USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1106 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 52 THR OG1 : rot -100:sc= 0.708 USER MOD Set 1.2: A 54 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00403) USER MOD Set 2.1: A 9 GLN : amide:sc= 0.337 K(o=-0.022,f=-2.2) USER MOD Set 2.2: A 32 ASN : amide:sc= -0.36 K(o=-0.022,f=-2.2!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0266 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot -69:sc= 0.777 USER MOD Single : A 20 LYS NZ :NH3+ -125:sc= -0.281 (180deg=-1.82!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.0462 K(o=-0.046,f=-1.7!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 MET CE :methyl -139:sc= -0.202 (180deg=-1.56!) USER MOD Single : A 31 MET CE :methyl -119:sc= -5.2 (180deg=-11.3!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -164:sc= -0.0427 (180deg=-0.295) USER MOD Single : A 38 MET CE :methyl 137:sc= -3.89! (180deg=-8.35!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 174:sc= 0.59 (180deg=0.43) USER MOD Single : A 45 LYS NZ :NH3+ 156:sc= 0.603 (180deg=0.31) USER MOD Single : A 46 SER OG : rot 180:sc= -0.328 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.359) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 55 GLN : amide:sc= -0.0467 K(o=-0.047,f=-0.96) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.18 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -33:sc= 0.448 USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -1.19 K(o=-1.2,f=-1.9!) USER MOD Single : A 100 SER OG : rot -103:sc= 0.0236 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 69:sc= -0.451 USER MOD Single : A 110 HIS : no HD1:sc= -0.0457 X(o=-0.046,f=-0.041) USER MOD Single : A 119 CYS SG : rot -150:sc= -0.249 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.193 USER MOD Single : A 125 TYR OH : rot 121:sc= 0.124 USER MOD Single : A 126 TYR OH : rot -120:sc= -0.252 USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 6.924 -3.631 -2.346 1.00 64.33 N ATOM 45 CA ILE A 4 7.658 -3.896 -1.115 1.00 33.03 C ATOM 46 C ILE A 4 8.763 -4.922 -1.343 1.00 34.05 C ATOM 47 O ILE A 4 8.715 -5.700 -2.296 1.00 14.33 O ATOM 48 CB ILE A 4 6.723 -4.404 -0.001 1.00 10.30 C ATOM 49 CG1 ILE A 4 5.600 -5.256 -0.596 1.00 43.14 C ATOM 50 CG2 ILE A 4 6.148 -3.233 0.782 1.00 21.15 C ATOM 51 CD1 ILE A 4 6.098 -6.469 -1.350 1.00 72.41 C ATOM 0 HA ILE A 4 8.102 -2.951 -0.803 1.00 33.03 H new ATOM 0 HB ILE A 4 7.301 -5.025 0.683 1.00 10.30 H new ATOM 0 HG12 ILE A 4 4.939 -5.583 0.206 1.00 43.14 H new ATOM 0 HG13 ILE A 4 5.004 -4.639 -1.269 1.00 43.14 H new ATOM 0 HG21 ILE A 4 5.489 -3.608 1.566 1.00 21.15 H new ATOM 0 HG22 ILE A 4 6.960 -2.663 1.233 1.00 21.15 H new ATOM 0 HG23 ILE A 4 5.582 -2.589 0.109 1.00 21.15 H new ATOM 0 HD11 ILE A 4 5.248 -7.026 -1.744 1.00 72.41 H new ATOM 0 HD12 ILE A 4 6.736 -6.149 -2.174 1.00 72.41 H new ATOM 0 HD13 ILE A 4 6.669 -7.107 -0.676 1.00 72.41 H new ATOM 63 N ARG A 5 9.756 -4.919 -0.460 1.00 64.01 N ATOM 64 CA ARG A 5 10.874 -5.850 -0.564 1.00 75.04 C ATOM 65 C ARG A 5 10.399 -7.290 -0.390 1.00 43.13 C ATOM 66 O ARG A 5 9.232 -7.537 -0.087 1.00 13.31 O ATOM 67 CB ARG A 5 11.938 -5.522 0.484 1.00 20.12 C ATOM 68 CG ARG A 5 11.724 -6.231 1.811 1.00 25.44 C ATOM 69 CD ARG A 5 12.828 -5.900 2.804 1.00 72.10 C ATOM 70 NE ARG A 5 12.869 -4.475 3.121 1.00 45.05 N ATOM 71 CZ ARG A 5 11.964 -3.863 3.876 1.00 60.23 C ATOM 72 NH1 ARG A 5 10.952 -4.549 4.389 1.00 10.54 N ATOM 73 NH2 ARG A 5 12.070 -2.563 4.119 1.00 62.02 N ATOM 0 H ARG A 5 9.810 -4.283 0.335 1.00 64.01 H new ATOM 0 HA ARG A 5 11.310 -5.747 -1.558 1.00 75.04 H new ATOM 0 HB2 ARG A 5 12.918 -5.792 0.091 1.00 20.12 H new ATOM 0 HB3 ARG A 5 11.948 -4.445 0.654 1.00 20.12 H new ATOM 0 HG2 ARG A 5 10.759 -5.942 2.228 1.00 25.44 H new ATOM 0 HG3 ARG A 5 11.691 -7.308 1.648 1.00 25.44 H new ATOM 0 HD2 ARG A 5 12.675 -6.471 3.720 1.00 72.10 H new ATOM 0 HD3 ARG A 5 13.790 -6.208 2.393 1.00 72.10 H new ATOM 0 HE ARG A 5 13.635 -3.919 2.741 1.00 45.05 H new ATOM 0 HH11 ARG A 5 10.868 -5.549 4.204 1.00 10.54 H new ATOM 0 HH12 ARG A 5 10.258 -4.077 4.969 1.00 10.54 H new ATOM 0 HH21 ARG A 5 12.847 -2.032 3.726 1.00 62.02 H new ATOM 0 HH22 ARG A 5 11.374 -2.094 4.699 1.00 62.02 H new ATOM 87 N ILE A 6 11.312 -8.236 -0.585 1.00 2.51 N ATOM 88 CA ILE A 6 10.987 -9.650 -0.449 1.00 2.12 C ATOM 89 C ILE A 6 11.865 -10.317 0.605 1.00 15.43 C ATOM 90 O ILE A 6 11.443 -11.261 1.273 1.00 73.23 O ATOM 91 CB ILE A 6 11.153 -10.397 -1.786 1.00 12.25 C ATOM 92 CG1 ILE A 6 10.592 -9.558 -2.936 1.00 71.40 C ATOM 93 CG2 ILE A 6 10.463 -11.751 -1.724 1.00 73.35 C ATOM 94 CD1 ILE A 6 11.587 -8.571 -3.505 1.00 73.11 C ATOM 0 H ILE A 6 12.282 -8.048 -0.838 1.00 2.51 H new ATOM 0 HA ILE A 6 9.944 -9.705 -0.138 1.00 2.12 H new ATOM 0 HB ILE A 6 12.216 -10.561 -1.966 1.00 12.25 H new ATOM 0 HG12 ILE A 6 10.258 -10.224 -3.731 1.00 71.40 H new ATOM 0 HG13 ILE A 6 9.714 -9.015 -2.585 1.00 71.40 H new ATOM 0 HG21 ILE A 6 10.589 -12.267 -2.676 1.00 73.35 H new ATOM 0 HG22 ILE A 6 10.904 -12.348 -0.926 1.00 73.35 H new ATOM 0 HG23 ILE A 6 9.401 -11.609 -1.526 1.00 73.35 H new ATOM 0 HD11 ILE A 6 11.121 -8.011 -4.316 1.00 73.11 H new ATOM 0 HD12 ILE A 6 11.903 -7.881 -2.723 1.00 73.11 H new ATOM 0 HD13 ILE A 6 12.455 -9.109 -3.887 1.00 73.11 H new ATOM 106 N VAL A 7 13.088 -9.817 0.751 1.00 32.32 N ATOM 107 CA VAL A 7 14.025 -10.362 1.726 1.00 33.34 C ATOM 108 C VAL A 7 15.043 -9.312 2.156 1.00 30.44 C ATOM 109 O VAL A 7 16.012 -9.026 1.452 1.00 35.03 O ATOM 110 CB VAL A 7 14.772 -11.586 1.164 1.00 72.10 C ATOM 111 CG1 VAL A 7 13.873 -12.813 1.179 1.00 64.54 C ATOM 112 CG2 VAL A 7 15.277 -11.302 -0.242 1.00 54.55 C ATOM 0 H VAL A 7 13.453 -9.035 0.206 1.00 32.32 H new ATOM 0 HA VAL A 7 13.438 -10.670 2.591 1.00 33.34 H new ATOM 0 HB VAL A 7 15.633 -11.788 1.801 1.00 72.10 H new ATOM 0 HG11 VAL A 7 14.418 -13.668 0.778 1.00 64.54 H new ATOM 0 HG12 VAL A 7 13.565 -13.026 2.203 1.00 64.54 H new ATOM 0 HG13 VAL A 7 12.991 -12.625 0.567 1.00 64.54 H new ATOM 0 HG21 VAL A 7 15.802 -12.177 -0.624 1.00 54.55 H new ATOM 0 HG22 VAL A 7 14.433 -11.073 -0.892 1.00 54.55 H new ATOM 0 HG23 