM 359 O GLN A 25 76.065 1.552 0.444 1.00 0.00 O ATOM 360 CB GLN A 25 77.755 3.191 2.523 1.00 0.00 C ATOM 361 CG GLN A 25 78.145 4.561 3.086 1.00 0.00 C ATOM 362 CD GLN A 25 78.277 4.488 4.611 1.00 0.00 C ATOM 363 OE1 GLN A 25 78.324 3.416 5.185 1.00 0.00 O ATOM 364 NE2 GLN A 25 78.336 5.597 5.297 1.00 0.00 N ATOM 0 H GLN A 25 75.560 3.897 0.971 1.00 0.00 H new ATOM 0 HA GLN A 25 78.538 3.603 0.533 1.00 0.00 H new ATOM 0 HB2 GLN A 25 76.820 2.854 2.970 1.00 0.00 H new ATOM 0 HB3 GLN A 25 78.515 2.451 2.776 1.00 0.00 H new ATOM 0 HG2 GLN A 25 79.088 4.888 2.647 1.00 0.00 H new ATOM 0 HG3 GLN A 25 77.393 5.302 2.814 1.00 0.00 H new ATOM 0 HE21 GLN A 25 78.297 6.496 4.817 1.00 0.00 H new ATOM 0 HE22 GLN A 25 78.421 5.564 6.313 1.00 0.00 H new ATOM 373 N GLY A 26 78.162 1.234 -0.166 1.00 0.00 N ATOM 374 CA GLY A 26 77.819 -0.018 -0.907 1.00 0.00 C ATOM 375 C GLY A 26 79.095 -0.709 -1.387 1.00 0.00 C ATOM 376 O GLY A 26 80.176 -0.152 -1.318 1.00 0.00 O ATOM 0 H GLY A 26 79.155 1.467 -0.146 1.00 0.00 H new ATOM 0 HA2 GLY A 26 77.253 -0.689 -0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 26 77.181 0.217 -1.759 1.00 0.00 H new ATOM 380 N LEU A 27 78.971 -1.922 -1.867 1.00 0.00 N ATOM 381 CA LEU A 27 80.146 -2.618 -2.469 1.00 0.00 C ATOM 382 C LEU A 27 80.220 -2.312 -3.965 1.00 0.00 C ATOM 383 O LEU A 27 79.226 -2.349 -4.667 1.00 0.00 O ATOM 384 CB LEU A 27 79.893 -4.108 -2.236 1.00 0.00 C ATOM 385 CG LEU A 27 79.963 -4.411 -0.738 1.00 0.00 C ATOM 386 CD1 LEU A 27 79.383 -5.802 -0.471 1.00 0.00 C ATOM 387 CD2 LEU A 27 81.425 -4.373 -0.278 1.00 0.00 C ATOM 0 H LEU A 27 78.104 -2.460 -1.867 1.00 0.00 H new ATOM 0 HA LEU A 27 81.090 -2.297 -2.028 1.00 0.00 H new ATOM 0 HB2 LEU A 27 78.915 -4.387 -2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 27 80.633 -4.701 -2.773 1.00 0.00 H new ATOM 0 HG LEU A 27 79.388 -3.665 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 27 79.433 -6.018 0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 27 78.344 -5.832 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 27 79.959 -6.548 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 27 81.476 -4.589 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 27 81.999 -5.120 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 27 81.841 -3.384 -0.469 1.00 0.00 H new ATOM 399 N ILE A 28 81.396 -2.015 -4.447 1.00 0.00 N ATOM 400 CA ILE A 28 81.555 -1.628 -5.884 1.00 0.00 C ATOM 401 C ILE A 28 81.247 -2.825 -6.790 1.00 0.00 C ATOM 402 O ILE A 28 81.657 -3.939 -6.526 1.00 0.00 O ATOM 403 CB ILE A 28 83.025 -1.196 -6.022 1.00 0.00 C ATOM 404 CG1 ILE A 28 83.290 0.006 -5.105 1.00 0.00 C ATOM 405 CG2 ILE A 28 83.337 -0.815 -7.477 1.00 0.00 C ATOM 406 CD1 ILE A 28 84.779 0.365 -5.137 1.00 0.00 C ATOM 0 H ILE A 28 82.261 -2.023 -3.906 1.00 0.00 H new ATOM 0 HA ILE A 28 80.873 -0.830 -6.178 1.00 0.00 H new ATOM 0 HB ILE A 28 83.668 -2.028 -5.734 1.00 0.00 H new ATOM 0 HG12 ILE A 28 82.694 0.860 -5.428 1.00 0.00 H new ATOM 0 HG13 ILE A 28 82.985 -0.229 -4.085 1.00 0.00 H new ATOM 0 HG21 ILE A 28 84.381 -0.512 -7.558 1.00 0.00 H new ATOM 0 HG22 ILE A 28 83.157 -1.673 -8.124 1.00 0.00 H new ATOM 0 HG23 ILE A 28 82.695 0.011 -7.783 1.00 0.00 H new ATOM 0 HD11 ILE A 28 84.962 1.219 -4.484 1.00 0.00 H new ATOM 0 HD12 ILE A 28 85.366 -0.487 -4.793 1.00 0.00 H new ATOM 0 HD13 ILE A 28 85.070 0.619 -6.156 1.00 0.00 H new ATOM 418 N LYS A 29 80.523 -2.592 -7.857 1.00 0.00 N ATOM 419 CA LYS A 29 80.295 -3.665 -8.869 1.00 0.00 C ATOM 420 C LYS A 29 81.080 -3.349 -10.145 1.00 0.00 C ATOM 421 O LYS A 29 81.513 -4.240 -10.852 1.00 0.00 O ATOM 422 CB LYS A 29 78.791 -3.644 -9.140 1.00 0.00 C ATOM 423 CG LYS A 29 78.427 -4.786 -10.092 1.00 0.00 C ATOM 424 CD LYS A 29 78.471 -6.114 -9.336 1.00 0.00 C ATOM 425 CE LYS A 29 78.024 -7.246 -10.265 1.00 0.00 C ATOM 426 NZ LYS A 29 79.281 -7.758 -10.877 1.00 0.00 N ATOM 0 H LYS A 29 80.078 -1.699 -8.070 1.00 0.00 H new ATOM 0 HA LYS A 29 80.627 -4.644 -8.522 1.00 0.00 H new ATOM 0 HB2 LYS A 29 78.241 -3.747 -8.205 1.00 0.00 H new ATOM 0 HB3 LYS A 29 78.503 -2.687 -9.576 1.00 0.00 H new ATOM 0 HG2 LYS A 29 77.432 -4.624 -10.507 1.00 0.00 H new ATOM 0 HG3 LYS A 29 79.122 -4.810 -10.931 1.00 0.00 H new ATOM 0 HD2 LYS A 29 79.481 -6.305 -8.973 1.00 0.00 H new ATOM 0 HD3 LYS A 29 77.821 -6.069 -8.462 1.00 0.00 H new ATOM 0 HE2 LYS A 29 77.506 -8.030 -9.712 1.00 0.00 H new ATOM 0 HE3 LYS A 29 77.333 -6.883 -11.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 79.058 -8.538 -11.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 79.749 -6.992 -11.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 79.916 -8.103 -10.129 1.00 0.00 H new ATOM 440 N GLN A 30 81.264 -2.084 -10.440 1.00 0.00 N ATOM 441 CA GLN A 30 82.032 -1.690 -11.662 1.00 0.00 C ATOM 442 C GLN A 30 82.672 -0.316 -11.445 1.00 0.00 C ATOM 443 O GLN A 30 82.144 0.514 -10.730 1.00 0.00 O ATOM 444 CB GLN A 30 81.012 -1.623 -12.806 1.00 0.00 C ATOM 445 CG GLN A 30 80.533 -3.032 -13.177 1.00 0.00 C ATOM 446 CD GLN A 30 79.627 -2.959 -14.409 1.00 0.00 C ATOM 447 OE1 GLN A 30 79.064 -1.922 -14.707 1.00 0.00 O ATOM 448 NE2 GLN A 30 79.459 -4.024 -15.143 1.00 0.00 N ATOM 0 H GLN A 30 80.913 -1.304 -9.884 1.00 0.00 H new ATOM 0 HA GLN A 30 82.828 -2.400 -11.885 1.00 0.00 H new ATOM 0 HB2 GLN A 30 80.162 -1.009 -12.508 1.00 0.00 H new ATOM 0 HB3 GLN A 30 81.462 -1.144 -13.676 1.00 0.00 H new ATOM 0 HG2 GLN A 30 81.389 -3.676 -13.380 1.00 0.00 H new ATOM 0 HG3 GLN A 30 79.992 -3.475 -12.341 1.00 0.00 H new ATOM 0 HE21 GLN A 30 79.930 -4.894 -14.895 1.00 0.00 H new ATOM 0 HE22 GLN A 30 78.857 -3.987 -15.965 1.00 0.00 H new ATOM 457 N ILE A 31 83.807 -0.075 -12.056 1.00 0.00 N ATOM 458 CA ILE A 31 84.486 1.249 -11.900 1.00 0.00 C ATOM 459 C ILE A 31 85.047 1.706 -13.249 1.00 0.00 C ATOM 460 O ILE A 31 85.639 0.936 -13.982 1.00 0.00 O ATOM 461 CB ILE A 31 85.613 1.032 -10.876 1.00 0.00 C ATOM 462 CG1 ILE A 31 85.009 0.567 -9.542 1.00 0.00 C ATOM 463 CG2 ILE A 31 86.380 2.345 -10.654 1.00 0.00 C ATOM 464 CD1 ILE A 31 86.121 0.268 -8.532 1.00 0.00 C ATOM 0 H ILE A 31 84.293 -0.740 -12.657 1.00 0.00 H new ATOM 0 HA ILE A 31 83.799 2.024 -11.560 1.00 0.00 H new ATOM 0 HB ILE A 31 86.298 0.274 -11.255 1.00 0.00 H new ATOM 0 HG12 ILE A 31 84.346 1.337 -9.147 1.00 0.00 H new ATOM 0 HG13 ILE A 31 84.403 -0.325 -9.700 1.00 0.00 H new ATOM 0 HG21 ILE A 31 87.176 2.183 -9.928 1.00 0.00 H new ATOM 0 HG22 ILE A 31 86.812 2.678 -11.598 1.00 0.00 H new ATOM 0 HG23 ILE A 31 85.696 3.107 -10.279 1.00 0.00 H new ATOM 0 HD11 ILE A 31 85.679 -0.060 -7.591 1.00 0.00 H new ATOM 0 HD12 ILE A 31 86.767 -0.518 -8.924 1.00 0.00 H new ATOM 0 HD13 ILE A 31 86.710 1.169 -8.361 1.00 0.00 H new ATOM 476 N SER A 32 84.856 2.959 -13.572 1.00 0.00 N ATOM 477 CA SER A 32 85.469 3.530 -14.807 1.00 0.00 C ATOM 478 C SER A 32 85.825 4.997 -14.567 1.00 0.00 C ATOM 479 O SER A 32 85.269 5.641 -13.698 1.00 0.00 O ATOM 480 CB SER A 32 84.399 3.403 -15.888 1.00 0.00 C ATOM 481 OG SER A 32 83.288 4.221 -15.547 1.00 0.00 O ATOM 0 H SER A 32 84.297 3.616 -13.028 1.00 0.00 H new ATOM 0 HA SER A 32 86.385 3.015 -15.095 1.00 0.00 H new ATOM 0 HB2 SER A 32 84.804 3.704 -16.854 1.00 0.00 H new ATOM 0 HB3 SER A 32 84.084 2.364 -15.984 1.00 0.00 H new ATOM 0 HG SER A 32 82.496 3.917 -16.037 1.00 0.00 H new ATOM 487 N ALA A 33 86.739 5.531 -15.336 1.00 0.00 N ATOM 488 CA ALA A 33 87.290 6.894 -15.033 1.00 0.00 C ATOM 489 C ALA A 33 86.172 7.941 -14.932 1.00 0.00 C ATOM 490 O ALA A 33 86.333 8.963 -14.288 1.00 0.00 O ATOM 491 CB ALA A 33 88.220 7.224 -16.204 1.00 0.00 C ATOM 0 H ALA A 33 87.131 5.083 -16.164 1.00 0.00 H new ATOM 0 HA ALA A 33 87.809 6.905 -14.075 1.00 0.00 H new ATOM 0 HB1 ALA A 33 88.661 8.209 -16.052 1.00 0.00 H new ATOM 0 HB2 ALA A 33 89.012 6.477 -16.262 1.00 0.00 H new ATOM 0 HB3 ALA A 33 87.650 7.221 -17.133 1.00 0.00 H new ATOM 497 N GLU A 34 85.044 7.699 -15.560 1.00 0.00 N ATOM 498 CA GLU A 34 83.973 8.744 -15.614 1.00 0.00 C ATOM 499 C GLU A 34 82.940 8.556 -14.486 1.00 0.00 C ATOM 500 O GLU A 34 82.258 9.492 -14.110 1.00 0.00 O ATOM 501 CB GLU A 34 83.330 8.600 -17.009 1.00 0.00 C ATOM 502 CG GLU A 34 82.542 7.283 -17.128 1.00 0.00 C ATOM 503 CD GLU A 34 82.013 7.113 -18.559 1.00 0.00 C ATOM 504 OE1 GLU A 34 81.844 8.113 -19.239 1.00 0.00 O ATOM 505 OE2 GLU A 34 81.785 5.980 -18.950 1.00 0.00 O ATOM 0 H GLU A 34 84.820 6.825 -16.036 1.00 0.00 H new ATOM 0 HA GLU A 34 84.380 9.744 -15.465 1.00 0.00 H new ATOM 0 HB2 GLU A 34 82.664 9.443 -17.194 1.00 0.00 H new ATOM 0 HB3 GLU A 34 84.105 8.633 -17.774 1.00 0.00 H new ATOM 0 HG2 GLU A 34 83.183 6.441 -16.867 1.00 0.00 H new ATOM 0 HG3 GLU A 34 81.711 7.282 -16.422 1.00 0.00 H new ATOM 512 N GLU A 35 82.822 7.364 -13.946 1.00 0.00 N ATOM 513 CA GLU A 35 81.741 7.094 -12.944 1.00 0.00 C ATOM 514 C GLU A 35 82.108 5.909 -12.040 1.00 0.00 C ATOM 515 O GLU A 35 82.890 5.052 -12.408 1.00 0.00 O ATOM 516 CB GLU A 35 80.489 6.785 -13.777 1.00 0.00 C ATOM 517 CG GLU A 35 80.738 5.563 -14.668 1.00 0.00 C ATOM 518 CD GLU A 35 79.556 5.376 -15.621 1.00 0.00 C ATOM 519 OE1 GLU A 35 78.506 4.966 -15.156 1.00 0.00 O ATOM 520 OE2 GLU A 35 79.722 5.646 -16.799 1.00 0.00 O ATOM 0 H GLU A 35 83.426 6.569 -14.156 1.00 0.00 H new ATOM 0 HA GLU A 35 81.586 7.943 -12.278 1.00 0.00 H new ATOM 0 HB2 GLU A 35 79.641 6.598 -13.118 1.00 0.00 H new ATOM 0 HB3 GLU A 35 80.230 7.647 -14.392 1.00 0.00 H new ATOM 0 HG2 GLU A 35 81.659 5.695 -15.236 1.00 0.00 H new ATOM 0 HG3 GLU A 35 80.868 4.672 -14.053 1.00 0.00 H new ATOM 527 N ILE A 36 81.546 5.864 -10.858 1.00 0.00 N ATOM 528 CA ILE A 36 81.698 4.658 -9.984 1.00 0.00 C ATOM 529 C ILE A 36 80.335 3.978 -9.809 1.00 0.00 C ATOM 530 O ILE A 36 79.327 4.644 -9.647 1.00 0.00 O ATOM 531 CB ILE A 36 82.205 5.193 -8.636 1.00 0.00 C ATOM 532 CG1 ILE A 36 83.515 5.984 -8.825 1.00 0.00 C ATOM 533 CG2 ILE A 36 82.449 4.021 -7.682 1.00 0.00 C ATOM 534 CD1 ILE A 36 84.596 5.097 -9.462 1.00 0.00 C ATOM 0 H ILE A 36 80.985 6.616 -10.458 1.00 0.00 H new ATOM 0 HA ILE A 36 82.382 3.922 -10.406 1.00 0.00 H new ATOM 0 HB ILE A 36 81.451 5.860 -8.218 1.00 0.00 H new ATOM 0 HG12 ILE A 36 83.333 6.854 -9.456 1.00 0.00 H new ATOM 0 HG13 ILE A 36 83.864 6.356 -7.862 1.00 0.00 H new ATOM 0 HG21 ILE A 36 82.809 4.399 -6.725 1.00 0.00 H new ATOM 0 HG22 ILE A 36 81.517 3.476 -7.530 1.00 0.00 H new ATOM 0 HG23 ILE A 36 83.195 3.352 -8.111 1.00 0.00 H new ATOM 0 HD11 ILE A 36 85.513 5.674 -9.587 1.00 0.00 H new ATOM 0 HD12 ILE A 36 84.791 4.241 -8.816 1.00 0.00 H new ATOM 0 HD13 ILE A 36 84.252 4.747 -10.435 1.00 0.00 H new ATOM 546 N THR A 37 80.293 2.665 -9.840 1.00 0.00 N ATOM 547 CA THR A 37 78.980 1.949 -9.758 1.00 0.00 C ATOM 548 C THR A 37 78.996 0.919 -8.621 1.00 0.00 C ATOM 549 O THR A 37 79.922 0.139 -8.498 1.00 0.00 O ATOM 550 CB THR A 37 78.832 1.247 -11.110 1.00 0.00 C ATOM 551 OG1 THR A 37 78.927 2.207 -12.153 1.00 0.00 O ATOM 552 CG2 THR A 37 77.473 0.549 -11.177 1.00 0.00 C ATOM 0 H THR A 37 81.111 2.060 -9.918 1.00 0.00 H new ATOM 0 HA THR A 37 78.154 2.630 -9.552 1.00 0.00 H new ATOM 0 HB THR A 37 79.624 0.507 -11.225 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.834 1.759 -13.020 1.00 0.00 H new ATOM 0 HG21 THR A 37 77.368 0.049 -12.140 1.00 0.00 H new ATOM 0 HG22 THR A 37 77.402 -0.187 -10.376 1.00 0.00 H new ATOM 0 HG23 THR A 37 76.679 1.287 -11.063 1.00 0.00 H new ATOM 560 N ILE A 38 77.975 0.913 -7.795 1.00 0.00 N ATOM 561 CA ILE A 38 77.916 -0.064 -6.656 1.00 0.00 C ATOM 562 C ILE A 38 76.537 -0.731 -6.598 1.00 0.00 C ATOM 563 O ILE A 38 75.611 -0.321 -7.274 1.00 0.00 O ATOM 564 CB ILE A 38 78.158 0.743 -5.371 1.00 0.00 C ATOM 565 CG1 ILE A 38 77.142 1.888 -5.277 1.00 0.00 C ATOM 566 CG2 ILE A 38 79.578 1.314 -5.364 1.00 0.00 C ATOM 567 CD1 ILE A 38 76.855 2.199 -3.810 1.00 0.00 C ATOM 0 H ILE A 38 77.177 1.545 -7.860 1.00 0.00 H new ATOM 0 HA ILE A 38 78.662 -0.850 -6.779 1.00 0.00 H new ATOM 0 HB ILE A 38 78.038 0.081 -4.513 1.00 0.00 H new ATOM 0 HG12 ILE A 38 77.531 2.775 -5.778 1.00 0.00 H new ATOM 0 HG13 ILE A 38 76.220 1.612 -5.788 1.00 0.00 H new ATOM 0 HG21 ILE A 38 79.737 1.884 -4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 38 80.299 0.498 -5.413 1.00 0.00 H new ATOM 0 HG23 ILE A 38 79.711 1.968 -6.226 1.00 0.00 H new ATOM 0 HD11 ILE A 38 76.133 3.013 -3.745 1.00 0.00 H new ATOM 0 HD12 ILE A 38 76.448 1.313 -3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.779 2.494 -3.313 1.00 0.00 H new ATOM 579 N VAL A 39 76.398 -1.753 -5.787 1.00 0.00 N ATOM 580 CA VAL A 39 75.099 -2.498 -5.714 1.00 0.00 C ATOM 581 C VAL A 39 74.639 -2.639 -4.256 1.00 0.00 C ATOM 582 O VAL A 39 75.410 -2.460 -3.333 1.00 0.00 O ATOM 583 CB VAL A 39 75.374 -3.871 -6.336 1.00 0.00 C ATOM 584 CG1 VAL A 39 75.794 -3.693 -7.796 1.00 0.00 C ATOM 585 CG2 VAL A 39 76.497 -4.580 -5.569 1.00 0.00 C ATOM 0 H VAL A 39 77.130 -2.105 -5.170 1.00 0.00 H new ATOM 0 HA VAL A 39 74.303 -1.974 -6.242 1.00 0.00 H new ATOM 0 HB VAL A 39 74.467 -4.474 -6.283 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.990 -4.669 -8.240 1.00 0.00 H new ATOM 0 HG12 VAL A 39 74.994 -3.198 -8.347 1.00 0.00 H new ATOM 0 HG13 VAL A 39 76.697 -3.085 -7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 39 76.685 -5.555 -6.018 1.00 0.00 H new ATOM 0 HG22 VAL A 39 77.405 -3.978 -5.614 1.00 0.00 H new ATOM 0 HG23 VAL A 39 76.200 -4.711 -4.528 1.00 0.00 H new ATOM 595 N ARG A 40 73.379 -2.958 -4.045 1.00 0.00 N ATOM 596 CA ARG A 40 72.815 -3.033 -2.651 1.00 0.00 C ATOM 597 C ARG A 40 73.059 -1.716 -1.906 1.00 0.00 C ATOM 598 O ARG A 40 73.489 -1.701 -0.768 1.00 0.00 O ATOM 599 CB ARG A 40 73.545 -4.193 -1.957 1.00 0.00 C ATOM 600 CG ARG A 40 73.333 -5.486 -2.748 1.00 0.00 C ATOM 601 CD ARG A 40 71.864 -5.907 -2.658 1.00 0.00 C ATOM 602 NE ARG A 40 71.792 -7.230 -3.358 1.00 0.00 N ATOM 603 CZ ARG A 40 70.807 -8.083 -3.134 1.00 0.00 C ATOM 604 NH1 ARG A 40 69.835 -7.819 -2.289 1.00 0.00 N ATOM 605 NH2 ARG A 40 70.799 -9.221 -3.773 1.00 0.00 N ATOM 0 H ARG A 40 72.711 -3.172 -4.785 1.00 0.00 H new ATOM 0 HA ARG A 40 71.738 -3.197 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 40 74.610 -3.972 -1.882 1.00 0.00 H new ATOM 0 HB3 ARG A 40 73.172 -4.313 -0.940 1.00 0.00 H new ATOM 0 HG2 ARG A 40 73.616 -5.337 -3.790 1.00 0.00 H new ATOM 0 HG3 ARG A 40 73.973 -6.275 -2.353 1.00 0.00 H new ATOM 0 HD2 ARG A 40 71.541 -5.992 -1.620 1.00 0.00 H new ATOM 0 HD3 ARG A 40 71.214 -5.173 -3.135 1.00 0.00 H new ATOM 0 HE ARG A 40 72.522 -7.479 -4.025 1.00 0.00 H new ATOM 0 HH11 ARG A 40 69.826 -6.934 -1.783 1.00 0.00 H new ATOM 0 HH12 ARG A 40 69.090 -8.500 -2.140 1.00 0.00 H new ATOM 0 HH21 ARG A 40 71.545 -9.441 -4.433 1.00 0.00 H new ATOM 0 HH22 ARG A 40 70.047 -9.891 -3.612 1.00 0.00 H new ATOM 619 N ALA A 41 72.781 -0.616 -2.554 1.00 0.00 N ATOM 620 CA ALA A 41 73.173 0.717 -1.997 1.00 0.00 C ATOM 621 C ALA A 41 72.347 1.086 -0.758 1.00 0.00 C ATOM 622 O ALA A 41 71.152 0.848 -0.686 1.00 0.00 O ATOM 623 CB ALA A 41 72.903 1.716 -3.122 1.00 0.00 C ATOM 0 H ALA A 41 72.296 -0.581 -3.451 1.00 0.00 H new ATOM 0 HA ALA A 41 74.215 0.713 -1.677 1.00 0.00 H new ATOM 0 HB1 ALA A 41 73.167 2.720 -2.788 1.00 0.00 H new ATOM 0 HB2 ALA A 41 73.503 1.454 -3.993 1.00 0.00 H new ATOM 0 HB3 ALA A 41 71.846 1.688 -3.388 1.00 0.00 H new ATOM 629 N PHE A 42 72.990 1.671 0.217 1.00 0.00 N ATOM 630 CA PHE A 42 72.253 2.298 1.351 1.00 0.00 C ATOM 631 C PHE A 42 72.510 3.809 1.339 1.00 0.00 C ATOM 632 O PHE A 42 73.611 4.245 1.063 1.00 0.00 O ATOM 633 CB PHE A 42 72.835 1.663 2.618 1.00 0.00 C ATOM 634 CG PHE A 42 72.121 0.406 3.075 1.00 0.00 C ATOM 635 CD1 PHE A 42 71.854 -0.671 2.158 1.00 0.00 C ATOM 636 CD2 PHE A 42 71.708 0.292 4.446 1.00 0.00 C ATOM 637 CE1 PHE A 42 71.178 -1.851 2.614 1.00 0.00 C ATOM 638 CE2 PHE A 42 71.033 -0.890 4.899 1.00 0.00 C ATOM 639 CZ PHE A 42 70.768 -1.961 3.983 1.00 0.00 C ATOM 0 H PHE A 42 74.006 1.742 0.276 1.00 0.00 H new ATOM 0 HA PHE A 42 71.176 2.142 1.291 1.00 0.00 H new ATOM 0 HB2 PHE A 42 73.884 1.426 2.442 1.00 0.00 H new ATOM 0 HB3 PHE A 42 72.805 2.396 3.424 1.00 0.00 H new ATOM 0 HD1 PHE A 42 72.163 -0.591 1.126 1.00 0.00 H new ATOM 0 HD2 PHE A 42 71.906 1.098 5.137 1.00 0.00 H new ATOM 0 HE1 PHE A 42 70.978 -2.658 1.925 1.00 0.00 H new ATOM 0 HE2 PHE A 42 70.724 -0.973 5.931 1.00 0.00 H new ATOM 0 HZ PHE A 42 70.260 -2.850 4.325 1.00 0.00 H new ATOM 649 N ARG A 43 71.512 4.602 1.634 1.00 0.00 N ATOM 650 CA ARG A 43 71.676 6.088 1.561 1.00 0.00 C ATOM 651 C ARG A 43 71.072 6.745 2.802 1.00 0.00 C ATOM 652 O ARG A 43 70.061 6.309 3.314 1.00 0.00 O ATOM 653 CB ARG A 43 70.912 6.507 0.305 1.00 0.00 C ATOM 654 CG ARG A 43 71.100 8.007 0.066 1.00 0.00 C ATOM 655 CD ARG A 43 70.294 8.433 -1.163 1.00 0.00 C ATOM 656 NE ARG A 43 70.627 9.878 -1.370 1.00 0.00 N ATOM 657 CZ ARG A 43 69.836 10.684 -2.059 1.00 0.00 C ATOM 658 NH1 ARG A 43 68.716 10.261 -2.606 1.00 0.00 N ATOM 659 NH2 ARG A 43 70.176 11.935 -2.202 1.00 0.00 N ATOM 0 H ARG A 43 70.587 4.285 1.923 1.00 0.00 H new ATOM 0 HA ARG A 43 72.723 6.389 1.520 1.00 0.00 H new ATOM 0 HB2 ARG A 43 71.271 5.944 -0.556 1.00 0.00 H new ATOM 0 HB3 ARG A 43 69.853 6.276 0.418 1.00 0.00 H new ATOM 0 HG2 ARG A 43 70.774 8.569 0.941 1.00 0.00 H new ATOM 