VAL A 7 15.958 -10.451 -0.219 1.00 54.55 H new ATOM 122 N PRO A 8 14.821 -8.724 3.341 1.00 5.41 N ATOM 123 CA PRO A 8 15.710 -7.696 3.893 1.00 72.31 C ATOM 124 C PRO A 8 17.060 -8.264 4.317 1.00 32.41 C ATOM 125 O PRO A 8 17.295 -9.468 4.218 1.00 71.20 O ATOM 126 CB PRO A 8 14.941 -7.179 5.111 1.00 35.31 C ATOM 127 CG PRO A 8 14.057 -8.311 5.509 1.00 54.51 C ATOM 128 CD PRO A 8 13.687 -9.016 4.233 1.00 1.23 C ATOM 0 HA PRO A 8 15.944 -6.924 3.160 1.00 72.31 H new ATOM 0 HB2 PRO A 8 15.618 -6.903 5.919 1.00 35.31 H new ATOM 0 HB3 PRO A 8 14.360 -6.290 4.864 1.00 35.31 H new ATOM 0 HG2 PRO A 8 14.571 -8.986 6.193 1.00 54.51 H new ATOM 0 HG3 PRO A 8 13.169 -7.949 6.027 1.00 54.51 H new ATOM 0 HD2 PRO A 8 13.563 -10.088 4.388 1.00 1.23 H new ATOM 0 HD3 PRO A 8 12.748 -8.642 3.825 1.00 1.23 H new ATOM 136 N GLN A 9 17.942 -7.390 4.790 1.00 63.21 N ATOM 137 CA GLN A 9 19.269 -7.806 5.229 1.00 60.31 C ATOM 138 C GLN A 9 19.202 -8.494 6.588 1.00 33.24 C ATOM 139 O GLN A 9 18.247 -8.306 7.343 1.00 22.13 O ATOM 140 CB GLN A 9 20.207 -6.600 5.300 1.00 23.33 C ATOM 141 CG GLN A 9 19.843 -5.610 6.394 1.00 13.33 C ATOM 142 CD GLN A 9 20.796 -4.433 6.457 1.00 1.32 C ATOM 143 OE1 GLN A 9 22.015 -4.605 6.448 1.00 62.32 O ATOM 144 NE2 GLN A 9 20.244 -3.227 6.522 1.00 44.55 N ATOM 0 H GLN A 9 17.762 -6.390 4.879 1.00 63.21 H new ATOM 0 HA GLN A 9 19.658 -8.518 4.501 1.00 60.31 H new ATOM 0 HB2 GLN A 9 21.226 -6.952 5.464 1.00 23.33 H new ATOM 0 HB3 GLN A 9 20.198 -6.086 4.339 1.00 23.33 H new ATOM 0 HG2 GLN A 9 18.830 -5.244 6.225 1.00 13.33 H new ATOM 0 HG3 GLN A 9 19.840 -6.122 7.356 1.00 13.33 H new ATOM 0 HE21 GLN A 9 19.229 -3.130 6.527 1.00 44.55 H new ATOM 0 HE22 GLN A 9 20.835 -2.397 6.567 1.00 44.55 H new ATOM 153 N ILE A 10 20.220 -9.291 6.894 1.00 71.55 N ATOM 154 CA ILE A 10 20.276 -10.007 8.162 1.00 11.44 C ATOM 155 C ILE A 10 21.407 -9.482 9.040 1.00 45.13 C ATOM 156 O ILE A 10 22.564 -9.436 8.620 1.00 63.04 O ATOM 157 CB ILE A 10 20.467 -11.520 7.948 1.00 0.30 C ATOM 158 CG1 ILE A 10 21.576 -11.776 6.926 1.00 42.13 C ATOM 159 CG2 ILE A 10 19.163 -12.159 7.495 1.00 62.24 C ATOM 160 CD1 ILE A 10 21.942 -13.237 6.784 1.00 11.22 C ATOM 0 H ILE A 10 21.018 -9.457 6.280 1.00 71.55 H new ATOM 0 HA ILE A 10 19.322 -9.838 8.662 1.00 11.44 H new ATOM 0 HB ILE A 10 20.761 -11.973 8.895 1.00 0.30 H new ATOM 0 HG12 ILE A 10 21.260 -11.393 5.956 1.00 42.13 H new ATOM 0 HG13 ILE A 10 22.464 -11.214 7.217 1.00 42.13 H new ATOM 0 HG21 ILE A 10 19.314 -13.228 7.348 1.00 62.24 H new ATOM 0 HG22 ILE A 10 18.397 -12.002 8.255 1.00 62.24 H new ATOM 0 HG23 ILE A 10 18.842 -11.705 6.557 1.00 62.24 H new ATOM 0 HD11 ILE A 10 22.734 -13.343 6.043 1.00 11.22 H new ATOM 0 HD12 ILE A 10 22.289 -13.620 7.744 1.00 11.22 H new ATOM 0 HD13 ILE A 10 21.067 -13.802 6.463 1.00 11.22 H new ATOM 172 N THR A 11 21.067 -9.088 10.263 1.00 52.32 N ATOM 173 CA THR A 11 22.053 -8.567 11.201 1.00 45.15 C ATOM 174 C THR A 11 22.683 -9.690 12.017 1.00 72.02 C ATOM 175 O THR A 11 22.498 -10.869 11.714 1.00 41.10 O ATOM 176 CB THR A 11 21.427 -7.538 12.161 1.00 24.20 C ATOM 177 OG1 THR A 11 20.111 -7.192 11.717 1.00 12.33 O ATOM 178 CG2 THR A 11 22.286 -6.285 12.246 1.00 34.12 C ATOM 0 H THR A 11 20.115 -9.120 10.627 1.00 52.32 H new ATOM 0 HA THR A 11 22.825 -8.076 10.608 1.00 45.15 H new ATOM 0 HB THR A 11 21.369 -7.987 13.153 1.00 24.20 H new ATOM 0 HG1 THR A 11 19.719 -6.539 12.333 1.00 12.33 H new ATOM 0 HG21 THR A 11 21.824 -5.573 12.930 1.00 34.12 H new ATOM 0 HG22 THR A 11 23.278 -6.548 12.612 1.00 34.12 H new ATOM 0 HG23 THR A 11 22.372 -5.835 11.257 1.00 34.12 H new ATOM 186 N ASP A 12 23.426 -9.317 13.053 1.00 71.12 N ATOM 187 CA ASP A 12 24.081 -10.294 13.915 1.00 65.05 C ATOM 188 C ASP A 12 23.053 -11.148 14.648 1.00 34.44 C ATOM 189 O ASP A 12 23.365 -12.238 15.127 1.00 3.12 O ATOM 190 CB ASP A 12 24.989 -9.588 14.923 1.00 23.30 C ATOM 191 CG ASP A 12 26.373 -10.205 14.988 1.00 75.52 C ATOM 192 OD1 ASP A 12 26.495 -11.334 15.509 1.00 55.33 O ATOM 193 OD2 ASP A 12 27.333 -9.560 14.518 1.00 3.15 O ATOM 0 H ASP A 12 23.590 -8.345 13.316 1.00 71.12 H new ATOM 0 HA ASP A 12 24.687 -10.947 13.287 1.00 65.05 H new ATOM 0 HB2 ASP A 12 25.076 -8.535 14.654 1.00 23.30 H new ATOM 0 HB3 ASP A 12 24.530 -9.628 15.911 1.00 23.30 H new ATOM 198 N GLU A 13 21.825 -10.645 14.733 1.00 21.12 N ATOM 199 CA GLU A 13 20.751 -11.362 15.411 1.00 63.23 C ATOM 200 C GLU A 13 20.182 -12.461 14.517 1.00 2.43 C ATOM 201 O GLU A 13 19.698 -13.481 15.004 1.00 32.53 O ATOM 202 CB GLU A 13 19.639 -10.394 15.818 1.00 0.42 C ATOM 203 CG GLU A 13 20.150 -9.116 16.462 1.00 2.13 C ATOM 204 CD GLU A 13 19.031 -8.169 16.850 1.00 74.53 C ATOM 205 OE1 GLU A 13 18.543 -7.434 15.967 1.00 55.14 O ATOM 206 OE2 GLU A 13 18.643 -8.165 18.037 1.00 55.02 O ATOM 0 H GLU A 13 21.549 -9.745 14.341 1.00 21.12 H new ATOM 0 HA GLU A 13 21.166 -11.824 16.307 1.00 63.23 H new ATOM 0 HB2 GLU A 13 19.052 -10.137 14.936 1.00 0.42 H new ATOM 0 HB3 GLU A 13 18.967 -10.897 16.513 1.00 0.42 H new ATOM 0 HG2 GLU A 13 20.731 -9.368 17.349 1.00 2.13 H new ATOM 0 HG3 GLU A 13 20.825 -8.611 15.771 1.00 2.13 H new ATOM 213 N GLU A 14 20.245 -12.242 13.208 1.00 53.35 N ATOM 214 CA GLU A 14 19.734 -13.212 12.246 1.00 23.23 C ATOM 215 C GLU A 14 20.857 -14.107 11.728 1.00 52.51 C ATOM 216 O GLU A 14 20.645 -15.285 11.443 1.00 21.51 O ATOM 217 CB GLU A 14 19.056 -12.496 11.076 1.00 22.33 C ATOM 218 CG GLU A 14 17.885 -11.622 11.494 1.00 63.54 C ATOM 219 CD GLU A 14 16.753 -12.420 12.111 1.00 22.05 C ATOM 220 OE1 GLU A 14 16.726 -13.654 11.926 1.00 61.52 O ATOM 221 OE2 GLU A 14 15.894 -11.809 12.781 1.00 4.23 O ATOM 0 H GLU A 14 20.644 -11.402 12.789 1.00 53.35 H new ATOM 0 HA GLU A 14 18.999 -13.837 12.754 1.00 23.23 H new ATOM 0 HB2 GLU A 14 19.793 -11.880 10.562 1.00 22.33 H new ATOM 0 HB3 GLU A 14 18.706 -13.239 10.359 1.00 22.33 H new ATOM 0 HG2 GLU A 14 18.231 -10.876 12.209 1.00 63.54 H new ATOM 0 HG3 GLU A 14 17.512 -11.081 10.624 1.00 63.54 H new ATOM 228 N PHE A 15 22.051 -13.537 11.607 1.00 4.15 N ATOM 229 CA PHE A 15 23.208 -14.281 11.122 1.00 52.10 C ATOM 230 C PHE A 15 23.683 -15.288 12.165 1.00 63.32 C ATOM 