0 HG3 ARG A 43 72.156 8.233 -0.082 1.00 0.00 H new ATOM 0 HD2 ARG A 43 70.563 7.838 -2.036 1.00 0.00 H new ATOM 0 HD3 ARG A 43 69.225 8.295 -1.000 1.00 0.00 H new ATOM 0 HE ARG A 43 71.487 10.251 -0.969 1.00 0.00 H new ATOM 0 HH11 ARG A 43 68.436 9.286 -2.505 1.00 0.00 H new ATOM 0 HH12 ARG A 43 68.129 10.909 -3.131 1.00 0.00 H new ATOM 0 HH21 ARG A 43 71.041 12.279 -1.785 1.00 0.00 H new ATOM 0 HH22 ARG A 43 69.577 12.569 -2.730 1.00 0.00 H new ATOM 673 N ASN A 44 71.690 7.796 3.295 1.00 0.00 N ATOM 674 CA ASN A 44 71.156 8.510 4.508 1.00 0.00 C ATOM 675 C ASN A 44 70.928 7.529 5.670 1.00 0.00 C ATOM 676 O ASN A 44 69.942 7.612 6.378 1.00 0.00 O ATOM 677 CB ASN A 44 69.830 9.143 4.069 1.00 0.00 C ATOM 678 CG ASN A 44 70.070 10.094 2.892 1.00 0.00 C ATOM 679 OD1 ASN A 44 69.331 10.084 1.928 1.00 0.00 O ATOM 680 ND2 ASN A 44 71.080 10.922 2.929 1.00 0.00 N ATOM 0 H ASN A 44 72.546 8.193 2.908 1.00 0.00 H new ATOM 0 HA ASN A 44 71.861 9.259 4.868 1.00 0.00 H new ATOM 0 HB2 ASN A 44 69.123 8.365 3.781 1.00 0.00 H new ATOM 0 HB3 ASN A 44 69.383 9.686 4.902 1.00 0.00 H new ATOM 0 HD21 ASN A 44 71.247 11.558 2.149 1.00 0.00 H new ATOM 0 HD22 ASN A 44 71.702 10.932 3.737 1.00 0.00 H new ATOM 687 N GLY A 45 71.835 6.603 5.860 1.00 0.00 N ATOM 688 CA GLY A 45 71.739 5.663 7.020 1.00 0.00 C ATOM 689 C GLY A 45 70.462 4.816 6.937 1.00 0.00 C ATOM 690 O GLY A 45 69.995 4.299 7.936 1.00 0.00 O ATOM 0 H GLY A 45 72.644 6.457 5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 45 72.612 5.011 7.037 1.00 0.00 H new ATOM 0 HA3 GLY A 45 71.745 6.228 7.952 1.00 0.00 H new ATOM 694 N VAL A 46 69.894 4.667 5.762 1.00 0.00 N ATOM 695 CA VAL A 46 68.737 3.734 5.593 1.00 0.00 C ATOM 696 C VAL A 46 68.798 3.081 4.194 1.00 0.00 C ATOM 697 O VAL A 46 69.314 3.676 3.272 1.00 0.00 O ATOM 698 CB VAL A 46 67.493 4.620 5.763 1.00 0.00 C ATOM 699 CG1 VAL A 46 66.215 3.838 5.428 1.00 0.00 C ATOM 700 CG2 VAL A 46 67.419 5.079 7.217 1.00 0.00 C ATOM 0 H VAL A 46 70.184 5.153 4.913 1.00 0.00 H new ATOM 0 HA VAL A 46 68.733 2.914 6.312 1.00 0.00 H new ATOM 0 HB VAL A 46 67.570 5.471 5.087 1.00 0.00 H new ATOM 0 HG11 VAL A 46 65.348 4.486 5.556 1.00 0.00 H new ATOM 0 HG12 VAL A 46 66.260 3.492 4.395 1.00 0.00 H new ATOM 0 HG13 VAL A 46 66.128 2.980 6.095 1.00 0.00 H new ATOM 0 HG21 VAL A 46 66.541 5.710 7.355 1.00 0.00 H new ATOM 0 HG22 VAL A 46 67.348 4.209 7.870 1.00 0.00 H new ATOM 0 HG23 VAL A 46 68.316 5.646 7.466 1.00 0.00 H new ATOM 710 N PRO A 47 68.268 1.877 4.069 1.00 0.00 N ATOM 711 CA PRO A 47 68.367 1.149 2.777 1.00 0.00 C ATOM 712 C PRO A 47 67.528 1.855 1.708 1.00 0.00 C ATOM 713 O PRO A 47 66.516 2.461 2.010 1.00 0.00 O ATOM 714 CB PRO A 47 67.802 -0.244 3.080 1.00 0.00 C ATOM 715 CG PRO A 47 67.664 -0.320 4.570 1.00 0.00 C ATOM 716 CD PRO A 47 67.540 1.089 5.077 1.00 0.00 C ATOM 0 HA PRO A 47 69.387 1.105 2.394 1.00 0.00 H new ATOM 0 HB2 PRO A 47 66.839 -0.389 2.591 1.00 0.00 H new ATOM 0 HB3 PRO A 47 68.468 -1.024 2.710 1.00 0.00 H new ATOM 0 HG2 PRO A 47 66.788 -0.907 4.846 1.00 0.00 H new ATOM 0 HG3 PRO A 47 68.530 -0.813 5.012 1.00 0.00 H new ATOM 0 HD2 PRO A 47 66.498 1.399 5.154 1.00 0.00 H new ATOM 0 HD3 PRO A 47 67.979 1.200 6.068 1.00 0.00 H new ATOM 724 N LEU A 48 67.940 1.783 0.462 1.00 0.00 N ATOM 725 CA LEU A 48 67.119 2.382 -0.637 1.00 0.00 C ATOM 726 C LEU A 48 65.911 1.490 -0.936 1.00 0.00 C ATOM 727 O LEU A 48 65.929 0.301 -0.680 1.00 0.00 O ATOM 728 CB LEU A 48 68.049 2.459 -1.852 1.00 0.00 C ATOM 729 CG LEU A 48 69.262 3.337 -1.525 1.00 0.00 C ATOM 730 CD1 LEU A 48 70.217 3.344 -2.719 1.00 0.00 C ATOM 731 CD2 LEU A 48 68.802 4.771 -1.244 1.00 0.00 C ATOM 0 H LEU A 48 68.806 1.337 0.161 1.00 0.00 H new ATOM 0 HA LEU A 48 66.732 3.365 -0.369 1.00 0.00 H new ATOM 0 HB2 LEU A 48 68.378 1.459 -2.133 1.00 0.00 H new ATOM 0 HB3 LEU A 48 67.512 2.870 -2.707 1.00 0.00 H new ATOM 0 HG LEU A 48 69.768 2.938 -0.646 1.00 0.00 H new ATOM 0 HD11 LEU A 48 71.081 3.968 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU A 48 70.548 2.326 -2.926 1.00 0.00 H new ATOM 0 HD13 LEU A 48 69.703 3.743 -3.594 1.00 0.00 H new ATOM 0 HD21 LEU A 48 69.667 5.392 -1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 48 68.295 5.169 -2.123 1.00 0.00 H new ATOM 0 HD23 LEU A 48 68.116 4.774 -0.397 1.00 0.00 H new ATOM 743 N ARG A 49 64.861 2.061 -1.477 1.00 0.00 N ATOM 744 CA ARG A 49 63.595 1.284 -1.695 1.00 0.00 C ATOM 745 C ARG A 49 63.863 0.033 -2.540 1.00 0.00 C ATOM 746 O ARG A 49 63.259 -1.004 -2.333 1.00 0.00 O ATOM 747 CB ARG A 49 62.656 2.238 -2.441 1.00 0.00 C ATOM 748 CG ARG A 49 62.314 3.426 -1.539 1.00 0.00 C ATOM 749 CD ARG A 49 61.337 4.355 -2.266 1.00 0.00 C ATOM 750 NE ARG A 49 60.049 3.593 -2.335 1.00 0.00 N ATOM 751 CZ ARG A 49 59.115 3.883 -3.225 1.00 0.00 C ATOM 752 NH1 ARG A 49 59.262 4.856 -4.098 1.00 0.00 N ATOM 753 NH2 ARG A 49 58.012 3.185 -3.236 1.00 0.00 N ATOM 0 H ARG A 49 64.824 3.035 -1.778 1.00 0.00 H new ATOM 0 HA ARG A 49 63.167 0.942 -0.753 1.00 0.00 H new ATOM 0 HB2 ARG A 49 63.130 2.588 -3.358 1.00 0.00 H new ATOM 0 HB3 ARG A 49 61.745 1.715 -2.732 1.00 0.00 H new ATOM 0 HG2 ARG A 49 61.872 3.073 -0.607 1.00 0.00 H new ATOM 0 HG3 ARG A 49 63.221 3.969 -1.276 1.00 0.00 H new ATOM 0 HD2 ARG A 49 61.211 5.294 -1.727 1.00 0.00 H new ATOM 0 HD3 ARG A 49 61.700 4.606 -3.263 1.00 0.00 H new ATOM 0 HE ARG A 49 59.888 2.830 -1.678 1.00 0.00 H new ATOM 0 HH11 ARG A 49 60.116 5.413 -4.102 1.00 0.00 H new ATOM 0 HH12 ARG A 49 58.522 5.053 -4.771 1.00 0.00 H new ATOM 0 HH21 ARG A 49 57.880 2.429 -2.564 1.00 0.00 H new ATOM 0 HH22 ARG A 49 57.282 3.396 -3.916 1.00 0.00 H new ATOM 767 N LYS A 50 64.764 0.127 -3.488 1.00 0.00 N ATOM 768 CA LYS A 50 65.122 -1.068 -4.312 1.00 0.00 C ATOM 769 C LYS A 50 66.483 -1.617 -3.877 1.00 0.00 C ATOM 770 O LYS A 50 67.516 -1.046 -4.178 1.00 0.00 O ATOM 771 CB LYS A 50 65.186 -0.553 -5.750 1.00 0.00 C ATOM 772 CG LYS A 50 63.800 -0.070 -6.182 1.00 0.00 C ATOM 773 CD LYS A 50 63.838 0.333 -7.658 1.00 0.00 C ATOM 774 CE LYS A 50 62.490 0.940 -8.057 1.00 0.00 C ATOM 775 NZ LYS A 50 62.737 1.591 -9.374 1.00 0.00 N ATOM 0 H LYS A 50 65.267 0.982 -3.726 1.00 0.00 H new ATOM 0 HA LYS A 50 64.401 -1.878 -4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 50 65.906 0.262 -5.824 1.00 0.00 H new ATOM 0 HB3 LYS A 50 65.531 -1.344 -6.416 1.00 0.00 H new ATOM 0 HG2 LYS A 50 63.064 -0.859 -6.028 1.00 0.00 H new ATOM 0 HG3 LYS A 50 63.491 0.778 -5.570 1.00 0.00 H new ATOM 0 HD2 LYS A 50 64.638 1.053 -7.829 1.00 0.00 H new ATOM 0 HD3 LYS A 50 64.055 -0.537 -8.278 1.00 0.00 H new ATOM 0 HE2 LYS A 50 61.719 0.173 -8.134 1.00 0.00 H new ATOM 0 HE3 LYS A 50 62.148 1.663 -7.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 61.858 2.031 -9.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 63.471 2.320 -9.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 63.055 0.877 -10.060 1.00 0.00 H new ATOM 789 N GLN A 51 66.488 -2.721 -3.170 1.00 0.00 N ATOM 790 CA GLN A 51 67.783 -3.329 -2.723 1.00 0.00 C ATOM 791 C GLN A 51 68.618 -3.740 -3.939 1.00 0.00 C ATOM 792 O GLN A 51 69.830 -3.624 -3.936 1.00 0.00 O ATOM 793 CB GLN A 51 67.395 -4.561 -1.901 1.00 0.00 C ATOM 794 CG GLN A 51 66.639 -4.120 -0.645 1.00 0.00 C ATOM 795 CD GLN A 51 66.202 -5.351 0.154 1.00 0.00 C ATOM 796 OE1 GLN A 51 66.107 -6.438 -0.380 1.00 0.00 O ATOM 797 NE2 GLN A 51 65.931 -5.224 1.424 1.00 0.00 N ATOM 0 H GLN A 51 65.651 -3.228 -2.882 1.00 0.00 H new ATOM 0 HA GLN A 51 68.383 -2.629 -2.141 1.00 0.00 H new ATOM 0 HB2 GLN A 51 66.773 -5.228 -2.498 1.00 0.00 H new ATOM 0 HB3 GLN A 51 68.287 -5.122 -1.623 1.00 0.00 H new ATOM 0 HG2 GLN A 51 67.275 -3.483 -0.031 1.00 0.00 H new ATOM 0 HG3 GLN A 51 65.768 -3.527 -0.923 1.00 0.00 H new ATOM 0 HE21 GLN A 51 66.010 -4.312 1.874 1.00 0.00 H new ATOM 0 HE22 GLN A 51 65.640 -6.037 1.967 1.00 0.00 H new ATOM 806 N ASN A 52 67.974 -4.217 -4.974 1.00 0.00 N ATOM 807 CA ASN A 52 68.716 -4.674 -6.189 1.00 0.00 C ATOM 808 C ASN A 52 69.006 -3.505 -7.147 1.00 0.00 C ATOM 809 O ASN A 52 69.571 -3.706 -8.208 1.00 0.00 O ATOM 810 CB ASN A 52 67.788 -5.690 -6.856 1.00 0.00 C ATOM 811 CG ASN A 52 67.556 -6.875 -5.915 1.00 0.00 C ATOM 812 OD1 ASN A 52 68.339 -7.120 -5.019 1.00 0.00 O ATOM 813 ND2 ASN A 52 66.504 -7.629 -6.084 1.00 0.00 N ATOM 0 H ASN A 52 66.960 -4.310 -5.030 1.00 0.00 H new ATOM 0 HA ASN A 52 69.685 -5.099 -5.928 1.00 0.00 H new ATOM 0 HB2 ASN A 52 66.837 -5.219 -7.105 1.00 0.00 H new ATOM 0 HB3 ASN A 52 68.226 -6.037 -7.792 1.00 0.00 H new ATOM 0 HD21 ASN A 52 66.340 -8.422 -5.464 1.00 0.00 H new ATOM 0 HD22 ASN A 52 65.846 -7.425 -6.836 1.00 0.00 H new ATOM 820 N ALA A 53 68.629 -2.291 -6.794 1.00 0.00 N ATOM 821 CA ALA A 53 68.839 -1.138 -7.728 1.00 0.00 C ATOM 822 C ALA A 53 70.317 -0.746 -7.752 1.00 0.00 C ATOM 823 O ALA A 53 70.962 -0.667 -6.722 1.00 0.00 O ATOM 824 CB ALA A 53 67.991 0.004 -7.163 1.00 0.00 C ATOM 0 H ALA A 53 68.188 -2.054 -5.905 1.00 0.00 H new ATOM 0 HA ALA A 53 68.554 -1.382 -8.751 1.00 0.00 H new ATOM 0 HB1 ALA A 53 68.096 0.884 -7.798 1.00 0.00 H new ATOM 0 HB2 ALA A 53 66.945 -0.300 -7.134 1.00 0.00 H new ATOM 0 HB3 ALA A 53 68.328 0.242 -6.154 1.00 0.00 H new ATOM 830 N GLU A 54 70.854 -0.501 -8.922 1.00 0.00 N ATOM 831 CA GLU A 54 72.294 -0.113 -9.028 1.00 0.00 C ATOM 832 C GLU A 54 72.451 1.410 -8.897 1.00 0.00 C ATOM 833 O GLU A 54 71.680 2.170 -9.454 1.00 0.00 O ATOM 834 CB GLU A 54 72.756 -0.615 -10.411 1.00 0.00 C ATOM 835 CG GLU A 54 72.063 0.158 -11.550 1.00 0.00 C ATOM 836 CD GLU A 54 72.508 -0.397 -12.910 1.00 0.00 C ATOM 837 OE1 GLU A 54 73.591 -0.957 -12.983 1.00 0.00 O ATOM 838 OE2 GLU A 54 71.753 -0.252 -13.858 1.00 0.00 O ATOM 0 H GLU A 54 70.355 -0.553 -9.810 1.00 0.00 H new ATOM 0 HA GLU A 54 72.897 -0.549 -8.232 1.00 0.00 H new ATOM 0 HB2 GLU A 54 73.837 -0.503 -10.498 1.00 0.00 H new ATOM 0 HB3 GLU A 54 72.537 -1.679 -10.505 1.00 0.00 H new ATOM 0 HG2 GLU A 54 70.981 0.075 -11.451 1.00 0.00 H new ATOM 0 HG3 GLU A 54 72.309 1.218 -11.483 1.00 0.00 H new ATOM 845 N VAL A 55 73.443 1.849 -8.165 1.00 0.00 N ATOM 846 CA VAL A 55 73.711 3.316 -8.051 1.00 0.00 C ATOM 847 C VAL A 55 74.926 3.678 -8.904 1.00 0.00 C ATOM 848 O VAL A 55 76.005 3.149 -8.704 1.00 0.00 O ATOM 849 CB VAL A 55 74.003 3.554 -6.562 1.00 0.00 C ATOM 850 CG1 VAL A 55 74.324 5.034 -6.315 1.00 0.00 C ATOM 851 CG2 VAL A 55 72.776 3.164 -5.738 1.00 0.00 C ATOM 0 H VAL A 55 74.082 1.253 -7.639 1.00 0.00 H new ATOM 0 HA VAL A 55 72.877 3.926 -8.398 1.00 0.00 H new ATOM 0 HB VAL A 55 74.860 2.948 -6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 55 74.529 5.190 -5.256 1.00 0.00 H new ATOM 0 HG12 VAL A 55 75.198 5.319 -6.900 1.00 0.00 H new ATOM 0 HG13 VAL A 55 73.473 5.646 -6.614 1.00 0.00 H new ATOM 0 HG21 VAL A 55 72.980 3.332 -4.680 1.00 0.00 H new ATOM 0 HG22 VAL A 55 71.924 3.771 -6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 55 72.548 2.111 -5.901 1.00 0.00 H new ATOM 861 N VAL A 56 74.758 4.571 -9.847 1.00 0.00 N ATOM 862 CA VAL A 56 75.918 5.009 -10.683 1.00 0.00 C ATOM 863 C VAL A 56 76.071 6.524 -10.584 1.00 0.00 C ATOM 864 O VAL A 56 75.224 7.274 -11.033 1.00 0.00 O ATOM 865 CB VAL A 56 75.600 4.590 -12.120 1.00 0.00 C ATOM 866 CG1 VAL A 56 76.814 4.897 -12.995 1.00 0.00 C ATOM 867 CG2 VAL A 56 75.307 3.086 -12.183 1.00 0.00 C ATOM 0 H VAL A 56 73.868 5.015 -10.074 1.00 0.00 H new ATOM 0 HA VAL A 56 76.853 4.558 -10.350 1.00 0.00 H new ATOM 0 HB VAL A 56 74.724 5.136 -12.471 1.00 0.00 H new ATOM 0 HG11 VAL A 56 76.604 4.604 -14.024 1.00 0.00 H new ATOM 0 HG12 VAL A 56 77.028 5.965 -12.958 1.00 0.00 H new ATOM 0 HG13 VAL A 56 77.677 4.341 -12.628 1.00 0.00 H new ATOM 0 HG21 VAL A 56 75.082 2.802 -13.211 1.00 0.00 H new ATOM 0 HG22 VAL A 56 76.178 2.531 -11.835 1.00 0.00 H new ATOM 0 HG23 VAL A 56 74.452 2.855 -11.548 1.00 0.00 H new ATOM 877 N LEU A 57 77.148 6.970 -10.002 1.00 0.00 N ATOM 878 CA LEU A 57 77.318 8.428 -9.737 1.00 0.00 C ATOM 879 C LEU A 57 78.668 8.912 -10.273 1.00 0.00 C ATOM 880 O LEU A 57 79.689 8.289 -10.054 1.00 0.00 O ATOM 881 CB LEU A 57 77.218 8.532 -8.217 1.00 0.00 C ATOM 882 CG LEU A 57 75.735 8.528 -7.827 1.00 0.00 C ATOM 883 CD1 LEU A 57 75.557 7.895 -6.451 1.00 0.00 C ATOM 884 CD2 LEU A 57 75.223 9.970 -7.774 1.00 0.00 C ATOM 0 H LEU A 57 77.924 6.384 -9.696 1.00 0.00 H new ATOM 0 HA LEU A 57 76.576 9.055 -10.231 1.00 0.00 H new ATOM 0 HB2 LEU A 57 77.736 7.697 -7.745 1.00 0.00 H new ATOM 0 HB3 LEU A 57 77.700 9.445 -7.867 1.00 0.00 H new ATOM 0 HG LEU A 57 75.176 7.955 -8.566 1.00 0.00 H new ATOM 0 HD11 LEU A 57 74.500 7.897 -6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 57 75.924 6.869 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 57 76.119 8.466 -5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 57 74.169 9.972 -7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 57 75.793 10.532 -7.034 1.00 0.00 H new ATOM 0 HD23 LEU A 57 75.342 10.434 -8.753 1.00 0.00 H new ATOM 896 N LYS A 58 78.671 10.018 -10.977 1.00 0.00 N ATOM 897 CA LYS A 58 79.934 10.508 -11.614 1.00 0.00 C ATOM 898 C LYS A 58 80.869 11.110 -10.563 1.00 0.00 C ATOM 899 O LYS A 58 80.433 11.737 -9.616 1.00 0.00 O ATOM 900 CB LYS A 58 79.491 11.583 -12.608 1.00 0.00 C ATOM 901 CG LYS A 58 78.633 10.945 -13.703 1.00 0.00 C ATOM 902 CD LYS A 58 78.288 11.996 -14.760 1.00 0.00 C ATOM 903 CE LYS A 58 77.336 11.387 -15.793 1.00 0.00 C ATOM 904 NZ LYS A 58 76.956 12.521 -16.680 1.00 0.00 N ATOM 0 H LYS A 58 77.852 10.604 -11.138 1.00 0.00 H new ATOM 0 HA LYS A 58 80.482 9.701 -12.100 1.00 0.00 H new ATOM 0 HB2 LYS A 58 78.924 12.358 -12.093 1.00 0.00 H new ATOM 0 HB3 LYS A 58 80.363 12.066 -13.050 1.00 0.00 H new ATOM 0 HG2 LYS A 58 79.169 10.115 -14.162 1.00 0.00 H new ATOM 0 HG3 LYS A 58 77.720 10.535 -13.271 1.00 0.00 H new ATOM 0 HD2 LYS A 58 77.824 12.863 -14.289 1.00 0.00 H new ATOM 0 HD3 LYS A 58 79.196 12.347 -15.249 1.00 0.00 H new ATOM 0 HE2 LYS A 58 77.822 10.590 -16.357 1.00 0.00 H new ATOM 0 HE3 LYS A 58 76.460 10.950 -15.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 76.303 12.183 -17.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 76.490 13.261 -16.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 77.809 12.913 -17.128 1.00 0.00 H new ATOM 918 N CYS A 59 82.158 10.919 -10.726 1.00 0.00 N ATOM 919 CA CYS A 59 83.151 11.529 -9.779 1.00 0.00 C ATOM 920 C CYS A 59 82.947 13.049 -9.674 1.00 0.00 C ATOM 921 O CYS A 59 83.183 13.645 -8.639 1.00 0.00 O ATOM 922 CB CYS A 59 84.536 11.208 -10.369 1.00 0.00 C ATOM 923 SG CYS A 59 84.690 11.885 -12.047 1.00 0.00 S ATOM 0 H CYS A 59 82.568 10.364 -11.478 1.00 0.00 H new ATOM 0 HA CYS A 59 83.038 11.130 -8.771 1.00 0.00 H new ATOM 0 HB2 CYS A 59 85.315 11.625 -9.730 1.00 0.00 H new ATOM 0 HB3 CYS A 59 84.686 10.129 -10.392 1.00 0.00 H new ATOM 0 HG CYS A 59 85.867 11.603 -12.522 1.00 0.00 H new ATOM 929 N THR A 60 82.510 13.669 -10.743 1.00 0.00 N ATOM 930 CA THR A 60 82.280 15.150 -10.720 1.00 0.00 C ATOM 931 C THR A 60 81.156 15.493 -9.738 1.00 0.00 C ATOM 932 O THR A 60 81.116 16.577 -9.185 1.00 0.00 O ATOM 933 CB THR A 60 81.874 15.527 -12.150 1.00 0.00 C ATOM 934 OG1 THR A 60 80.683 14.835 -12.500 1.00 0.00 O ATOM 935 CG2 THR A 60 82.993 15.148 -13.122 1.00 0.00 C ATOM 0 H THR A 60 82.302 13.214 -11.632 1.00 0.00 H new ATOM 0 HA THR A 60 83.168 15.694 -10.398 1.00 0.00 H new ATOM 0 HB THR A 60 81.701 16.602 -12.206 1.00 0.00 H new ATOM 0 HG1 THR A 60 80.421 15.076 -13.413 1.00 0.00 H new ATOM 0 HG21 THR A 60 82.700 15.418 -14.137 1.00 0.00 H new ATOM 0 HG22 THR A 60 83.905 15.682 -12.853 1.00 0.00 H new ATOM 0 HG23 THR A 60 83.172 14.074 -13.069 1.00 0.00 H new ATOM 943 N ASP A 61 80.245 14.575 -9.520 1.00 0.00 N ATOM 944 CA ASP A 61 79.148 14.815 -8.534 1.00 0.00 C ATOM 945 C ASP A 61 79.585 14.358 -7.137 1.00 0.00 C ATOM 946 O ASP A 61 79.099 14.851 -6.137 1.00 0.00 O ATOM 947 CB ASP A 61 77.968 13.978 -9.033 1.00 0.00 C ATOM 948 CG ASP A 61 77.518 14.479 -10.410 1.00 0.00 C ATOM 949 OD1 ASP A 61 77.675 15.661 -10.674 1.00 0.00 O ATOM 950 OD2 ASP A 61 77.023 13.670 -11.178 1.00 0.00 O ATOM 0 H ASP A 61 80.215 13.668 -9.985 1.00 0.00 H new ATOM 0 HA ASP A 61 78.888 15.871 -8.455 1.00 0.00 H new ATOM 0 HB2 ASP A 61 78.256 12.928 -9.094 1.00 0.00 H new ATOM 0 HB3 ASP A 61 77.141 14.041 -8.325 1.00 0.00 H new ATOM 955 N ILE A 62 80.500 13.421 -7.068 1.00 0.00 N ATOM 956 CA ILE A 62 81.027 12.970 -5.743 1.00 0.00 C ATOM 957 C ILE A 62 82.105 13.944 -5.254 1.00 0.00 C ATOM 958 O ILE A 62 82.879 14.466 -6.036 1.00 0.00 O ATOM 959 CB ILE A 62 81.627 11.580 -5.998 1.00 0.00 C ATOM 960 CG1 ILE A 62 80.542 10.639 -6.532 1.00 0.00 C ATOM 961 CG2 ILE A 62 82.186 11.011 -4.690 1.00 0.00 C ATOM 962 CD1 ILE A 62 81.173 9.305 -6.939 1.00 0.00 C ATOM 0 H ILE A 62 80.905 12.948 -7.876 1.00 0.00 H new ATOM 0 HA ILE A 62 80.252 12.937 -4.977 1.00 0.00 H new ATOM 0 HB ILE A 62 82.429 11.668 -6.731 1.00 0.00 H new ATOM 0 HG12 ILE A 62 79.781 10.475 -5.769 1.00 0.00 H new ATOM 0 HG13 ILE A 62 80.042 11.093 -7.388 1.00 0.00 H new ATOM 0 HG21 ILE A 62 82.611 10.024 -4.875 1.00 0.00 H new ATOM 0 HG22 ILE A 62 82.961 11.674 -4.307 1.00 0.00 H new ATOM 0 HG23 ILE A 62 81.384 10.929 -3.957 1.00 0.00 H new ATOM 0 HD11 ILE A 62 80.399 8.637 -7.318 