231 O PHE A 15 24.185 -16.361 11.826 1.00 13.41 O ATOM 232 CB PHE A 15 24.346 -13.322 10.767 1.00 53.30 C ATOM 233 CG PHE A 15 25.669 -14.006 10.575 1.00 72.21 C ATOM 234 CD1 PHE A 15 26.520 -14.212 11.649 1.00 53.01 C ATOM 235 CD2 PHE A 15 26.062 -14.443 9.320 1.00 31.32 C ATOM 236 CE1 PHE A 15 27.738 -14.842 11.476 1.00 52.13 C ATOM 237 CE2 PHE A 15 27.278 -15.074 9.141 1.00 24.20 C ATOM 238 CZ PHE A 15 28.118 -15.273 10.220 1.00 50.42 C ATOM 0 H PHE A 15 22.243 -12.562 11.838 1.00 4.15 H new ATOM 0 HA PHE A 15 22.909 -14.826 10.226 1.00 52.10 H new ATOM 0 HB2 PHE A 15 24.087 -12.786 9.854 1.00 53.30 H new ATOM 0 HB3 PHE A 15 24.442 -12.577 11.557 1.00 53.30 H new ATOM 0 HD1 PHE A 15 26.228 -13.876 12.633 1.00 53.01 H new ATOM 0 HD2 PHE A 15 25.411 -14.289 8.473 1.00 31.32 H new ATOM 0 HE1 PHE A 15 28.392 -14.997 12.322 1.00 52.13 H new ATOM 0 HE2 PHE A 15 27.572 -15.412 8.158 1.00 24.20 H new ATOM 0 HZ PHE A 15 29.070 -15.765 10.082 1.00 50.42 H new ATOM 248 N LYS A 16 23.523 -14.935 13.436 1.00 72.43 N ATOM 249 CA LYS A 16 23.934 -15.807 14.530 1.00 41.20 C ATOM 250 C LYS A 16 23.032 -17.034 14.617 1.00 63.04 C ATOM 251 O LYS A 16 23.313 -17.973 15.362 1.00 3.03 O ATOM 252 CB LYS A 16 23.903 -15.044 15.856 1.00 4.41 C ATOM 253 CG LYS A 16 22.501 -14.709 16.333 1.00 54.01 C ATOM 254 CD LYS A 16 22.512 -14.135 17.740 1.00 60.31 C ATOM 255 CE LYS A 16 22.762 -15.216 18.781 1.00 62.15 C ATOM 256 NZ LYS A 16 23.515 -14.693 19.954 1.00 14.51 N ATOM 0 H LYS A 16 23.111 -14.051 13.734 1.00 72.43 H new ATOM 0 HA LYS A 16 24.953 -16.140 14.332 1.00 41.20 H new ATOM 0 HB2 LYS A 16 24.405 -15.639 16.619 1.00 4.41 H new ATOM 0 HB3 LYS A 16 24.471 -14.120 15.747 1.00 4.41 H new ATOM 0 HG2 LYS A 16 22.045 -13.992 15.650 1.00 54.01 H new ATOM 0 HG3 LYS A 16 21.884 -15.607 16.310 1.00 54.01 H new ATOM 0 HD2 LYS A 16 23.284 -13.370 17.816 1.00 60.31 H new ATOM 0 HD3 LYS A 16 21.559 -13.647 17.942 1.00 60.31 H new ATOM 0 HE2 LYS A 16 21.809 -15.626 19.115 1.00 62.15 H new ATOM 0 HE3 LYS A 16 23.320 -16.035 18.327 1.00 62.15 H new ATOM 0 HZ1 LYS A 16 23.665 -15.460 20.640 1.00 14.51 H new ATOM 0 HZ2 LYS A 16 24.435 -14.325 19.640 1.00 14.51 H new ATOM 0 HZ3 LYS A 16 22.971 -13.928 20.403 1.00 14.51 H new ATOM 270 N THR A 17 21.948 -17.021 13.848 1.00 35.31 N ATOM 271 CA THR A 17 21.005 -18.133 13.838 1.00 40.11 C ATOM 272 C THR A 17 21.550 -19.308 13.034 1.00 33.23 C ATOM 273 O THR A 17 20.960 -20.389 13.020 1.00 13.02 O ATOM 274 CB THR A 17 19.645 -17.711 13.251 1.00 51.20 C ATOM 275 OG1 THR A 17 19.721 -17.664 11.822 1.00 44.21 O ATOM 276 CG2 THR A 17 19.223 -16.351 13.786 1.00 0.14 C ATOM 0 H THR A 17 21.701 -16.253 13.224 1.00 35.31 H new ATOM 0 HA THR A 17 20.866 -18.439 14.875 1.00 40.11 H new ATOM 0 HB THR A 17 18.901 -18.449 13.551 1.00 51.20 H new ATOM 0 HG1 THR A 17 20.290 -16.914 11.549 1.00 44.21 H new ATOM 0 HG21 THR A 17 18.260 -16.074 13.357 1.00 0.14 H new ATOM 0 HG22 THR A 17 19.137 -16.398 14.872 1.00 0.14 H new ATOM 0 HG23 THR A 17 19.969 -15.605 13.513 1.00 0.14 H new ATOM 284 N ILE A 18 22.678 -19.091 12.367 1.00 1.43 N ATOM 285 CA ILE A 18 23.303 -20.133 11.563 1.00 74.41 C ATOM 286 C ILE A 18 24.581 -20.643 12.220 1.00 35.43 C ATOM 287 O ILE A 18 25.451 -19.872 12.624 1.00 30.12 O ATOM 288 CB ILE A 18 23.634 -19.629 10.146 1.00 53.11 C ATOM 289 CG1 ILE A 18 22.357 -19.191 9.426 1.00 51.53 C ATOM 290 CG2 ILE A 18 24.351 -20.711 9.353 1.00 72.14 C ATOM 291 CD1 ILE A 18 22.198 -17.689 9.339 1.00 55.22 C ATOM 0 H ILE A 18 23.178 -18.202 12.368 1.00 1.43 H new ATOM 0 HA ILE A 18 22.584 -20.949 11.491 1.00 74.41 H new ATOM 0 HB ILE A 18 24.296 -18.767 10.228 1.00 53.11 H new ATOM 0 HG12 ILE A 18 22.356 -19.607 8.419 1.00 51.53 H new ATOM 0 HG13 ILE A 18 21.495 -19.610 9.945 1.00 51.53 H new ATOM 0 HG21 ILE A 18 24.578 -20.340 8.354 1.00 72.14 H new ATOM 0 HG22 ILE A 18 25.278 -20.980 9.860 1.00 72.14 H new ATOM 0 HG23 ILE A 18 23.711 -21.590 9.277 1.00 72.14 H new ATOM 0 HD11 ILE A 18 21.272 -17.451 8.816 1.00 55.22 H new ATOM 0 HD12 ILE A 18 22.167 -17.268 10.344 1.00 55.22 H new ATOM 0 HD13 ILE A 18 23.041 -17.265 8.794 1.00 55.22 H new ATOM 303 N PRO A 19 24.699 -21.975 12.329 1.00 31.04 N ATOM 304 CA PRO A 19 25.868 -22.619 12.935 1.00 44.20 C ATOM 305 C PRO A 19 27.118 -22.480 12.072 1.00 21.12 C ATOM 306 O PRO A 19 27.035 -22.420 10.845 1.00 32.33 O ATOM 307 CB PRO A 19 25.451 -24.088 13.039 1.00 53.31 C ATOM 308 CG PRO A 19 24.428 -24.267 11.971 1.00 74.01 C ATOM 309 CD PRO A 19 23.700 -22.955 11.870 1.00 44.24 C ATOM 0 HA PRO A 19 26.131 -22.168 13.892 1.00 44.20 H new ATOM 0 HB2 PRO A 19 26.302 -24.753 12.888 1.00 53.31 H new ATOM 0 HB3 PRO A 19 25.040 -24.314 14.023 1.00 53.31 H new ATOM 0 HG2 PRO A 19 24.896 -24.527 11.022 1.00 74.01 H new ATOM 0 HG3 PRO A 19 23.741 -25.076 12.220 1.00 74.01 H new ATOM 0 HD2 PRO A 19 23.377 -22.752 10.849 1.00 44.24 H new ATOM 0 HD3 PRO A 19 22.807 -22.942 12.495 1.00 44.24 H new ATOM 317 N LYS A 20 28.277 -22.430 12.721 1.00 54.11 N ATOM 318 CA LYS A 20 29.545 -22.300 12.014 1.00 60.14 C ATOM 319 C LYS A 20 29.742 -23.452 11.034 1.00 70.34 C ATOM 320 O LYS A 20 30.512 -23.343 10.079 1.00 30.31 O ATOM 321 CB LYS A 20 30.706 -22.260 13.010 1.00 41.43 C ATOM 322 CG LYS A 20 30.717 -23.429 13.979 1.00 40.01 C ATOM 323 CD LYS A 20 31.857 -23.315 14.977 1.00 63.51 C ATOM 324 CE LYS A 20 31.511 -22.365 16.112 1.00 5.55 C ATOM 325 NZ LYS A 20 31.868 -20.956 15.784 1.00 34.35 N ATOM 0 H LYS A 20 28.364 -22.478 13.736 1.00 54.11 H new ATOM 0 HA LYS A 20 29.525 -21.367 11.451 1.00 60.14 H new ATOM 0 HB2 LYS A 20 31.646 -22.247 12.459 1.00 41.43 H new ATOM 0 HB3 LYS A 20 30.656 -21.330 13.576 1.00 41.43 H new ATOM 0 HG2 LYS A 20 29.768 -23.469 14.513 1.00 40.01 H new ATOM 0 HG3 LYS A 20 30.810 -24.362 13.424 1.00 40.01 H new ATOM 0 HD2 LYS A 20 32.086 -24.300 15.383 1.00 63.51 H new ATOM 0 HD3 LYS A 20 32.754 -22.963 14.468 1.00 63.51 H new ATOM 0 HE2 LYS A 20 30.444 -22.429 16.327 1.00 5.55 H new ATOM 0 HE3 LYS A 20 32.037 -22.672 17.016 1.00 5.55 H new ATOM 0 HZ1 LYS A 20 32.489 -20.574 16.525 1.00 34.35 H new ATOM 0 HZ2 LYS A 20 32.362 -20.927 14.869 1.00 34.35 H new ATOM 