1.00 0.00 H new ATOM 0 HD12 ILE A 62 81.917 9.477 -7.716 1.00 0.00 H new ATOM 0 HD13 ILE A 62 81.652 8.850 -6.072 1.00 0.00 H new ATOM 974 N ARG A 63 82.156 14.189 -3.967 1.00 0.00 N ATOM 975 CA ARG A 63 83.157 15.151 -3.417 1.00 0.00 C ATOM 976 C ARG A 63 84.341 14.392 -2.809 1.00 0.00 C ATOM 977 O ARG A 63 85.466 14.858 -2.849 1.00 0.00 O ATOM 978 CB ARG A 63 82.407 15.935 -2.341 1.00 0.00 C ATOM 979 CG ARG A 63 83.310 17.041 -1.792 1.00 0.00 C ATOM 980 CD ARG A 63 83.464 18.145 -2.842 1.00 0.00 C ATOM 981 NE ARG A 63 84.414 19.131 -2.235 1.00 0.00 N ATOM 982 CZ ARG A 63 85.100 19.985 -2.979 1.00 0.00 C ATOM 983 NH1 ARG A 63 84.984 20.017 -4.289 1.00 0.00 N ATOM 984 NH2 ARG A 63 85.913 20.820 -2.394 1.00 0.00 N ATOM 0 H ARG A 63 81.544 13.761 -3.272 1.00 0.00 H new ATOM 0 HA ARG A 63 83.564 15.808 -4.185 1.00 0.00 H new ATOM 0 HB2 ARG A 63 81.498 16.367 -2.758 1.00 0.00 H new ATOM 0 HB3 ARG A 63 82.102 15.267 -1.536 1.00 0.00 H new ATOM 0 HG2 ARG A 63 82.884 17.452 -0.877 1.00 0.00 H new ATOM 0 HG3 ARG A 63 84.287 16.632 -1.533 1.00 0.00 H new ATOM 0 HD2 ARG A 63 83.854 17.747 -3.779 1.00 0.00 H new ATOM 0 HD3 ARG A 63 82.505 18.610 -3.069 1.00 0.00 H new ATOM 0 HE ARG A 63 84.536 19.145 -1.222 1.00 0.00 H new ATOM 0 HH11 ARG A 63 84.351 19.371 -4.761 1.00 0.00 H new ATOM 0 HH12 ARG A 63 85.527 20.688 -4.833 1.00 0.00 H new ATOM 0 HH21 ARG A 63 86.013 20.808 -1.379 1.00 0.00 H new ATOM 0 HH22 ARG A 63 86.449 21.485 -2.951 1.00 0.00 H new ATOM 998 N SER A 64 84.096 13.231 -2.245 1.00 0.00 N ATOM 999 CA SER A 64 85.217 12.431 -1.655 1.00 0.00 C ATOM 1000 C SER A 64 84.808 10.964 -1.492 1.00 0.00 C ATOM 1001 O SER A 64 83.638 10.644 -1.405 1.00 0.00 O ATOM 1002 CB SER A 64 85.488 13.070 -0.295 1.00 0.00 C ATOM 1003 OG SER A 64 84.407 12.781 0.583 1.00 0.00 O ATOM 0 H SER A 64 83.172 12.805 -2.168 1.00 0.00 H new ATOM 0 HA SER A 64 86.101 12.437 -2.292 1.00 0.00 H new ATOM 0 HB2 SER A 64 86.421 12.688 0.120 1.00 0.00 H new ATOM 0 HB3 SER A 64 85.605 14.148 -0.404 1.00 0.00 H new ATOM 0 HG SER A 64 84.578 13.188 1.458 1.00 0.00 H new ATOM 1009 N ILE A 65 85.771 10.073 -1.443 1.00 0.00 N ATOM 1010 CA ILE A 65 85.455 8.616 -1.308 1.00 0.00 C ATOM 1011 C ILE A 65 86.446 7.955 -0.344 1.00 0.00 C ATOM 1012 O ILE A 65 87.596 8.346 -0.259 1.00 0.00 O ATOM 1013 CB ILE A 65 85.592 8.012 -2.713 1.00 0.00 C ATOM 1014 CG1 ILE A 65 84.660 8.741 -3.694 1.00 0.00 C ATOM 1015 CG2 ILE A 65 85.219 6.525 -2.661 1.00 0.00 C ATOM 1016 CD1 ILE A 65 84.877 8.204 -5.112 1.00 0.00 C ATOM 0 H ILE A 65 86.766 10.294 -1.491 1.00 0.00 H new ATOM 0 HA ILE A 65 84.453 8.459 -0.910 1.00 0.00 H new ATOM 0 HB ILE A 65 86.621 8.124 -3.054 1.00 0.00 H new ATOM 0 HG12 ILE A 65 83.621 8.599 -3.397 1.00 0.00 H new ATOM 0 HG13 ILE A 65 84.856 9.813 -3.667 1.00 0.00 H new ATOM 0 HG21 ILE A 65 85.314 6.091 -3.656 1.00 0.00 H new ATOM 0 HG22 ILE A 65 85.887 6.006 -1.973 1.00 0.00 H new ATOM 0 HG23 ILE A 65 84.190 6.420 -2.316 1.00 0.00 H new ATOM 0 HD11 ILE A 65 84.214 8.724 -5.803 1.00 0.00 H new ATOM 0 HD12 ILE A 65 85.913 8.369 -5.409 1.00 0.00 H new ATOM 0 HD13 ILE A 65 84.659 7.136 -5.134 1.00 0.00 H new ATOM 1028 N ASP A 66 86.002 6.958 0.379 1.00 0.00 N ATOM 1029 CA ASP A 66 86.911 6.234 1.321 1.00 0.00 C ATOM 1030 C ASP A 66 86.668 4.723 1.246 1.00 0.00 C ATOM 1031 O ASP A 66 85.542 4.272 1.317 1.00 0.00 O ATOM 1032 CB ASP A 66 86.550 6.772 2.712 1.00 0.00 C ATOM 1033 CG ASP A 66 85.072 6.503 3.022 1.00 0.00 C ATOM 1034 OD1 ASP A 66 84.234 7.000 2.288 1.00 0.00 O ATOM 1035 OD2 ASP A 66 84.808 5.806 3.987 1.00 0.00 O ATOM 0 H ASP A 66 85.043 6.612 0.357 1.00 0.00 H new ATOM 0 HA ASP A 66 87.962 6.393 1.082 1.00 0.00 H new ATOM 0 HB2 ASP A 66 87.178 6.299 3.466 1.00 0.00 H new ATOM 0 HB3 ASP A 66 86.749 7.843 2.758 1.00 0.00 H new ATOM 1040 N LEU A 67 87.714 3.943 1.102 1.00 0.00 N ATOM 1041 CA LEU A 67 87.554 2.453 1.153 1.00 0.00 C ATOM 1042 C LEU A 67 87.388 1.998 2.605 1.00 0.00 C ATOM 1043 O LEU A 67 88.300 2.111 3.404 1.00 0.00 O ATOM 1044 CB LEU A 67 88.855 1.893 0.566 1.00 0.00 C ATOM 1045 CG LEU A 67 88.769 1.864 -0.970 1.00 0.00 C ATOM 1046 CD1 LEU A 67 90.097 2.334 -1.570 1.00 0.00 C ATOM 1047 CD2 LEU A 67 88.487 0.433 -1.445 1.00 0.00 C ATOM 0 H LEU A 67 88.668 4.272 0.952 1.00 0.00 H new ATOM 0 HA LEU A 67 86.678 2.110 0.603 1.00 0.00 H new ATOM 0 HB2 LEU A 67 89.699 2.507 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 67 89.033 0.888 0.948 1.00 0.00 H new ATOM 0 HG LEU A 67 87.964 2.525 -1.293 1.00 0.00 H new ATOM 0 HD11 LEU A 67 90.033 2.312 -2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 67 90.306 3.351 -1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 67 90.899 1.673 -1.241 1.00 0.00 H new ATOM 0 HD21 LEU A 67 88.427 0.416 -2.533 1.00 0.00 H new ATOM 0 HD22 LEU A 67 89.291 -0.225 -1.116 1.00 0.00 H new ATOM 0 HD23 LEU A 67 87.542 0.089 -1.024 1.00 0.00 H new ATOM 1059 N ILE A 68 86.232 1.483 2.950 1.00 0.00 N ATOM 1060 CA ILE A 68 86.003 0.998 4.349 1.00 0.00 C ATOM 1061 C ILE A 68 86.659 -0.373 4.538 1.00 0.00 C ATOM 1062 O ILE A 68 87.318 -0.624 5.530 1.00 0.00 O ATOM 1063 CB ILE A 68 84.478 0.895 4.500 1.00 0.00 C ATOM 1064 CG1 ILE A 68 83.840 2.268 4.250 1.00 0.00 C ATOM 1065 CG2 ILE A 68 84.127 0.431 5.918 1.00 0.00 C ATOM 1066 CD1 ILE A 68 82.315 2.135 4.246 1.00 0.00 C ATOM 0 H ILE A 68 85.435 1.377 2.322 1.00 0.00 H new ATOM 0 HA ILE A 68 86.434 1.666 5.094 1.00 0.00 H new ATOM 0 HB ILE A 68 84.098 0.175 3.775 1.00 0.00 H new ATOM 0 HG12 ILE A 68 84.151 2.971 5.023 1.00 0.00 H new ATOM 0 HG13 ILE A 68 84.182 2.671 3.297 1.00 0.00 H new ATOM 0 HG21 ILE A 68 83.044 0.360 6.020 1.00 0.00 H new ATOM 0 HG22 ILE A 68 84.574 -0.546 6.102 1.00 0.00 H new ATOM 0 HG23 ILE A 68 84.513 1.149 6.642 1.00 0.00 H new ATOM 0 HD11 ILE A 68 81.865 3.112 4.068 1.00 0.00 H new ATOM 0 HD12 ILE A 68 82.012 1.447 3.457 1.00 0.00 H new ATOM 0 HD13 ILE A 68 81.981 1.752 5.210 1.00 0.00 H new ATOM 1078 N GLU A 69 86.479 -1.254 3.587 1.00 0.00 N ATOM 1079 CA GLU A 69 87.039 -2.633 3.711 1.00 0.00 C ATOM 1080 C GLU A 69 87.663 -3.071 2.374 1.00 0.00 C ATOM 1081 O GLU A 69 86.959 -3.558 1.510 1.00 0.00 O ATOM 1082 CB GLU A 69 85.842 -3.518 4.059 1.00 0.00 C ATOM 1083 CG GLU A 69 85.281 -3.107 5.421 1.00 0.00 C ATOM 1084 CD GLU A 69 84.036 -3.939 5.734 1.00 0.00 C ATOM 1085 OE1 GLU A 69 82.991 -3.637 5.181 1.00 0.00 O ATOM 1086 OE2 GLU A 69 84.148 -4.864 6.522 1.00 0.00 O ATOM 0 H GLU A 69 85.965 -1.075 2.724 1.00 0.00 H new ATOM 0 HA GLU A 69 87.823 -2.695 4.466 1.00 0.00 H new ATOM 0 HB2 GLU A 69 85.072 -3.424 3.293 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.144 -4.565 4.080 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.034 -3.254 6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 69 85.031 -2.046 5.418 1.00 0.00 H new ATOM 1093 N PRO A 70 88.964 -2.885 2.231 1.00 0.00 N ATOM 1094 CA PRO A 70 89.645 -3.313 0.982 1.00 0.00 C ATOM 1095 C PRO A 70 89.501 -4.826 0.786 1.00 0.00 C ATOM 1096 O PRO A 70 89.402 -5.575 1.739 1.00 0.00 O ATOM 1097 CB PRO A 70 91.112 -2.934 1.197 1.00 0.00 C ATOM 1098 CG PRO A 70 91.120 -1.977 2.347 1.00 0.00 C ATOM 1099 CD PRO A 70 89.908 -2.276 3.184 1.00 0.00 C ATOM 0 HA PRO A 70 89.222 -2.843 0.094 1.00 0.00 H new ATOM 0 HB2 PRO A 70 91.715 -3.815 1.417 1.00 0.00 H new ATOM 0 HB3 PRO A 70 91.533 -2.474 0.303 1.00 0.00 H new ATOM 0 HG2 PRO A 70 92.031 -2.090 2.935 1.00 0.00 H new ATOM 0 HG3 PRO A 70 91.097 -0.947 1.990 1.00 0.00 H new ATOM 0 HD2 PRO A 70 90.145 -2.956 4.002 1.00 0.00 H new ATOM 0 HD3 PRO A 70 89.497 -1.371 3.631 1.00 0.00 H new ATOM 1107 N ALA A 71 89.490 -5.273 -0.446 1.00 0.00 N ATOM 1108 CA ALA A 71 89.378 -6.738 -0.722 1.00 0.00 C ATOM 1109 C ALA A 71 90.770 -7.345 -0.912 1.00 0.00 C ATOM 1110 O ALA A 71 91.658 -6.718 -1.460 1.00 0.00 O ATOM 1111 CB ALA A 71 88.566 -6.837 -2.014 1.00 0.00 C ATOM 0 H ALA A 71 89.554 -4.683 -1.275 1.00 0.00 H new ATOM 0 HA ALA A 71 88.905 -7.279 0.097 1.00 0.00 H new ATOM 0 HB1 ALA A 71 88.440 -7.885 -2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 71 87.588 -6.380 -1.865 1.00 0.00 H new ATOM 0 HB3 ALA A 71 89.091 -6.316 -2.815 1.00 0.00 H new ATOM 1117 N LYS A 72 90.963 -8.562 -0.464 1.00 0.00 N ATOM 1118 CA LYS A 72 92.304 -9.211 -0.583 1.00 0.00 C ATOM 1119 C LYS A 72 92.435 -9.914 -1.937 1.00 0.00 C ATOM 1120 O LYS A 72 91.546 -10.632 -2.360 1.00 0.00 O ATOM 1121 CB LYS A 72 92.352 -10.229 0.557 1.00 0.00 C ATOM 1122 CG LYS A 72 92.278 -9.498 1.898 1.00 0.00 C ATOM 1123 CD LYS A 72 92.437 -10.505 3.038 1.00 0.00 C ATOM 1124 CE LYS A 72 92.233 -9.796 4.379 1.00 0.00 C ATOM 1125 NZ LYS A 72 91.897 -10.882 5.342 1.00 0.00 N ATOM 0 H LYS A 72 90.246 -9.135 -0.019 1.00 0.00 H new ATOM 0 HA LYS A 72 93.119 -8.490 -0.521 1.00 0.00 H new ATOM 0 HB2 LYS A 72 91.523 -10.931 0.467 1.00 0.00 H new ATOM 0 HB3 LYS A 72 93.271 -10.812 0.499 1.00 0.00 H new ATOM 0 HG2 LYS A 72 93.060 -8.741 1.955 1.00 0.00 H new ATOM 0 HG3 LYS A 72 91.324 -8.978 1.988 1.00 0.00 H new ATOM 0 HD2 LYS A 72 91.713 -11.312 2.928 1.00 0.00 H new ATOM 0 HD3 LYS A 72 93.428 -10.958 3.001 1.00 0.00 H new ATOM 0 HE2 LYS A 72 93.133 -9.262 4.684 1.00 0.00 H new ATOM 0 HE3 LYS A 72 91.431 -9.060 4.