0 HZ3 LYS A 20 31.002 -20.382 15.728 1.00 34.35 H new ATOM 339 N TYR A 21 29.041 -24.554 11.275 1.00 31.40 N ATOM 340 CA TYR A 21 29.140 -25.727 10.414 1.00 13.01 C ATOM 341 C TYR A 21 28.597 -25.427 9.020 1.00 13.23 C ATOM 342 O TYR A 21 28.957 -26.088 8.047 1.00 61.00 O ATOM 343 CB TYR A 21 28.377 -26.902 11.028 1.00 24.33 C ATOM 344 CG TYR A 21 28.965 -27.390 12.333 1.00 4.32 C ATOM 345 CD1 TYR A 21 28.662 -26.759 13.533 1.00 3.23 C ATOM 346 CD2 TYR A 21 29.823 -28.482 12.366 1.00 65.21 C ATOM 347 CE1 TYR A 21 29.198 -27.200 14.728 1.00 71.44 C ATOM 348 CE2 TYR A 21 30.363 -28.932 13.556 1.00 54.41 C ATOM 349 CZ TYR A 21 30.047 -28.287 14.734 1.00 63.12 C ATOM 350 OH TYR A 21 30.582 -28.731 15.922 1.00 53.03 O ATOM 0 H TYR A 21 28.398 -24.660 12.060 1.00 31.40 H new ATOM 0 HA TYR A 21 30.193 -25.993 10.325 1.00 13.01 H new ATOM 0 HB2 TYR A 21 27.342 -26.605 11.194 1.00 24.33 H new ATOM 0 HB3 TYR A 21 28.361 -27.727 10.315 1.00 24.33 H new ATOM 0 HD1 TYR A 21 27.996 -25.909 13.532 1.00 3.23 H new ATOM 0 HD2 TYR A 21 30.073 -28.988 11.445 1.00 65.21 H new ATOM 0 HE1 TYR A 21 28.954 -26.697 15.652 1.00 71.44 H new ATOM 0 HE2 TYR A 21 31.028 -29.783 13.564 1.00 54.41 H new ATOM 0 HH TYR A 21 31.158 -29.506 15.752 1.00 53.03 H new ATOM 360 N GLN A 22 27.728 -24.424 8.934 1.00 63.30 N ATOM 361 CA GLN A 22 27.135 -24.036 7.660 1.00 40.21 C ATOM 362 C GLN A 22 27.874 -22.847 7.055 1.00 2.44 C ATOM 363 O GLN A 22 28.108 -22.796 5.847 1.00 75.21 O ATOM 364 CB GLN A 22 25.656 -23.691 7.846 1.00 63.42 C ATOM 365 CG GLN A 22 24.843 -24.815 8.467 1.00 23.44 C ATOM 366 CD GLN A 22 24.476 -25.893 7.466 1.00 25.13 C ATOM 367 OE1 GLN A 22 25.349 -26.531 6.876 1.00 53.11 O ATOM 368 NE2 GLN A 22 23.180 -26.102 7.270 1.00 60.42 N ATOM 0 H GLN A 22 27.420 -23.866 9.731 1.00 63.30 H new ATOM 0 HA GLN A 22 27.221 -24.880 6.976 1.00 40.21 H new ATOM 0 HB2 GLN A 22 25.575 -22.804 8.475 1.00 63.42 H new ATOM 0 HB3 GLN A 22 25.226 -23.435 6.877 1.00 63.42 H new ATOM 0 HG2 GLN A 22 25.411 -25.261 9.283 1.00 23.44 H new ATOM 0 HG3 GLN A 22 23.932 -24.402 8.901 1.00 23.44 H new ATOM 0 HE21 GLN A 22 22.491 -25.550 7.781 1.00 60.42 H new ATOM 0 HE22 GLN A 22 22.873 -26.815 6.608 1.00 60.42 H new ATOM 377 N LEU A 23 28.240 -21.891 7.903 1.00 61.14 N ATOM 378 CA LEU A 23 28.953 -20.701 7.452 1.00 41.10 C ATOM 379 C LEU A 23 30.331 -21.065 6.907 1.00 14.12 C ATOM 380 O LEU A 23 30.670 -20.727 5.774 1.00 25.12 O ATOM 381 CB LEU A 23 29.094 -19.701 8.601 1.00 25.32 C ATOM 382 CG LEU A 23 27.835 -19.451 9.431 1.00 1.54 C ATOM 383 CD1 LEU A 23 28.158 -18.594 10.646 1.00 40.23 C ATOM 384 CD2 LEU A 23 26.759 -18.791 8.582 1.00 51.53 C ATOM 0 H LEU A 23 28.055 -21.917 8.906 1.00 61.14 H new ATOM 0 HA LEU A 23 28.375 -20.244 6.649 1.00 41.10 H new ATOM 0 HB2 LEU A 23 29.881 -20.053 9.268 1.00 25.32 H new ATOM 0 HB3 LEU A 23 29.428 -18.749 8.189 1.00 25.32 H new ATOM 0 HG LEU A 23 27.456 -20.412 9.780 1.00 1.54 H new ATOM 0 HD11 LEU A 23 27.250 -18.426 11.225 1.00 40.23 H new ATOM 0 HD12 LEU A 23 28.895 -19.105 11.266 1.00 40.23 H new ATOM 0 HD13 LEU A 23 28.561 -17.636 10.319 1.00 40.23 H new ATOM 0 HD21 LEU A 23 25.870 -18.621 9.189 1.00 51.53 H new ATOM 0 HD22 LEU A 23 27.128 -17.838 8.203 1.00 51.53 H new ATOM 0 HD23 LEU A 23 26.507 -19.441 7.744 1.00 51.53 H new ATOM 396 N GLY A 24 31.119 -21.759 7.722 1.00 5.44 N ATOM 397 CA GLY A 24 32.450 -22.159 7.304 1.00 61.11 C ATOM 398 C GLY A 24 33.377 -20.976 7.108 1.00 51.23 C ATOM 399 O GLY A 24 34.079 -20.569 8.033 1.00 1.23 O ATOM 0 H GLY A 24 30.860 -22.051 8.664 1.00 5.44 H new ATOM 0 HA2 GLY A 24 32.875 -22.830 8.050 1.00 61.11 H new ATOM 0 HA3 GLY A 24 32.381 -22.721 6.372 1.00 61.11 H new ATOM 403 N ARG A 25 33.381 -20.423 5.899 1.00 32.21 N ATOM 404 CA ARG A 25 34.231 -19.281 5.584 1.00 73.43 C ATOM 405 C ARG A 25 33.389 -18.060 5.225 1.00 4.14 C ATOM 406 O ARG A 25 33.878 -17.118 4.599 1.00 73.41 O ATOM 407 CB ARG A 25 35.172 -19.623 4.427 1.00 73.10 C ATOM 408 CG ARG A 25 35.863 -20.968 4.581 1.00 3.33 C ATOM 409 CD ARG A 25 36.944 -21.162 3.530 1.00 63.14 C ATOM 410 NE ARG A 25 38.009 -20.170 3.649 1.00 50.40 N ATOM 411 CZ ARG A 25 39.180 -20.270 3.030 1.00 22.13 C ATOM 412 NH1 ARG A 25 39.435 -21.313 2.253 1.00 65.14 N ATOM 413 NH2 ARG A 25 40.099 -19.326 3.189 1.00 53.33 N ATOM 0 H ARG A 25 32.805 -20.747 5.122 1.00 32.21 H new ATOM 0 HA ARG A 25 34.824 -19.045 6.468 1.00 73.43 H new ATOM 0 HB2 ARG A 25 34.605 -19.620 3.496 1.00 73.10 H new ATOM 0 HB3 ARG A 25 35.929 -18.843 4.342 1.00 73.10 H new ATOM 0 HG2 ARG A 25 36.304 -21.040 5.575 1.00 3.33 H new ATOM 0 HG3 ARG A 25 35.127 -21.768 4.500 1.00 3.33 H new ATOM 0 HD2 ARG A 25 37.368 -22.162 3.626 1.00 63.14 H new ATOM 0 HD3 ARG A 25 36.499 -21.099 2.537 1.00 63.14 H new ATOM 0 HE ARG A 25 37.845 -19.355 4.240 1.00 50.40 H new ATOM 0 HH11 ARG A 25 38.731 -22.041 2.129 1.00 65.14 H new ATOM 0 HH12 ARG A 25 40.335 -21.388 1.779 1.00 65.14 H new ATOM 0 HH21 ARG A 25 39.907 -18.522 3.787 1.00 53.33 H new ATOM 0 HH22 ARG A 25 40.998 -19.404 2.713 1.00 53.33 H new ATOM 427 N LEU A 26 32.123 -18.082 5.626 1.00 21.11 N ATOM 428 CA LEU A 26 31.213 -16.977 5.347 1.00 12.21 C ATOM 429 C LEU A 26 31.131 -16.025 6.536 1.00 24.03 C ATOM 430 O LEU A 26 31.466 -16.391 7.663 1.00 24.33 O ATOM 431 CB LEU A 26 29.819 -17.510 5.010 1.00 64.40 C ATOM 432 CG LEU A 26 29.498 -17.656 3.522 1.00 3.21 C ATOM 433 CD1 LEU A 26 29.075 -19.081 3.204 1.00 32.53 C ATOM 434 CD2 LEU A 26 28.413 -16.671 3.112 1.00 31.10 C ATOM 0 H LEU A 26 31.703 -18.853 6.145 1.00 21.11 H new ATOM 0 HA LEU A 26 31.602 -16.427 4.490 1.00 12.21 H new ATOM 0 HB2 LEU A 26 29.700 -18.484 5.484 1.00 64.40 H new ATOM 0 HB3 LEU A 26 29.080 -16.845 5.457 1.00 64.40 H new ATOM 0 HG LEU A 26 30.399 -17.431 2.952 1.00 3.21 H new ATOM 0 HD11 LEU A 26 28.851 -19.165 2.141 1.00 32.53 H new ATOM 0 HD12 LEU A 26 29.883 -19.766 3.460 1.00 32.53 H new ATOM 0 HD13 LEU A 26 28.187 -19.335 3.783 1.00 32.53 H new ATOM 0 HD21 LEU A 26 28.197 -16.789 2.050 1.00 31.10 H new ATOM 0 HD22 LEU A 26 27.509 -16.864 3.690 1.00 31.10 H new ATOM 0 HD23 LEU A 26 28.755 -15.654 3.302 1.00 31.10 H new ATOM 446 N THR A 27 30.682 -14.801 6.278 1.00 12.33 N ATOM 447 CA THR A 27 30.555 -13.796 7.327 1.00 71.43 C ATOM 448 C THR A 27 29.294 -12.961 7.138 1.00 41.21 C ATOM 449 O THR A 27 28.675 -12.985 6.074 1.00 54.35 O ATOM 450 CB THR A 27 31.778 -12.860 7.359 1.00 73.12 C ATOM 451 OG1 THR A 27 32.904 -13.504 6.752 1.00 54.22 O ATOM 452 CG2 THR A 27 32.121 -12.467 8.788 1.00 61.33 C ATOM 0 H THR A 27 30.400 -14.481 5.351 1.00 12.33 H new ATOM 0 HA THR A 27 30.493 -14.333 8.274 1.00 71.43 H new ATOM 0 HB THR A 27 31.532 -11.957 6.800 1.00 73.12 H new ATOM 0 HG1 THR A 27 33.677 -12.902 6.775 1.00 54.22 H new ATOM 0 HG21 THR A 27 32.988 -11.806 8.786 1.00 61.33 H new ATOM 0 HG22 THR A 27 31.272 -11.951 9.237 1.00 61.33 H new ATOM 0 HG23 THR A 27 32.349 -13.362 9.367 1.00 61.33 H new ATOM 460 N LEU A 28 28.919 -12.222 8.176 1.00 11.21 N ATOM 461 CA LEU A 28 27.731 -11.377 8.124 1.00 11.32 C ATOM 462 C LEU A 28 27.751 -10.484 6.888 1.00 43.23 C ATOM 463 O LEU A 28 26.731 -10.305 6.223 1.00 64.40 O ATOM 464 CB LEU A 28 27.637 -10.518 9.386 1.00 14.53 C ATOM 465 CG LEU A 28 26.290 -10.534 10.110 1.00 11.13 C ATOM 466 CD1 LEU A 28 26.492 -10.684 11.610 1.00 30.11 C ATOM 467 CD2 LEU A 28 25.502 -9.269 9.800 1.00 24.15 C ATOM 0 H LEU A 28 29.420 -12.191 9.064 1.00 11.21 H new ATOM 0 HA LEU A 28 26.857 -12.025 8.067 1.00 11.32 H new ATOM 0 HB2 LEU A 28 28.406 -10.848 10.084 1.00 14.53 H new ATOM 0 HB3 LEU A 28 27.871 -9.488 9.118 1.00 14.53 H new ATOM 0 HG LEU A 28 25.718 -11.391 9.753 1.00 11.13 H new ATOM 0 HD11 LEU A 28 25.523 -10.693 12.109 1.00 30.11 H new ATOM 0 HD12 LEU A 28 27.015 -11.618 11.815 1.00 30.11 H new ATOM 0 HD13 LEU A 28 27.084 -9.848 11.983 1.00 30.11 H new ATOM 0 HD21 LEU A 28 24.546 -9.298 10.324 1.00 24.15 H new ATOM 0 HD22 LEU A 28 26.069 -8.398 10.128 1.00 24.15 H new ATOM 0 HD23 LEU A 28 25.325 -9.204 8.726 1.00 24.15 H new ATOM 479 N GLU A 29 28.920 -9.927 6.585 1.00 21.40 N ATOM 480 CA GLU A 29 29.073 -9.054 5.427 1.00 33.31 C ATOM 481 C GLU A 29 28.754 -9.802 4.136 1.00 62.52 C ATOM 482 O GLU A 29 28.132 -9.255 3.226 1.00 11.23 O ATOM 483 CB GLU A 29 30.495 -8.494 5.367 1.00 1.31 C ATOM 484 CG GLU A 29 30.752 -7.614 4.155 1.00 21.02 C ATOM 485 CD GLU A 29 31.064 -6.179 4.532 1.00 51.43 C ATOM 486 OE1 GLU A 29 30.116 -5.430 4.850 1.00 60.21 O ATOM 487 OE2 GLU A 29 32.255 -5.804 4.508 1.00 13.31 O ATOM 0 H GLU A 29 29.774 -10.065 7.125 1.00 21.40 H new ATOM 0 HA GLU A 29 28.369 -8.228 5.531 1.00 33.31 H new ATOM 0 HB2 GLU A 29 30.688 -7.917 6.272 1.00 1.31 H new ATOM 0 HB3 GLU A 29 31.203 -9.323 5.360 1.00 1.31 H new ATOM 0 HG2 GLU A 29 31.584 -8.024 3.582 1.00 21.02 H new ATOM 0 HG3 GLU A 29 29.877 -7.633 3.505 1.00 21.02 H new ATOM 494 N MET A 30 29.186 -11.057 4.064 1.00 65.11 N ATOM 495 CA MET A 30 28.947 -11.881 2.885 1.00 61.13 C ATOM 496 C MET A 30 27.453 -12.093 2.664 1.00 32.41 C ATOM 497 O MET A 30 26.962 -11.997 1.539 1.00 24.35 O ATOM 498 CB MET A 30 29.650 -13.232 3.029 1.00 63.11 C ATOM 499 CG MET A 30 31.152 -13.117 3.232 1.00 43.12 C ATOM 500 SD MET A 30 32.063 -14.472 2.467 1.00 74.40 S ATOM 501 CE MET A 30 33.582 -13.643 2.008 1.00 63.22 C ATOM 0 H MET A 30 29.703 -11.525 4.808 1.00 65.11 H new ATOM 0 HA MET A 30 29.354 -11.359 2.019 1.00 61.13 H new ATOM 0 HB2 MET A 30 29.218 -13.769 3.873 1.00 63.11 H new ATOM 0 HB3 MET A 30 29.457 -13.830 2.138 1.00 63.11 H new ATOM 0 HG2 MET A 30 31.499 -12.171 2.817 1.00 43.12 H new ATOM 0 HG3 MET A 30 31.370 -13.095 4.300 1.00 43.12 H new ATOM 0 HE1 MET A 30 33.896 -13.979 1.020 1.00 63.22 H new ATOM 0 HE2 MET A 30 33.417 -12.566 1.990 1.00 63.22 H new ATOM 0 HE3 MET A 30 34.359 -13.879 2.735 1.00 63.22 H new ATOM 511 N MET A 31 26.735 -12.383 3.744 1.00 11.34 N ATOM 512 CA MET A 31 25.296 -12.608 3.668 1.00 40.44 C ATOM 513 C MET A 31 24.548 -11.289 3.499 1.00 31.00 C ATOM 514 O MET A 31 23.551 -11.218 2.782 1.00 35.14 O ATOM 515 CB MET A 31 24.803 -13.330 4.923 1.00 25.00 C ATOM 516 CG MET A 31 25.179 -14.802 4.964 1.00 62.43 C ATOM 517 SD MET A 31 23.988 -15.798 5.880 1.00 31.15 S ATOM 518 CE MET A 31 25.047 -16.534 7.123 1.00 20.13 C ATOM 0 H MET A 31 27.126 -12.468 4.682 1.00 11.34 H new ATOM 0 HA MET A 31 25.097 -13.233 2.797 1.00 40.44 H new ATOM 0 HB2 MET A 31 25.213 -12.834 5.803 1.00 25.00 H new ATOM 0 HB3 MET A 31 23.718 -13.239 4.982 1.00 25.00 H new ATOM 0 HG2 MET A 31 25.257 -15.182 3.945 1.00 62.43 H new ATOM 0 HG3 MET A 31 26.163 -14.909 5.420 1.00 62.43 H new ATOM 0 HE1 MET A 31 25.030 -17.619 7.019 1.00 20.13 H new ATOM 0 HE2 MET A 31 26.067 -16.173 6.992 1.00 20.13 H new ATOM 0 HE3 MET A 31 24.689 -16.259 8.115 1.00 20.13 H new ATOM 528 N ASN A 32 25.036 -10.247 4.164 1.00 24.33 N ATOM 529 CA ASN A 32 24.413 -8.931 4.088 1.00 32.13 C ATOM 530 C ASN A 32 24.313 -8.459 2.641 1.00 62.21 C ATOM 531 O ASN A 32 23.297 -7.900 2.229 1.00 63.40 O ATOM 532 CB ASN A 32 25.209 -7.918 4.913 1.00 21.12 C ATOM 533 CG ASN A 32 24.490 -6.589 5.048 1.00 65.43 C ATOM 534 OD1 ASN A 32 23.962 -6.056 4.072 1.00 13.44 O ATOM 535 ND2 ASN A 32 24.469 -6.049 6.260 1.00 14.14 N ATOM 0 H ASN A 32 25.861 -10.289 4.762 1.00 24.33 H new ATOM 0 HA ASN A 32 23.405 -9.010 4.496 1.00 32.13 H new ATOM 0 HB2 ASN A 32 25.397 -8.329 5.905 1.00 21.12 H new ATOM 0 HB3 ASN A 32 26.181 -7.757 4.446 1.00 21.12 H new ATOM 0 HD21 ASN A 32 24.001 -5.155 6.412 1.00 14.14 H new ATOM 0 HD22 ASN A 32 24.920 -6.528 7.039 1.00 14.14 H new ATOM 542 N GLU A 33 25.375 -8.689 1.875 1.00 41.12 N ATOM 543 CA GLU A 33 25.407 -8.287 0.474 1.00 54.25 C ATOM 544 C GLU A 33 24.642 -9.281 -0.395 1.00 74.12 C ATOM 545 O GLU A 33 24.060 -8.911 -1.416 1.00 4.23 O ATOM 546 CB GLU A 33 26.852 -8.173 -0.015 1.00 2.20 C ATOM 547 CG GLU A 33 27.663 -9.443 0.181 1.00 52.11 C ATOM 548 CD GLU A 33 29.157 -9.202 0.087 1.00 11.31 C ATOM 549 OE1 GLU A 33 29.640 -8.892 -1.022 1.00 10.42 O ATOM 550 OE2 GLU A 33 29.843 -9.323 1.124 1.00 50.13 O ATOM 0 H GLU A 33 26.224 -9.151 2.201 1.00 41.12 H new ATOM 0 HA GLU A 33 24.926 -7.313 0.392 1.00 54.25 H new ATOM 0 HB2 GLU A 33 26.849 -7.914 -1.074 1.00 2.20 H new ATOM 0 HB3 GLU A 33 27.342 -7.354 0.512 1.00 2.20 H new ATOM 0 HG2 GLU A 33 27.429 -9.872 1.155 1.00 52.11 H new