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 91.743 -10.474 6.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 91.032 -11.368 5.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 92.681 -11.564 5.384 1.00 0.00 H new ATOM 1139 N GLN A 73 93.537 -9.710 -2.615 1.00 0.00 N ATOM 1140 CA GLN A 73 93.744 -10.369 -3.945 1.00 0.00 C ATOM 1141 C GLN A 73 93.746 -11.892 -3.785 1.00 0.00 C ATOM 1142 O GLN A 73 93.252 -12.612 -4.634 1.00 0.00 O ATOM 1143 CB GLN A 73 95.111 -9.882 -4.436 1.00 0.00 C ATOM 1144 CG GLN A 73 95.076 -8.364 -4.640 1.00 0.00 C ATOM 1145 CD GLN A 73 94.097 -8.019 -5.766 1.00 0.00 C ATOM 1146 OE1 GLN A 73 94.150 -8.599 -6.831 1.00 0.00 O ATOM 1147 NE2 GLN A 73 93.200 -7.090 -5.571 1.00 0.00 N ATOM 0 H GLN A 73 94.305 -9.114 -2.305 1.00 0.00 H new ATOM 0 HA GLN A 73 92.951 -10.120 -4.650 1.00 0.00 H new ATOM 0 HB2 GLN A 73 95.883 -10.144 -3.712 1.00 0.00 H new ATOM 0 HB3 GLN A 73 95.370 -10.378 -5.371 1.00 0.00 H new ATOM 0 HG2 GLN A 73 94.773 -7.870 -3.717 1.00 0.00 H new ATOM 0 HG3 GLN A 73 96.072 -7.997 -4.886 1.00 0.00 H new ATOM 0 HE21 GLN A 73 93.156 -6.603 -4.676 1.00 0.00 H new ATOM 0 HE22 GLN A 73 92.543 -6.851 -6.314 1.00 0.00 H new ATOM 1156 N ASP A 74 94.299 -12.383 -2.702 1.00 0.00 N ATOM 1157 CA ASP A 74 94.353 -13.864 -2.481 1.00 0.00 C ATOM 1158 C ASP A 74 92.939 -14.449 -2.448 1.00 0.00 C ATOM 1159 O ASP A 74 92.696 -15.532 -2.948 1.00 0.00 O ATOM 1160 CB ASP A 74 95.039 -14.050 -1.122 1.00 0.00 C ATOM 1161 CG ASP A 74 96.484 -13.541 -1.193 1.00 0.00 C ATOM 1162 OD1 ASP A 74 97.063 -13.589 -2.267 1.00 0.00 O ATOM 1163 OD2 ASP A 74 96.988 -13.112 -0.169 1.00 0.00 O ATOM 0 H ASP A 74 94.716 -11.821 -1.960 1.00 0.00 H new ATOM 0 HA ASP A 74 94.892 -14.374 -3.280 1.00 0.00 H new ATOM 0 HB2 ASP A 74 94.491 -13.508 -0.351 1.00 0.00 H new ATOM 0 HB3 ASP A 74 95.028 -15.103 -0.841 1.00 0.00 H new ATOM 1168 N LEU A 75 92.008 -13.736 -1.863 1.00 0.00 N ATOM 1169 CA LEU A 75 90.603 -14.239 -1.782 1.00 0.00 C ATOM 1170 C LEU A 75 89.730 -13.515 -2.811 1.00 0.00 C ATOM 1171 O LEU A 75 89.783 -12.305 -2.936 1.00 0.00 O ATOM 1172 CB LEU A 75 90.147 -13.909 -0.353 1.00 0.00 C ATOM 1173 CG LEU A 75 89.004 -14.842 0.088 1.00 0.00 C ATOM 1174 CD1 LEU A 75 87.803 -14.693 -0.852 1.00 0.00 C ATOM 1175 CD2 LEU A 75 89.486 -16.297 0.072 1.00 0.00 C ATOM 0 H LEU A 75 92.163 -12.823 -1.436 1.00 0.00 H new ATOM 0 HA LEU A 75 90.527 -15.305 -1.995 1.00 0.00 H new ATOM 0 HB2 LEU A 75 90.988 -14.008 0.333 1.00 0.00 H new ATOM 0 HB3 LEU A 75 89.815 -12.872 -0.303 1.00 0.00 H new ATOM 0 HG LEU A 75 88.701 -14.569 1.099 1.00 0.00 H new ATOM 0 HD11 LEU A 75 87.003 -15.358 -0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 75 87.449 -13.662 -0.830 1.00 0.00 H new ATOM 0 HD13 LEU A 75 88.102 -14.952 -1.868 1.00 0.00 H new ATOM 0 HD21 LEU A 75 88.674 -16.953 0.385 1.00 0.00 H new ATOM 0 HD22 LEU A 75 89.801 -16.565 -0.937 1.00 0.00 H new ATOM 0 HD23 LEU A 75 90.327 -16.409 0.756 1.00 0.00 H new ATOM 1187 N ASP A 76 88.931 -14.249 -3.544 1.00 0.00 N ATOM 1188 CA ASP A 76 88.034 -13.615 -4.558 1.00 0.00 C ATOM 1189 C ASP A 76 86.776 -13.066 -3.877 1.00 0.00 C ATOM 1190 O ASP A 76 86.004 -13.804 -3.294 1.00 0.00 O ATOM 1191 CB ASP A 76 87.673 -14.738 -5.533 1.00 0.00 C ATOM 1192 CG ASP A 76 86.840 -14.177 -6.690 1.00 0.00 C ATOM 1193 OD1 ASP A 76 87.022 -13.018 -7.026 1.00 0.00 O ATOM 1194 OD2 ASP A 76 86.030 -14.919 -7.223 1.00 0.00 O ATOM 0 H ASP A 76 88.861 -15.265 -3.483 1.00 0.00 H new ATOM 0 HA ASP A 76 88.512 -12.778 -5.066 1.00 0.00 H new ATOM 0 HB2 ASP A 76 88.581 -15.202 -5.919 1.00 0.00 H new ATOM 0 HB3 ASP A 76 87.113 -15.516 -5.014 1.00 0.00 H new ATOM 1199 N GLY A 77 86.572 -11.774 -3.949 1.00 0.00 N ATOM 1200 CA GLY A 77 85.400 -11.145 -3.264 1.00 0.00 C ATOM 1201 C GLY A 77 84.094 -11.748 -3.791 1.00 0.00 C ATOM 1202 O GLY A 77 83.116 -11.847 -3.073 1.00 0.00 O ATOM 0 H GLY A 77 87.171 -11.123 -4.457 1.00 0.00 H new ATOM 0 HA2 GLY A 77 85.472 -11.300 -2.187 1.00 0.00 H new ATOM 0 HA3 GLY A 77 85.406 -10.068 -3.432 1.00 0.00 H new ATOM 1206 N HIS A 78 84.075 -12.149 -5.039 1.00 0.00 N ATOM 1207 CA HIS A 78 82.816 -12.684 -5.644 1.00 0.00 C ATOM 1208 C HIS A 78 82.813 -14.216 -5.606 1.00 0.00 C ATOM 1209 O HIS A 78 83.067 -14.870 -6.601 1.00 0.00 O ATOM 1210 CB HIS A 78 82.828 -12.181 -7.088 1.00 0.00 C ATOM 1211 CG HIS A 78 81.582 -12.534 -7.855 1.00 0.00 C ATOM 1212 ND1 HIS A 78 80.339 -12.015 -7.526 1.00 0.00 N ATOM 1213 CD2 HIS A 78 81.373 -13.352 -8.937 1.00 0.00 C ATOM 1214 CE1 HIS A 78 79.446 -12.522 -8.396 1.00 0.00 C ATOM 1215 NE2 HIS A 78 80.023 -13.343 -9.278 1.00 0.00 N ATOM 0 H HIS A 78 84.879 -12.129 -5.666 1.00 0.00 H new ATOM 0 HA HIS A 78 81.928 -12.356 -5.104 1.00 0.00 H new ATOM 0 HB2 HIS A 78 82.950 -11.098 -7.086 1.00 0.00 H new ATOM 0 HB3 HIS A 78 83.693 -12.598 -7.603 1.00 0.00 H new ATOM 0 HD2 HIS A 78 82.139 -13.917 -9.447 1.00 0.00 H new ATOM 0 HE1 HIS A 78 78.391 -12.293 -8.383 1.00 0.00 H new ATOM 0 HE2 HIS A 78 79.572 -13.853 -10.037 1.00 0.00 H new ATOM 1223 N THR A 79 82.527 -14.787 -4.462 1.00 0.00 N ATOM 1224 CA THR A 79 82.427 -16.276 -4.360 1.00 0.00 C ATOM 1225 C THR A 79 81.090 -16.669 -3.727 1.00 0.00 C ATOM 1226 O THR A 79 80.485 -15.894 -3.009 1.00 0.00 O ATOM 1227 CB THR A 79 83.591 -16.695 -3.458 1.00 0.00 C ATOM 1228 OG1 THR A 79 83.454 -16.067 -2.191 1.00 0.00 O ATOM 1229 CG2 THR A 79 84.917 -16.282 -4.097 1.00 0.00 C ATOM 0 H THR A 79 82.358 -14.284 -3.591 1.00 0.00 H new ATOM 0 HA THR A 79 82.475 -16.761 -5.335 1.00 0.00 H new ATOM 0 HB THR A 79 83.579 -17.778 -3.331 1.00 0.00 H new ATOM 0 HG1 THR A 79 84.341 -15.848 -1.837 1.00 0.00 H new ATOM 0 HG21 THR A 79 85.742 -16.583 -3.451 1.00 0.00 H new ATOM 0 HG22 THR A 79 85.020 -16.768 -5.067 1.00 0.00 H new ATOM 0 HG23 THR A 79 84.936 -15.200 -4.229 1.00 0.00 H new ATOM 1237 N ALA A 80 80.629 -17.869 -3.989 1.00 0.00 N ATOM 1238 CA ALA A 80 79.329 -18.323 -3.404 1.00 0.00 C ATOM 1239 C ALA A 80 79.555 -19.184 -2.143 1.00 0.00 C ATOM 1240 O ALA A 80 78.992 -18.886 -1.107 1.00 0.00 O ATOM 1241 CB ALA A 80 78.649 -19.136 -4.506 1.00 0.00 C ATOM 0 H ALA A 80 81.098 -18.553 -4.583 1.00 0.00 H new ATOM 0 HA ALA A 80 78.716 -17.479 -3.087 1.00 0.00 H new ATOM 0 HB1 ALA A 80 77.687 -19.502 -4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 80 78.493 -18.505 -5.381 1.00 0.00 H new ATOM 0 HB3 ALA A 80 79.281 -19.982 -4.777 1.00 0.00 H new ATOM 1247 N PRO A 81 80.366 -20.228 -2.247 1.00 0.00 N ATOM 1248 CA PRO A 81 80.556 -21.135 -1.084 1.00 0.00 C ATOM 1249 C PRO A 81 81.081 -20.365 0.146 1.00 0.00 C ATOM 1250 O PRO A 81 80.529 -20.505 1.221 1.00 0.00 O ATOM 1251 CB PRO A 81 81.580 -22.169 -1.556 1.00 0.00 C ATOM 1252 CG PRO A 81 81.647 -22.035 -3.045 1.00 0.00 C ATOM 1253 CD PRO A 81 81.165 -20.656 -3.408 1.00 0.00 C ATOM 0 HA PRO A 81 79.619 -21.595 -0.772 1.00 0.00 H new ATOM 0 HB2 PRO A 81 82.555 -21.987 -1.104 1.00 0.00 H new ATOM 0 HB3 PRO A 81 81.278 -23.176 -1.268 1.00 0.00 H new ATOM 0 HG2 PRO A 81 82.668 -22.187 -3.396 1.00 0.00 H new ATOM 0 HG3 PRO A 81 81.029 -22.794 -3.525 1.00 0.00 H new ATOM 0 HD2 PRO A 81 82.000 -19.978 -3.587 1.00 0.00 H new ATOM 0 HD3 PRO A 81 80.566 -20.672 -4.318 1.00 0.00 H new ATOM 1261 N PRO A 82 82.127 -19.572 -0.029 1.00 0.00 N ATOM 1262 CA PRO A 82 82.709 -18.846 1.130 1.00 0.00 C ATOM 1263 C PRO A 82 81.677 -17.869 1.726 1.00 0.00 C ATOM 1264 O PRO A 82 80.880 -17.310 0.999 1.00 0.00 O ATOM 1265 CB PRO A 82 83.897 -18.078 0.546 1.00 0.00 C ATOM 1266 CG PRO A 82 84.155 -18.687 -0.795 1.00 0.00 C ATOM 1267 CD PRO A 82 82.857 -19.275 -1.273 1.00 0.00 C ATOM 0 HA PRO A 82 83.005 -19.519 1.935 1.00 0.00 H new ATOM 0 HB2 PRO A 82 83.670 -17.016 0.456 1.00 0.00 H new ATOM 0 HB3 PRO A 82 84.773 -18.164 1.190 1.00 0.00 H new ATOM 0 HG2 PRO A 82 84.518 -17.935 -1.496 1.00 0.00 H new ATOM 0 HG3 PRO A 82 84.924 -19.456 -0.727 1.00 0.00 H new ATOM 0 HD2 PRO A 82 82.308 -18.574 -1.902 1.00 0.00 H new ATOM 0 HD3 PRO A 82 83.020 -20.175 -1.866 1.00 0.00 H new ATOM 1275 N PRO A 83 