ATOM 0 HG3 GLU A 33 27.369 -10.177 -0.570 1.00 52.11 H new ATOM 557 N ILE A 34 24.647 -10.544 0.017 1.00 61.31 N ATOM 558 CA ILE A 34 23.954 -11.592 -0.723 1.00 12.44 C ATOM 559 C ILE A 34 22.442 -11.404 -0.655 1.00 40.53 C ATOM 560 O ILE A 34 21.750 -11.482 -1.670 1.00 51.04 O ATOM 561 CB ILE A 34 24.310 -12.990 -0.185 1.00 61.45 C ATOM 562 CG1 ILE A 34 25.715 -13.392 -0.640 1.00 31.34 C ATOM 563 CG2 ILE A 34 23.284 -14.013 -0.650 1.00 64.31 C ATOM 564 CD1 ILE A 34 26.347 -14.460 0.226 1.00 45.52 C ATOM 0 H ILE A 34 25.123 -10.867 0.859 1.00 61.31 H new ATOM 0 HA ILE A 34 24.282 -11.516 -1.760 1.00 12.44 H new ATOM 0 HB ILE A 34 24.296 -12.959 0.904 1.00 61.45 H new ATOM 0 HG12 ILE A 34 25.667 -13.751 -1.668 1.00 31.34 H new ATOM 0 HG13 ILE A 34 26.355 -12.510 -0.640 1.00 31.34 H new ATOM 0 HG21 ILE A 34 23.549 -14.996 -0.262 1.00 64.31 H new ATOM 0 HG22 ILE A 34 22.297 -13.732 -0.282 1.00 64.31 H new ATOM 0 HG23 ILE A 34 23.270 -14.045 -1.739 1.00 64.31 H new ATOM 0 HD11 ILE A 34 27.341 -14.696 -0.154 1.00 45.52 H new ATOM 0 HD12 ILE A 34 26.427 -14.097 1.251 1.00 45.52 H new ATOM 0 HD13 ILE A 34 25.729 -15.357 0.206 1.00 45.52 H new ATOM 576 N VAL A 35 21.935 -11.153 0.548 1.00 43.12 N ATOM 577 CA VAL A 35 20.505 -10.950 0.748 1.00 24.11 C ATOM 578 C VAL A 35 20.067 -9.583 0.236 1.00 42.23 C ATOM 579 O VAL A 35 18.921 -9.400 -0.173 1.00 73.05 O ATOM 580 CB VAL A 35 20.124 -11.076 2.235 1.00 54.40 C ATOM 581 CG1 VAL A 35 18.621 -11.259 2.387 1.00 2.30 C ATOM 582 CG2 VAL A 35 20.878 -12.227 2.883 1.00 54.11 C ATOM 0 H VAL A 35 22.494 -11.085 1.399 1.00 43.12 H new ATOM 0 HA VAL A 35 19.992 -11.727 0.182 1.00 24.11 H new ATOM 0 HB VAL A 35 20.407 -10.155 2.744 1.00 54.40 H new ATOM 0 HG11 VAL A 35 18.370 -11.346 3.444 1.00 2.30 H new ATOM 0 HG12 VAL A 35 18.105 -10.398 1.961 1.00 2.30 H new ATOM 0 HG13 VAL A 35 18.310 -12.164 1.864 1.00 2.30 H new ATOM 0 HG21 VAL A 35 20.596 -12.301 3.933 1.00 54.11 H new ATOM 0 HG22 VAL A 35 20.628 -13.158 2.374 1.00 54.11 H new ATOM 0 HG23 VAL A 35 21.951 -12.048 2.807 1.00 54.11 H new ATOM 592 N SER A 36 20.988 -8.625 0.261 1.00 40.43 N ATOM 593 CA SER A 36 20.696 -7.272 -0.198 1.00 41.33 C ATOM 594 C SER A 36 20.574 -7.228 -1.718 1.00 73.35 C ATOM 595 O SER A 36 19.574 -6.755 -2.260 1.00 23.02 O ATOM 596 CB SER A 36 21.789 -6.306 0.264 1.00 21.44 C ATOM 597 OG SER A 36 21.902 -5.203 -0.618 1.00 11.04 O ATOM 0 H SER A 36 21.942 -8.761 0.594 1.00 40.43 H new ATOM 0 HA SER A 36 19.744 -6.967 0.235 1.00 41.33 H new ATOM 0 HB2 SER A 36 21.563 -5.950 1.269 1.00 21.44 H new ATOM 0 HB3 SER A 36 22.743 -6.831 0.319 1.00 21.44 H new ATOM 0 HG SER A 36 22.606 -4.600 -0.299 1.00 11.04 H new ATOM 603 N LYS A 37 21.598 -7.726 -2.402 1.00 44.05 N ATOM 604 CA LYS A 37 21.608 -7.747 -3.860 1.00 50.44 C ATOM 605 C LYS A 37 20.458 -8.591 -4.400 1.00 62.21 C ATOM 606 O LYS A 37 19.687 -8.138 -5.245 1.00 74.30 O ATOM 607 CB LYS A 37 22.942 -8.293 -4.374 1.00 74.35 C ATOM 608 CG LYS A 37 23.789 -7.256 -5.089 1.00 45.54 C ATOM 609 CD LYS A 37 23.052 -6.652 -6.273 1.00 61.41 C ATOM 610 CE LYS A 37 23.844 -5.517 -6.903 1.00 53.31 C ATOM 611 NZ LYS A 37 23.998 -4.365 -5.972 1.00 10.21 N ATOM 0 H LYS A 37 22.433 -8.121 -1.969 1.00 44.05 H new ATOM 0 HA LYS A 37 21.481 -6.724 -4.214 1.00 50.44 H new ATOM 0 HB2 LYS A 37 23.508 -8.695 -3.534 1.00 74.35 H new ATOM 0 HB3 LYS A 37 22.748 -9.122 -5.054 1.00 74.35 H new ATOM 0 HG2 LYS A 37 24.065 -6.466 -4.390 1.00 45.54 H new ATOM 0 HG3 LYS A 37 24.715 -7.716 -5.433 1.00 45.54 H new ATOM 0 HD2 LYS A 37 22.865 -7.424 -7.019 1.00 61.41 H new ATOM 0 HD3 LYS A 37 22.080 -6.282 -5.947 1.00 61.41 H new ATOM 0 HE2 LYS A 37 24.829 -5.881 -7.197 1.00 53.31 H new ATOM 0 HE3 LYS A 37 23.342 -5.185 -7.812 1.00 53.31 H new ATOM 0 HZ1 LYS A 37 24.294 -3.524 -6.507 1.00 10.21 H new ATOM 0 HZ2 LYS A 37 23.090 -4.175 -5.502 1.00 10.21 H new ATOM 0 HZ3 LYS A 37 24.717 -4.591 -5.256 1.00 10.21 H new ATOM 625 N MET A 38 20.350 -9.820 -3.905 1.00 55.14 N ATOM 626 CA MET A 38 19.292 -10.726 -4.337 1.00 33.22 C ATOM 627 C MET A 38 17.921 -10.074 -4.184 1.00 22.10 C ATOM 628 O MET A 38 17.058 -10.210 -5.052 1.00 25.13 O ATOM 629 CB MET A 38 19.344 -12.026 -3.531 1.00 12.41 C ATOM 630 CG MET A 38 18.601 -11.950 -2.207 1.00 1.32 C ATOM 631 SD MET A 38 18.597 -13.521 -1.322 1.00 14.31 S ATOM 632 CE MET A 38 16.993 -14.168 -1.789 1.00 41.20 C ATOM 0 H MET A 38 20.981 -10.211 -3.206 1.00 55.14 H new ATOM 0 HA MET A 38 19.451 -10.953 -5.391 1.00 33.22 H new ATOM 0 HB2 MET A 38 18.921 -12.832 -4.130 1.00 12.41 H new ATOM 0 HB3 MET A 38 20.386 -12.284 -3.340 1.00 12.41 H new ATOM 0 HG2 MET A 38 19.060 -11.186 -1.580 1.00 1.32 H new ATOM 0 HG3 MET A 38 17.573 -11.637 -2.389 1.00 1.32 H new ATOM 0 HE1 MET A 38 17.083 -15.228 -2.027 1.00 41.20 H new ATOM 0 HE2 MET A 38 16.294 -14.040 -0.962 1.00 41.20 H new ATOM 0 HE3 MET A 38 16.624 -13.630 -2.663 1.00 41.20 H new ATOM 642 N ASP A 39 17.728 -9.367 -3.076 1.00 51.33 N ATOM 643 CA ASP A 39 16.462 -8.693 -2.811 1.00 2.25 C ATOM 644 C ASP A 39 16.249 -7.535 -3.781 1.00 34.30 C ATOM 645 O ASP A 39 15.113 -7.183 -4.102 1.00 5.43 O ATOM 646 CB ASP A 39 16.425 -8.180 -1.370 1.00 25.30 C ATOM 647 CG ASP A 39 15.043 -7.716 -0.956 1.00 0.03 C ATOM 648 OD1 ASP A 39 14.052 -8.228 -1.517 1.00 33.30 O ATOM 649 OD2 ASP A 39 14.952 -6.841 -0.070 1.00 3.03 O ATOM 0 H ASP A 39 18.431 -9.246 -2.347 1.00 51.33 H new ATOM 0 HA ASP A 39 15.658 -9.415 -2.953 1.00 2.25 H new ATOM 0 HB2 ASP A 39 16.756 -8.971 -0.697 1.00 25.30 H new ATOM 0 HB3 ASP A 39 17.129 -7.355 -1.263 1.00 25.30 H new ATOM 654 N ASP A 40 17.346 -6.948 -4.244 1.00 5.12 N ATOM 655 CA ASP A 40 17.280 -5.830 -5.178 1.00 13.12 C ATOM 656 C ASP A 40 16.714 -6.278 -6.522 1.00 14.43 C ATOM 657 O ASP A 40 15.854 -5.611 -7.098 1.00 35.11 O ATOM 658 CB ASP A 40 18.667 -5.217 -5.373 1.00 65.54 C ATOM 659 CG ASP A 40 18.648 -4.026 -6.311 1.00 33.31 C ATOM 660 OD1 ASP A 40 17.701 -3.217 -6.222 1.00 53.43 O ATOM 661 OD2 ASP A 40 19.580 -3.903 -7.133 1.00 34.13 O ATOM 0 H ASP A 40 18.293 -7.228 -3.988 1.00 5.12 H new ATOM 0 HA ASP A 40 16.615 -5.076 -4.757 1.00 13.12 H new ATOM 0 HB2 ASP A 40 19.063 -4.908 -4.406 1.00 65.54 H new ATOM 0 HB3 ASP A 40 19.344 -5.975 -5.767 1.00 65.54 H new ATOM 666 N PHE A 41 17.203 -7.410 -7.016 1.00 54.14 N ATOM 667 CA PHE A 41 16.747 -7.946 -8.294 1.00 1.22 C ATOM 668 C PHE A 41 15.296 -8.408 -8.203 1.00 53.12 C ATOM 669 O PHE A 41 14.492 -8.147 -9.100 1.00 31.25 O ATOM 670 CB PHE A 41 17.639 -9.110 -8.729 1.00 73.45 C ATOM 671 CG PHE A 41 17.254 -9.696 -10.058 1.00 52.42 C ATOM 672 CD1 PHE A 41 16.537 -8.947 -10.978 1.00 63.22 C ATOM 673 CD2 PHE A 41 17.609 -10.994 -10.387 1.00 51.34 C ATOM 674 CE1 PHE A 41 16.181 -9.484 -12.201 1.00 43.41 C ATOM 675 CE2 PHE A 41 17.256 -11.535 -11.609 1.00 60.41 C ATOM 676 CZ PHE A 41 16.542 -10.779 -12.518 1.00 1.25 C ATOM 0 H PHE A 41 17.915 -7.974 -6.552 1.00 54.14 H new ATOM 0 HA PHE A 41 16.810 -7.151 -9.037 1.00 1.22 H new ATOM 0 HB2 PHE A 41 18.672 -8.767 -8.778 1.00 73.45 H new ATOM 0 HB3 PHE A 41 17.598 -9.892 -7.971 1.00 73.45 H new ATOM 0 HD1 PHE A 41 16.254 -7.933 -10.737 1.00 63.22 H new ATOM 0 HD2 PHE A 41 18.168 -11.590 -9.681 1.00 51.34 H new ATOM 0 HE1 PHE A 41 15.621 -8.891 -12.909 1.00 43.41 H new ATOM 0 HE2 PHE A 41 17.538 -12.548 -11.853 1.00 60.41 H new ATOM 0 HZ PHE A 41 16.267 -11.199 -13.474 1.00 1.25 H new ATOM 686 N LEU A 42 14.967 -9.096 -7.115 1.00 41.14 N ATOM 687 CA LEU A 42 13.613 -9.596 -6.906 1.00 53.24 C ATOM 688 C LEU A 42 12.654 -8.453 -6.588 1.00 75.24 C ATOM 689 O LEU A 42 11.454 -8.547 -6.847 1.00 10.22 O ATOM 690 CB LEU A 42 13.596 -10.622 -5.772 1.00 10.43 C ATOM 691 CG LEU A 42 13.029 -11.998 -6.120 1.00 30.42 C ATOM 692 CD1 LEU A 42 11.509 -11.963 -6.128 1.00 34.14 C ATOM 693 CD2 LEU A 42 13.560 -12.469 -7.466 1.00 23.22 C ATOM 0 H LEU A 42 15.620 -9.320 -6.364 1.00 41.14 H new ATOM 0 HA LEU A 42 13.283 -10.077 -7.827 1.00 53.24 H new ATOM 0 HB2 LEU A 42 14.616 -10.752 -5.412 1.00 10.43 H new ATOM 0 HB3 LEU A 42 13.016 -10.211 -4.946 1.00 10.43 H new ATOM 0 HG LEU A 42 13.352 -12.706 -5.356 1.00 30.42 H new ATOM 0 HD11 LEU A 42 11.124 -12.952 -6.378 1.00 34.14 H new ATOM 0 HD12 LEU A 42 11.147 -11.671 -5.142 1.00 34.14 H new ATOM 0 HD13 LEU A 42 11.166 -11.242 -6.870 1.00 34.14 H new ATOM 0 HD21 LEU A 42 13.146 -13.450 -7.697 1.00 23.22 H new ATOM 0 HD22 LEU A 42 13.268 -11.760 -8.241 1.00 23.22 H new ATOM 0 HD23 LEU A 42 14.647 -12.535 -7.425 1.00 23.22 H new ATOM 705 N MET A 43 13.191 -7.375 -6.028 1.00 42.32 N ATOM 706 CA MET A 43 12.383 -6.212 -5.678 1.00 61.34 C ATOM 707 C MET A 43 11.937 -5.464 -6.930 1.00 41.44 C ATOM 708 O MET A 43 10.790 -5.028 -7.030 1.00 72.13 O ATOM 709 CB MET A 43 13.171 -5.274 -4.762 1.00 53.23 C ATOM 710 CG MET A 43 12.500 -3.926 -4.551 1.00 71.22 C ATOM 711 SD MET A 43 10.899 -4.068 -3.733 1.00 44.40 S ATOM 712 CE MET A 43 10.813 -2.493 -2.884 1.00 54.33 C ATOM 0 H MET A 43 14.182 -7.282 -5.807 1.00 42.32 H new ATOM 0 HA MET A 43 11.496 -6.562 -5.150 1.00 61.34 H new ATOM 0 HB2 MET A 43 13.311 -5.757 -3.795 1.00 53.23 H new ATOM 0 HB3 MET A 43 14.163 -5.115 -5.185 1.00 53.23 H new ATOM 0 HG2 MET A 43 13.153 -3.289 -3.955 1.00 71.22 H new ATOM 0 HG3 MET A 43 12.369 -3.435 -5.515 1.00 71.22 H new ATOM 0 HE1 MET A 43 9.876 -2.429 -2.330 1.00 54.33 H new ATOM 0 HE2 MET A 43 11.650 -2.407 -2.192 1.00 54.33 H new ATOM 0 HE3 MET A 43 10.860 -1.684 -3.613 1.00 54.33 H new ATOM 722 N LYS A 44 12.851 -5.317 -7.884 1.00 10.24 N ATOM 723 CA LYS A 44 12.552 -4.622 -9.130 1.00 43.30 C ATOM 724 C LYS A 44 11.637 -5.461 -10.015 1.00 61.35 C ATOM 725 O LYS A 44 10.748 -4.934 -10.684 1.00 42.24 O ATOM 726 CB LYS A 44 13.846 -4.296 -9.879 1.00 65.53 C ATOM 727 CG LYS A 44 14.702 -5.517 -10.174 1.00 12.42 C ATOM 728 CD LYS A 44 15.882 -5.168 -11.065 1.00 24.14 C ATOM 729 CE LYS A 44 16.776 -4.119 -10.421 1.00 20.12 C ATOM 730 NZ LYS A 44 17.414 -4.624 -9.174 1.00 25.12 N ATOM 0 H LYS A 44 13.805 -5.670 -7.817 1.00 10.24 H new ATOM 0 HA LYS A 44 12.038 -3.693 -8.884 1.00 43.30 H new ATOM 0 HB2 LYS A 44 13.598 -3.801 -10.818 1.00 65.53 H new ATOM 0 HB3 LYS A 44 14.429 -3.588 -9.290 1.00 65.53 H new ATOM 0 HG2 LYS A 44 15.065 -5.943 -9.239 1.00 12.42 H new ATOM 0 HG3 LYS A 44 14.093 -6.281 -10.657 1.00 12.42 H new ATOM 0 HD2 LYS A 44 16.463 -6.067 -11.269 1.00 24.14 H new ATOM 0 HD3 LYS A 44 15.518 -4.799 -12.024 1.00 24.14 H new ATOM 0 HE2 LYS A 44 17.549 -3.817 -11.128 1.00 20.12 H new ATOM 0 HE3 LYS A 44 16.187 -3.230 -10.194 1.00 20.12 H new ATOM 0 HZ1 LYS A 44 18.092 -3.919 -8.821 1.00 25.12 H new ATOM 0 HZ2 LYS A 44 16.683 -4.792 -8.454 1.00 25.12 H new ATOM 0 HZ3 LYS A 44 17.913 -5.514 -9.375 1.00 25.12 H new ATOM 744 N LYS A 45 11.859 -6.771 -10.014 1.00 61.31 N ATOM 745 CA LYS A 45 11.053 -7.685 -10.815 1.00 21.33 C ATOM 746 C LYS A 45 9.597 -7.667 -10.361 1.00 11.40 C ATOM 747 O LYS A 45 8.689 -7.455 -11.165 1.00 20.31 O ATOM 748 CB LYS A 45 11.610 -9.107 -10.718 1.00 62.43 C ATOM 749 CG LYS A 45 11.124 -10.027 -11.825 1.00 33.54 C ATOM 750 CD LYS A 45 10.824 -11.421 -11.299 1.00 62.41 C ATOM 751 CE LYS A 45 10.769 -12.442 -12.426 1.00 3.23 C ATOM 752 NZ LYS A 45 11.596 -13.644 -12.126 1.00 14.11 N ATOM 0 H LYS A 45 12.591 -7.224 -9.467 1.00 61.31 H new ATOM 0 HA LYS A 45 11.096 -7.354 -11.853 1.00 21.33 H new ATOM 0 HB2 LYS A 45 12.699 -9.064 -10.744 1.00 62.43 H new ATOM 0 HB3 LYS A 45 11.331 -9.533 -9.754 1.00 62.43 H new ATOM 0 HG2 LYS A 45 10.227 -9.608 -12.280 1.00 33.54 H new ATOM 0 HG3 LYS A 45 11.880 -10.087 -12.608 1.00 33.54 H new ATOM 0 HD2 LYS A 45 11.589 -11.712 -10.580 1.00 62.41 H new ATOM 0 HD3 LYS A 45 9.873 -11.413 -10.767 1.00 62.41 H new ATOM 0 HE2 LYS A 45 9.735 -12.745 -12.592 1.00 3.23 H new ATOM 0 HE3 LYS A 45 11.119 -11.982 -13.350 1.00 3.23 H new ATOM 0 HZ1 LYS A 45 11.240 -14.455 -12.670 1.00 14.11 H new ATOM 0 HZ2 LYS A 45 12.585 -13.459 -12.388 1.00 14.11 H new ATOM 0 HZ3 LYS A 45 11.541 -13.858 -11.110 1.00 14.11 H new ATOM 766 N SER A 46 9.382 -7.888 -9.068 1.00 52.50 N ATOM 767 CA SER A 46 8.035 -7.898 -8.508 1.00 64.30 C ATOM 768 C SER A 46 7.360 -6.543 -8.692 1.00 11.34 C ATOM 769 O SER A 46 6.135 -6.453 -8.780 1.00 42.45 O ATOM 770 CB SER A 46 8.081 -8.261 -7.022 1.00 60.15 C ATOM 771 OG SER A 46 6.822 -8.731 -6.573 1.00 53.14 O ATOM 0 H SER A 