81.714 -17.685 3.036 1.00 0.00 N ATOM 1276 CA PRO A 83 80.790 -16.715 3.679 1.00 0.00 C ATOM 1277 C PRO A 83 81.050 -15.304 3.146 1.00 0.00 C ATOM 1278 O PRO A 83 82.144 -14.987 2.716 1.00 0.00 O ATOM 1279 CB PRO A 83 81.125 -16.802 5.170 1.00 0.00 C ATOM 1280 CG PRO A 83 82.456 -17.480 5.249 1.00 0.00 C ATOM 1281 CD PRO A 83 82.592 -18.337 4.023 1.00 0.00 C ATOM 0 HA PRO A 83 79.741 -16.935 3.479 1.00 0.00 H new ATOM 0 HB2 PRO A 83 81.164 -15.810 5.621 1.00 0.00 H new ATOM 0 HB3 PRO A 83 80.365 -17.368 5.709 1.00 0.00 H new ATOM 0 HG2 PRO A 83 83.260 -16.745 5.296 1.00 0.00 H new ATOM 0 HG3 PRO A 83 82.526 -18.087 6.152 1.00 0.00 H new ATOM 0 HD2 PRO A 83 83.624 -18.376 3.675 1.00 0.00 H new ATOM 0 HD3 PRO A 83 82.282 -19.364 4.217 1.00 0.00 H new ATOM 1289 N VAL A 84 80.049 -14.457 3.171 1.00 0.00 N ATOM 1290 CA VAL A 84 80.220 -13.064 2.645 1.00 0.00 C ATOM 1291 C VAL A 84 81.319 -12.330 3.422 1.00 0.00 C ATOM 1292 O VAL A 84 81.326 -12.319 4.640 1.00 0.00 O ATOM 1293 CB VAL A 84 78.859 -12.378 2.840 1.00 0.00 C ATOM 1294 CG1 VAL A 84 77.795 -13.126 2.036 1.00 0.00 C ATOM 1295 CG2 VAL A 84 78.472 -12.384 4.326 1.00 0.00 C ATOM 0 H VAL A 84 79.120 -14.670 3.533 1.00 0.00 H new ATOM 0 HA VAL A 84 80.521 -13.060 1.597 1.00 0.00 H new ATOM 0 HB VAL A 84 78.927 -11.347 2.494 1.00 0.00 H new ATOM 0 HG11 VAL A 84 76.828 -12.641 2.173 1.00 0.00 H new ATOM 0 HG12 VAL A 84 78.061 -13.113 0.979 1.00 0.00 H new ATOM 0 HG13 VAL A 84 77.736 -14.158 2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 84 77.506 -11.895 4.452 1.00 0.00 H new ATOM 0 HG22 VAL A 84 78.408 -13.413 4.681 1.00 0.00 H new ATOM 0 HG23 VAL A 84 79.227 -11.848 4.901 1.00 0.00 H new ATOM 1305 N VAL A 85 82.242 -11.720 2.722 1.00 0.00 N ATOM 1306 CA VAL A 85 83.361 -10.995 3.406 1.00 0.00 C ATOM 1307 C VAL A 85 82.809 -9.803 4.198 1.00 0.00 C ATOM 1308 O VAL A 85 83.286 -9.490 5.273 1.00 0.00 O ATOM 1309 CB VAL A 85 84.289 -10.518 2.277 1.00 0.00 C ATOM 1310 CG1 VAL A 85 85.479 -9.752 2.867 1.00 0.00 C ATOM 1311 CG2 VAL A 85 84.808 -11.729 1.498 1.00 0.00 C ATOM 0 H VAL A 85 82.270 -11.692 1.703 1.00 0.00 H new ATOM 0 HA VAL A 85 83.890 -11.630 4.116 1.00 0.00 H new ATOM 0 HB VAL A 85 83.730 -9.861 1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 85 86.132 -9.417 2.061 1.00 0.00 H new ATOM 0 HG12 VAL A 85 85.116 -8.887 3.423 1.00 0.00 H new ATOM 0 HG13 VAL A 85 86.036 -10.406 3.538 1.00 0.00 H new ATOM 0 HG21 VAL A 85 85.466 -11.392 0.697 1.00 0.00 H new ATOM 0 HG22 VAL A 85 85.361 -12.384 2.171 1.00 0.00 H new ATOM 0 HG23 VAL A 85 83.967 -12.275 1.071 1.00 0.00 H new ATOM 1321 N ASN A 86 81.807 -9.142 3.669 1.00 0.00 N ATOM 1322 CA ASN A 86 81.264 -7.922 4.346 1.00 0.00 C ATOM 1323 C ASN A 86 80.504 -8.311 5.617 1.00 0.00 C ATOM 1324 O ASN A 86 79.567 -9.087 5.576 1.00 0.00 O ATOM 1325 CB ASN A 86 80.313 -7.282 3.328 1.00 0.00 C ATOM 1326 CG ASN A 86 79.922 -5.871 3.788 1.00 0.00 C ATOM 1327 OD1 ASN A 86 80.174 -5.486 4.914 1.00 0.00 O ATOM 1328 ND2 ASN A 86 79.310 -5.076 2.954 1.00 0.00 N ATOM 0 H ASN A 86 81.342 -9.395 2.797 1.00 0.00 H new ATOM 0 HA ASN A 86 82.057 -7.237 4.647 1.00 0.00 H new ATOM 0 HB2 ASN A 86 80.792 -7.235 2.350 1.00 0.00 H new ATOM 0 HB3 ASN A 86 79.420 -7.897 3.216 1.00 0.00 H new ATOM 0 HD21 ASN A 86 79.045 -4.136 3.247 1.00 0.00 H new ATOM 0 HD22 ASN A 86 79.097 -5.395 2.009 1.00 0.00 H new ATOM 1335 N LYS A 87 80.906 -7.773 6.742 1.00 0.00 N ATOM 1336 CA LYS A 87 80.206 -8.080 8.026 1.00 0.00 C ATOM 1337 C LYS A 87 79.956 -6.783 8.816 1.00 0.00 C ATOM 1338 O LYS A 87 80.529 -5.760 8.496 1.00 0.00 O ATOM 1339 CB LYS A 87 81.163 -8.996 8.789 1.00 0.00 C ATOM 1340 CG LYS A 87 80.781 -10.458 8.543 1.00 0.00 C ATOM 1341 CD LYS A 87 81.539 -11.358 9.522 1.00 0.00 C ATOM 1342 CE LYS A 87 81.878 -12.685 8.841 1.00 0.00 C ATOM 1343 NZ LYS A 87 83.196 -13.084 9.411 1.00 0.00 N ATOM 0 H LYS A 87 81.694 -7.131 6.826 1.00 0.00 H new ATOM 0 HA LYS A 87 79.235 -8.548 7.866 1.00 0.00 H new ATOM 0 HB2 LYS A 87 82.188 -8.818 8.465 1.00 0.00 H new ATOM 0 HB3 LYS A 87 81.123 -8.774 9.855 1.00 0.00 H new ATOM 0 HG2 LYS A 87 79.706 -10.590 8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 87 81.018 -10.739 7.517 1.00 0.00 H new ATOM 0 HD2 LYS A 87 82.452 -10.864 9.854 1.00 0.00 H new ATOM 0 HD3 LYS A 87 80.933 -11.538 10.410 1.00 0.00 H new ATOM 0 HE2 LYS A 87 81.116 -13.438 9.043 1.00 0.00 H new ATOM 0 HE3 LYS A 87 81.934 -12.570 7.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 83.496 -13.987 8.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 83.903 -12.351 9.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 83.110 -13.192 10.442 1.00 0.00 H new ATOM 1357 N PRO A 88 79.110 -6.851 9.829 1.00 0.00 N ATOM 1358 CA PRO A 88 78.840 -5.647 10.658 1.00 0.00 C ATOM 1359 C PRO A 88 80.130 -5.163 11.329 1.00 0.00 C ATOM 1360 O PRO A 88 80.968 -5.957 11.719 1.00 0.00 O ATOM 1361 CB PRO A 88 77.829 -6.122 11.705 1.00 0.00 C ATOM 1362 CG PRO A 88 77.883 -7.617 11.672 1.00 0.00 C ATOM 1363 CD PRO A 88 78.339 -8.017 10.297 1.00 0.00 C ATOM 0 HA PRO A 88 78.462 -4.810 10.071 1.00 0.00 H new ATOM 0 HB2 PRO A 88 78.083 -5.743 12.695 1.00 0.00 H new ATOM 0 HB3 PRO A 88 76.827 -5.761 11.473 1.00 0.00 H new ATOM 0 HG2 PRO A 88 78.570 -7.994 12.430 1.00 0.00 H new ATOM 0 HG3 PRO A 88 76.903 -8.042 11.891 1.00 0.00 H new ATOM 0 HD2 PRO A 88 78.953 -8.917 10.325 1.00 0.00 H new ATOM 0 HD3 PRO A 88 77.494 -8.228 9.641 1.00 0.00 H new ATOM 1371 N THR A 89 80.291 -3.870 11.464 1.00 0.00 N ATOM 1372 CA THR A 89 81.535 -3.321 12.085 1.00 0.00 C ATOM 1373 C THR A 89 81.194 -2.516 13.353 1.00 0.00 C ATOM 1374 O THR A 89 80.780 -1.378 13.254 1.00 0.00 O ATOM 1375 CB THR A 89 82.138 -2.406 11.017 1.00 0.00 C ATOM 1376 OG1 THR A 89 81.107 -1.627 10.427 1.00 0.00 O ATOM 1377 CG2 THR A 89 82.818 -3.255 9.941 1.00 0.00 C ATOM 0 H THR A 89 79.611 -3.169 11.169 1.00 0.00 H new ATOM 0 HA THR A 89 82.225 -4.109 12.388 1.00 0.00 H new ATOM 0 HB THR A 89 82.875 -1.747 11.476 1.00 0.00 H new ATOM 0 HG1 THR A 89 80.563 -1.217 11.131 1.00 0.00 H new ATOM 0 HG21 THR A 89 83.247 -2.603 9.180 1.00 0.00 H new ATOM 0 HG22 THR A 89 83.608 -3.853 10.395 1.00 0.00 H new ATOM 0 HG23 THR A 89 82.083 -3.915 9.480 1.00 0.00 H new ATOM 1385 N PRO A 90 81.373 -3.125 14.512 1.00 0.00 N ATOM 1386 CA PRO A 90 81.123 -2.394 15.782 1.00 0.00 C ATOM 1387 C PRO A 90 82.095 -1.217 15.914 1.00 0.00 C ATOM 1388 O PRO A 90 83.198 -1.254 15.401 1.00 0.00 O ATOM 1389 CB PRO A 90 81.379 -3.432 16.876 1.00 0.00 C ATOM 1390 CG PRO A 90 82.163 -4.525 16.220 1.00 0.00 C ATOM 1391 CD PRO A 90 81.811 -4.510 14.759 1.00 0.00 C ATOM 0 HA PRO A 90 80.117 -1.977 15.837 1.00 0.00 H new ATOM 0 HB2 PRO A 90 81.934 -2.997 17.707 1.00 0.00 H new ATOM 0 HB3 PRO A 90 80.442 -3.812 17.283 1.00 0.00 H new ATOM 0 HG2 PRO A 90 83.233 -4.368 16.360 1.00 0.00 H new ATOM 0 HG3 PRO A 90 81.922 -5.491 16.664 1.00 0.00 H new ATOM 0 HD2 PRO A 90 82.668 -4.774 14.139 1.00 0.00 H new ATOM 0 HD3 PRO A 90 81.021 -5.225 14.532 1.00 0.00 H new ATOM 1399 N VAL A 91 81.689 -0.175 16.599 1.00 0.00 N ATOM 1400 CA VAL A 91 82.588 1.014 16.776 1.00 0.00 C ATOM 1401 C VAL A 91 83.870 0.593 17.504 1.00 0.00 C ATOM 1402 O VAL A 91 84.956 1.029 17.167 1.00 0.00 O ATOM 1403 CB VAL A 91 81.783 2.012 17.623 1.00 0.00 C ATOM 1404 CG1 VAL A 91 82.615 3.274 17.873 1.00 0.00 C ATOM 1405 CG2 VAL A 91 80.500 2.394 16.881 1.00 0.00 C ATOM 0 H VAL A 91 80.775 -0.095 17.044 1.00 0.00 H new ATOM 0 HA VAL A 91 82.888 1.451 15.824 1.00 0.00 H new ATOM 0 HB VAL A 91 81.533 1.549 18.577 1.00 0.00 H new ATOM 0 HG11 VAL A 91 82.038 3.977 18.474 1.00 0.00 H new ATOM 0 HG12 VAL A 91 83.529 3.008 18.404 1.00 0.00 H new ATOM 0 HG13 VAL A 91 82.870 3.736 16.919 1.00 0.00 H new ATOM 0 HG21 VAL A 91 79.929 3.102 17.482 1.00 0.00 H new ATOM 0 HG22 VAL A 91 80.755 2.852 15.925 1.00 0.00 H new ATOM 0 HG23 VAL A 91 79.901 1.500 16.706 1.00 0.00 H new ATOM 1415 N LYS A 92 83.746 -0.252 18.498 1.00 0.00 N ATOM 1416 CA LYS A 92 84.951 -0.737 19.238 1.00 0.00 C ATOM 1417 C LYS A 92 85.602 -1.899 18.481 1.00 0.00 C ATOM 1418 O LYS A 92 84.926 -2.786 17.992 1.00 0.00 O ATOM 1419 CB LYS A 92 84.423 -1.209 20.593 1.00 0.00 C ATOM 1420 CG LYS A 92 85.602 -1.557 21.505 1.00 0.00 C ATOM 1421 CD LYS A 92 86.268 -0.268 21.990 1.00 0.00 C ATOM 1422 CE LYS A 92 87.408 -0.614 22.951 1.00 0.00 C ATOM 1423 NZ LYS A 92 88.628 -0.662 22.099 1.00 0.00 N ATOM 0 H LYS A 92 82.858 -0.628 18.830 1.00 0.00 H new ATOM 0 HA LYS A 92 85.709 0.038 19.345 1.00 0.00 H new ATOM 0 HB2 LYS A 92 83.813 -0.429 21.050 1.00 0.00 H new ATOM 0 HB3 LYS A 92 83.781 -2.080 20.462 1.00 0.00 H new ATOM 0 HG2 LYS A 92 85.256 -2.143 22.356 1.00 0.00 H new ATOM 0 HG3 LYS A 92 86.323 -2.172 20.966 1.00 0.00 H new ATOM 0 HD2 LYS A 92 86.652 0.297 21.141 1.00 0.00 H new ATOM 0 HD3 LYS A 92 85.536 0.366 22.490 1.00 0.00 H new ATOM 0 HE2 LYS A 92 87.504 0.136 23.736 1.00 0.00 H new ATOM 0 HE3 LYS A 92 87.233 -1.570 23.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 89.269 -1.402 22.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 88.358 -0.876 21.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 89.111 0.258 22.132 1.00 0.00 H new ATOM 1437 N LEU A 93 86.910 -1.895 18.383 1.00 0.00 N ATOM 1438 CA LEU A 93 87.617 -2.990 17.644 1.00 0.00 C ATOM 1439 C LEU A 93 87.449 -4.326 18.393 1.00 0.00 C ATOM 1440 O LEU A 93 87.498 -4.348 19.606 1.00 0.00 O ATOM 1441 CB LEU A 93 89.092 -2.574 17.615 1.00 0.00 C ATOM 1442 CG LEU A 93 89.690 -2.889 16.242 1.00 0.00 C ATOM 1443 CD1 LEU A 93 89.214 -1.851 15.226 1.00 0.00 C ATOM 1444 CD2 LEU A 93 91.217 -2.851 16.332 1.00 0.00 C ATOM 0 H LEU A 93 87.519 -1.181 18.783 1.00 0.00 H new ATOM 0 HA LEU A 93 87.218 -3.131 16.640 1.00 0.00 H new ATOM 0 HB2 LEU A 93 89.184 -1.509 17.826 1.00 0.00 H new ATOM 0 HB3 LEU A 93 89.644 -3.102 18.393 1.00 0.00 H new ATOM 0 HG LEU A 93 89.368 -3.881 15.924 1.00 0.00 H new ATOM 0 HD11 LEU A 93 89.641 -2.076 14.249 1.00 0.00 H new ATOM 0 HD12 LEU A 93 88.126 -1.877 15.162 1.00 0.00 H new ATOM 0 HD13 LEU A 93 89.535 -0.859 15.542 1.00 0.00 H new ATOM 0 HD21 LEU A 93 91.645 -3.075 15.355 1.00 0.00 H new ATOM 0 HD22 LEU A 93 91.538 -1.859 16.650 1.00 0.00 H new ATOM 0 HD23 LEU A 93 91.557 -3.592 17.056 1.00 0.00 H new ATOM 1456 N PRO A 94 87.254 -5.409 17.658 1.00 0.00 N ATOM 1457 CA PRO A 94 87.068 -6.732 18.312 1.00 0.00 C ATOM 1458 C PRO A 94 88.296 -7.094 19.155 1.00 0.00 C ATOM 1459 O PRO A 94 89.416 -6.768 18.806 1.00 0.00 O ATOM 1460 CB PRO A 94 86.906 -7.712 17.148 1.00 0.00 C ATOM 1461 CG PRO A 94 86.584 -6.872 15.954 1.00 0.00 C ATOM 1462 CD PRO A 94 87.187 -5.517 16.189 1.00 0.00 C ATOM 0 HA PRO A 94 86.214 -6.745 18.989 1.00 0.00 H new ATOM 0 HB2 PRO A 94 87.819 -8.285 16.989 1.00 0.00 H new ATOM 0 HB3 PRO A 94 86.110 -8.430 17.348 1.00 0.00 H new ATOM 0 HG2 PRO A 94 86.989 -7.321 15.047 1.00 0.00 H new ATOM 0 HG3 PRO A 94 85.505 -6.795 15.817 1.00 0.00 H new ATOM 0 HD2 PRO A 94 88.175 -5.436 15.737 1.00 0.00 H new ATOM 0 HD3 PRO A 94 86.573 -4.726 15.758 1.00 0.00 H new ATOM 1470 N HIS A 95 88.087 -7.765 20.261 1.00 0.00 N ATOM 1471 CA HIS A 95 89.234 -8.179 21.126 1.00 0.00 C ATOM 1472 C HIS A 95 89.240 -9.700 21.299 1.00 0.00 C ATOM 1473 O HIS A 95 88.201 -10.331 21.347 1.00 0.00 O ATOM 1474 CB HIS A 95 88.989 -7.489 22.468 1.00 0.00 C ATOM 1475 CG HIS A 95 89.073 -5.989 22.397 1.00 0.00 C ATOM 1476 ND1 HIS A 95 87.956 -5.194 22.200 1.00 0.00 N ATOM 1477 CD2 HIS A 95 90.136 -5.124 22.495 1.00 0.00 C ATOM 1478 CE1 HIS A 95 88.366 -3.912 22.189 1.00 0.00 C ATOM 1479 NE2 HIS A 95 89.687 -3.813 22.363 1.00 0.00 N ATOM 0 H HIS A 95 87.168 -8.045 20.603 1.00 0.00 H new ATOM 0 HA HIS A 95 90.197 -7.902 20.696 1.00 0.00 H new ATOM 0 HB2 HIS A 95 88.004 -7.772 22.838 1.00 0.00 H new ATOM 0 HB3 HIS A 95 89.718 -7.852 23.192 1.00 0.00 H new ATOM 0 HD1 HIS A 95 86.997 -5.521 22.084 1.00 0.00 H new ATOM 0 HD2 HIS A 95 91.164 -5.417 22.651 1.00 0.00 H new ATOM 0 HE1 HIS A 95 87.707 -3.066 22.056 1.00 0.00 H new ATOM 1487 N PHE A 96 90.409 -10.288 21.394 1.00 0.00 N ATOM 1488 CA PHE A 96 90.497 -11.775 21.556 1.00 0.00 C ATOM 1489 C PHE A 96 89.809 -12.210 22.856 1.00 0.00 C ATOM 1490 O PHE A 96 89.324 -13.321 22.966 1.00 0.00 O ATOM 1491 CB PHE A 96 91.996 -12.097 21.604 1.00 0.00 C ATOM 1492 CG PHE A 96 92.715 -11.509 22.798 1.00 0.00 C ATOM 1493 CD1 PHE A 96 93.264 -10.184 22.727 1.00 0.00 C ATOM 1494 CD2 PHE A 96 92.845 -12.276 24.004 1.00 0.00 C ATOM 1495 CE1 PHE A 96 93.945 -9.628 23.861 1.00 0.00 C ATOM 1496 CE2 PHE A 96 93.525 -11.720 25.139 1.00 0.00 C ATOM 1497 CZ PHE A 96 94.075 -10.395 25.067 1.00 0.00 C ATOM 0 H PHE A 96 91.306 -9.803 21.366 1.00 0.00 H new ATOM 0 HA PHE A 96 90.000 -12.302 20.741 1.00 0.00 H new ATOM 0 HB2 PHE A 96 92.124 -13.179 21.613 1.00 0.00 H new ATOM 0 HB3 PHE A 96 92.466 -11.728 20.692 1.00 0.00 H new ATOM 0 HD1 PHE A 96 93.164 -9.606 21.820 1.00 0.00 H new ATOM 0 HD2 PHE A 96 92.431 -13.272 24.057 1.00 0.00 H new ATOM 0 HE1 PHE A 96 94.360 -8.632 23.807 1.00 0.00 H new ATOM 0 HE2 PHE A 96 93.623 -12.297 26.046 1.00 0.00 H new ATOM 0 HZ PHE A 96 94.587 -9.976 25.921 1.00 0.00 H new ATOM 1507 N SER A 97 89.765 -11.339 23.836 1.00 0.00 N ATOM 1508 CA SER A 97 89.092 -11.682 25.126 1.00 0.00 C ATOM 1509 C SER A 97 87.910 -10.740 25.371 1.00 0.00 C ATOM 1510 O SER A 97 87.980 -9.557 25.090 1.00 0.00 O ATOM 1511 CB SER A 97 90.164 -11.486 26.196 1.00 0.00 C ATOM 1512 OG SER A 97 89.649 -11.889 27.457 1.00 0.00 O ATOM 0 H SER A 97 90.168 -10.403 23.796 1.00 0.00 H new ATOM 0 HA SER A 97 88.695 -12.697 25.128 1.00 0.00 H new ATOM 0 HB2 SER A 97 91.051 -12.070 25.949 1.00 0.00 H new ATOM 0 HB3 SER A 97 90.470 -10.441 26.233 1.00 0.00 H new ATOM 0 HG SER A 97 90.336 -11.766 28.145 1.00 0.00 H new ATOM 1518 N ASN A 98 86.826 -11.260 25.894 1.00 0.00 N ATOM 1519 CA ASN A 98 85.627 -10.408 26.162 1.00 0.00 C ATOM 1520 C ASN A 98 85.494 -10.137 27.662 1.00 0.00 C ATOM 1521 O ASN A 98 85.360 -11.050 28.456 1.00 0.00 O ATOM 1522 CB ASN A 98 84.437 -11.229 25.657 1.00 0.00 C ATOM 1523 CG ASN A 98 83.181 -10.350 25.594 1.00 0.00 C ATOM 1524 OD1 ASN A 98 83.161 -9.246 26.105 1.00 0.00 O ATOM 1525 ND2 ASN A 98 82.120 -10.799 24.980 1.00 0.00 N ATOM 0 H ASN A 98 86.721 -12.242 26.148 1.00 0.00 H new ATOM 0 HA ASN A 98 85.692 -9.438 25.670 1.00 0.00 H new ATOM 0 HB2 ASN A 98 84.657 -11.634 24.669 1.00 0.00 H new ATOM 0 HB3 ASN A 98 84.264 -12.078 26.318 1.00 0.00 H new ATOM 0 HD21 ASN A 98 81.278 -10.225 24.930 1.00 0.00 H new ATOM 0 HD22 ASN A 98 82.133 -11.724 24.550 1.00 0.00 H new ATOM 1532 N ILE A 99 85.530 -8.885 28.051 1.00 0.00 N ATOM 1533 CA ILE A 99 85.399 -8.538 29.503 1.00 0.00 C ATOM 1534 C ILE A 99 84.019 -8.968 30.016 1.00 0.00 C ATOM 1535 O ILE A 99 83.875 -9.387 31.149 1.00 0.00 O ATOM 1536 CB ILE A 99 85.561 -7.010 29.581 1.00 0.00 C ATOM 1537 CG1 ILE A 99 86.933 -6.586 29.020 1.00 0.00 C ATOM 1538 CG2 ILE A 99 85.447 -6.550 31.039 1.00 0.00 C ATOM 1539 CD1 ILE A 99 88.069 -7.266 29.798 1.00 0.00 C ATOM 0 H ILE A 99 85.645 -8.087 27.426 1.00 0.00 H new ATOM 0 HA ILE A 99 86.143 -9.045 30.117 1.00 0.00 H new ATOM 0 HB ILE A 99 84.774 -6.547 28.986 1.00 0.00 H new ATOM 0 HG12 ILE A 99 86.998 -6.851 27.965 1.00 0.00 H new ATOM 0 HG13 ILE A 99 87.039 -5.503 29.084 1.00 0.00 H new ATOM 0 HG21 ILE A 99 85.562 -5.467 31.089 1.00 0.00 H new ATOM 0 HG22 ILE A 99 84.470 -6.829 31.433 1.00 0.00 H new ATOM 0 HG23 ILE A 99 86.227 -7.026 31.633 1.00 0.00 H new ATOM 0 HD11 ILE A 99 89.029 -6.954 29.387 1.00 0.00 H new ATOM 0 HD12 ILE A 99 88.013 -6.979 30.848 1.00 0.00 H new ATOM 0 HD13 ILE A 99 87.972 -8.348 29.712 1.00 0.00 H new ATOM 1551 N LEU A 100 83.010 -8.862 29.186 1.00 0.00 N ATOM 1552 CA LEU A 100 81.632 -9.258 29.611 1.00 0.00 C ATOM 1553 C LEU A 100 81.348 -10.707 29.206 1.00 0.00 C ATOM 1554 O LEU A 100 81.747 -11.150 28.145 1.00 0.00 O ATOM 1555 CB LEU A 100 80.691 -8.300 28.871 1.00 0.00 C ATOM 1556 CG LEU A 100 81.010 -6.851 29.254 1.00 0.00 C ATOM 1557 CD1 LEU A 100 80.128 -5.903 28.438 1.00 0.00 C ATOM 1558 CD2 LEU A 100 80.731 -6.639 30.745 1.00 0.00 C ATOM 0 H LEU A 100 83.082 -8.517 28.229 1.00 0.00 H new ATOM 0 HA LEU A 100 81.504 -9.199 30.692 1.00 0.00 H new ATOM 0 HB2 LEU A 100 80.798 -8.432 27.794 1.00 0.00 H new ATOM 0 HB3 LEU A 100 79.655 -8.531 29.119 1.00 0.00 H new ATOM 0 HG LEU A 100 82.061 -6.647 29.047 1.00 0.00 H new ATOM 0 HD11 LEU A 100 80.354 -4.872 28.709 1.00 0.00 H new ATOM 0 HD12 LEU A 100 80.322 -6.049 27.375 1.00 0.00 H new ATOM 0 HD13 LEU A 100 79.079 -6.112 28.647 1.00 0.00 H new ATOM 0 HD21 LEU A 100 80.959 -5.608 31.015 1.00 0.00 H new ATOM 0 HD22 LEU A 100 79.681 -6.845 30.951 1.00 0.00 H new ATOM 0 HD23 LEU A 100 81.355 -7.314 31.331 1.00 0.00 H new ATOM 1570 N GLY A 101 80.664 -11.442 30.048 1.00 0.00 N ATOM 1571 CA GLY A 101 80.343 -12.865 29.727 1.00 0.00 C ATOM 1572 C GLY A 101 78.827 -13.062 29.729 1.00 0.00 C ATOM 1573 O GLY A 101 78.136 -12.185 30.223 1.00 0.00 O ATOM 1574 OXT GLY A 101 78.380 -14.085 29.236 1.00 0.00 O ATOM 0 H GLY A 101 80.313 -11.115 30.948 1.00 0.00 H new ATOM 0 HA2 GLY A 101 80.753 -13.130 28.752 1.00 0.00 H new ATOM 0 HA3 GLY A 101 80.807 -13.527 30.458 1.00 0.00 H new TER 1578 GLY A 101