46 10.123 -8.062 -8.389 1.00 52.50 H new ATOM 0 HA SER A 46 7.452 -8.649 -9.040 1.00 64.30 H new ATOM 0 HB2 SER A 46 8.839 -9.026 -6.855 1.00 60.15 H new ATOM 0 HB3 SER A 46 8.375 -7.388 -6.440 1.00 60.15 H new ATOM 0 HG SER A 46 6.878 -8.958 -5.621 1.00 53.14 H new ATOM 777 N LYS A 47 8.168 -5.489 -8.748 1.00 34.15 N ATOM 778 CA LYS A 47 7.651 -4.137 -8.922 1.00 10.23 C ATOM 779 C LYS A 47 7.109 -3.939 -10.334 1.00 3.12 C ATOM 780 O LYS A 47 6.182 -3.157 -10.549 1.00 24.40 O ATOM 781 CB LYS A 47 8.748 -3.109 -8.636 1.00 42.11 C ATOM 782 CG LYS A 47 9.097 -2.243 -9.834 1.00 51.22 C ATOM 783 CD LYS A 47 8.091 -1.119 -10.022 1.00 24.24 C ATOM 784 CE LYS A 47 8.761 0.245 -9.958 1.00 23.23 C ATOM 785 NZ LYS A 47 8.741 0.809 -8.580 1.00 35.03 N ATOM 0 H LYS A 47 9.184 -5.546 -8.675 1.00 34.15 H new ATOM 0 HA LYS A 47 6.834 -3.993 -8.215 1.00 10.23 H new ATOM 0 HB2 LYS A 47 8.428 -2.467 -7.815 1.00 42.11 H new ATOM 0 HB3 LYS A 47 9.645 -3.631 -8.302 1.00 42.11 H new ATOM 0 HG2 LYS A 47 10.094 -1.822 -9.702 1.00 51.22 H new ATOM 0 HG3 LYS A 47 9.128 -2.859 -10.733 1.00 51.22 H new ATOM 0 HD2 LYS A 47 7.590 -1.235 -10.983 1.00 24.24 H new ATOM 0 HD3 LYS A 47 7.322 -1.185 -9.252 1.00 24.24 H new ATOM 0 HE2 LYS A 47 9.792 0.159 -10.300 1.00 23.23 H new ATOM 0 HE3 LYS A 47 8.255 0.930 -10.638 1.00 23.23 H new ATOM 0 HZ1 LYS A 47 9.207 1.739 -8.579 1.00 35.03 H new ATOM 0 HZ2 LYS A 47 7.756 0.915 -8.262 1.00 35.03 H new ATOM 0 HZ3 LYS A 47 9.246 0.168 -7.935 1.00 35.03 H new ATOM 799 N ILE A 48 7.692 -4.652 -11.291 1.00 62.04 N ATOM 800 CA ILE A 48 7.266 -4.556 -12.682 1.00 14.11 C ATOM 801 C ILE A 48 5.999 -5.369 -12.926 1.00 21.52 C ATOM 802 O ILE A 48 5.159 -4.999 -13.747 1.00 33.51 O ATOM 803 CB ILE A 48 8.367 -5.041 -13.643 1.00 53.44 C ATOM 804 CG1 ILE A 48 9.585 -4.118 -13.566 1.00 14.34 C ATOM 805 CG2 ILE A 48 7.835 -5.106 -15.067 1.00 61.34 C ATOM 806 CD1 ILE A 48 10.904 -4.857 -13.573 1.00 43.23 C ATOM 0 H ILE A 48 8.461 -5.303 -11.129 1.00 62.04 H new ATOM 0 HA ILE A 48 7.063 -3.503 -12.878 1.00 14.11 H new ATOM 0 HB ILE A 48 8.675 -6.043 -13.344 1.00 53.44 H new ATOM 0 HG12 ILE A 48 9.561 -3.427 -14.408 1.00 14.34 H new ATOM 0 HG13 ILE A 48 9.519 -3.518 -12.659 1.00 14.34 H new ATOM 0 HG21 ILE A 48 8.624 -5.450 -15.735 1.00 61.34 H new ATOM 0 HG22 ILE A 48 6.995 -5.799 -15.110 1.00 61.34 H new ATOM 0 HG23 ILE A 48 7.504 -4.115 -15.377 1.00 61.34 H new ATOM 0 HD11 ILE A 48 11.723 -4.140 -13.516 1.00 43.23 H new ATOM 0 HD12 ILE A 48 10.949 -5.528 -12.716 1.00 43.23 H new ATOM 0 HD13 ILE A 48 10.992 -5.436 -14.492 1.00 43.23 H new ATOM 818 N LEU A 49 5.867 -6.478 -12.206 1.00 63.44 N ATOM 819 CA LEU A 49 4.702 -7.345 -12.343 1.00 14.24 C ATOM 820 C LEU A 49 3.428 -6.614 -11.929 1.00 44.41 C ATOM 821 O LEU A 49 2.322 -7.039 -12.256 1.00 74.45 O ATOM 822 CB LEU A 49 4.877 -8.606 -11.495 1.00 21.00 C ATOM 823 CG LEU A 49 6.259 -9.260 -11.542 1.00 54.34 C ATOM 824 CD1 LEU A 49 6.193 -10.686 -11.018 1.00 54.24 C ATOM 825 CD2 LEU A 49 6.812 -9.235 -12.960 1.00 33.42 C ATOM 0 H LEU A 49 6.552 -6.798 -11.522 1.00 63.44 H new ATOM 0 HA LEU A 49 4.613 -7.629 -13.392 1.00 14.24 H new ATOM 0 HB2 LEU A 49 4.650 -8.357 -10.458 1.00 21.00 H new ATOM 0 HB3 LEU A 49 4.138 -9.341 -11.815 1.00 21.00 H new ATOM 0 HG LEU A 49 6.932 -8.691 -10.901 1.00 54.34 H new ATOM 0 HD11 LEU A 49 7.185 -11.135 -11.059 1.00 54.24 H new ATOM 0 HD12 LEU A 49 5.840 -10.679 -9.987 1.00 54.24 H new ATOM 0 HD13 LEU A 49 5.506 -11.268 -11.632 1.00 54.24 H new ATOM 0 HD21 LEU A 49 7.796 -9.704 -12.975 1.00 33.42 H new ATOM 0 HD22 LEU A 49 6.140 -9.780 -13.622 1.00 33.42 H new ATOM 0 HD23 LEU A 49 6.897 -8.203 -13.299 1.00 33.42 H new ATOM 837 N GLY A 50 3.594 -5.508 -11.209 1.00 21.33 N ATOM 838 CA GLY A 50 2.450 -4.734 -10.764 1.00 71.12 C ATOM 839 C GLY A 50 2.348 -3.394 -11.466 1.00 62.51 C ATOM 840 O GLY A 50 1.255 -2.851 -11.628 1.00 45.03 O ATOM 0 H GLY A 50 4.500 -5.135 -10.926 1.00 21.33 H new ATOM 0 HA2 GLY A 50 1.538 -5.304 -10.942 1.00 71.12 H new ATOM 0 HA3 GLY A 50 2.521 -4.573 -9.688 1.00 71.12 H new ATOM 844 N LYS A 51 3.490 -2.859 -11.883 1.00 4.41 N ATOM 845 CA LYS A 51 3.527 -1.574 -12.571 1.00 40.31 C ATOM 846 C LYS A 51 2.948 -1.693 -13.977 1.00 50.22 C ATOM 847 O LYS A 51 2.428 -2.742 -14.359 1.00 42.25 O ATOM 848 CB LYS A 51 4.964 -1.051 -12.642 1.00 55.32 C ATOM 849 CG LYS A 51 5.196 0.203 -11.816 1.00 61.34 C ATOM 850 CD LYS A 51 4.746 0.014 -10.378 1.00 32.15 C ATOM 851 CE LYS A 51 3.475 0.796 -10.084 1.00 75.22 C ATOM 852 NZ LYS A 51 3.769 2.180 -9.621 1.00 21.02 N ATOM 0 H LYS A 51 4.403 -3.296 -11.756 1.00 4.41 H new ATOM 0 HA LYS A 51 2.918 -0.869 -12.005 1.00 40.31 H new ATOM 0 HB2 LYS A 51 5.643 -1.832 -12.300 1.00 55.32 H new ATOM 0 HB3 LYS A 51 5.215 -0.843 -13.682 1.00 55.32 H new ATOM 0 HG2 LYS A 51 6.255 0.462 -11.836 1.00 61.34 H new ATOM 0 HG3 LYS A 51 4.655 1.038 -12.261 1.00 61.34 H new ATOM 0 HD2 LYS A 51 4.575 -1.045 -10.185 1.00 32.15 H new ATOM 0 HD3 LYS A 51 5.538 0.337 -9.702 1.00 32.15 H new ATOM 0 HE2 LYS A 51 2.858 0.837 -10.982 1.00 75.22 H new ATOM 0 HE3 LYS A 51 2.896 0.274 -9.323 1.00 75.22 H new ATOM 0 HZ1 LYS A 51 2.939 2.785 -9.785 1.00 21.02 H new ATOM 0 HZ2 LYS A 51 3.992 2.166 -8.605 1.00 21.02 H new ATOM 0 HZ3 LYS A 51 4.582 2.557 -10.149 1.00 21.02 H new ATOM 866 N THR A 52 3.042 -0.611 -14.745 1.00 21.42 N ATOM 867 CA THR A 52 2.528 -0.595 -16.108 1.00 61.15 C ATOM 868 C THR A 52 3.632 -0.272 -17.108 1.00 65.35 C ATOM 869 O THR A 52 4.808 -0.210 -16.751 1.00 32.43 O ATOM 870 CB THR A 52 1.391 0.431 -16.268 1.00 13.41 C ATOM 871 OG1 THR A 52 1.936 1.730 -16.528 1.00 34.11 O ATOM 872 CG2 THR A 52 0.526 0.480 -15.017 1.00 62.32 C ATOM 0 H THR A 52 3.470 0.265 -14.445 1.00 21.42 H new ATOM 0 HA THR A 52 2.138 -1.593 -16.310 1.00 61.15 H new ATOM 0 HB THR A 52 0.769 0.123 -17.109 1.00 13.41 H new ATOM 0 HG1 THR A 52 1.936 2.256 -15.701 1.00 34.11 H new ATOM 0 HG21 THR A 52 -0.270 1.212 -15.154 1.00 62.32 H new ATOM 0 HG22 THR A 52 0.089 -0.502 -14.838 1.00 62.32 H new ATOM 0 HG23 THR A 52 1.139 0.766 -14.162 1.00 62.32 H new ATOM 880 N ASN A 53 3.246 -0.067 -18.364 1.00 4.45 N ATOM 881 CA ASN A 53 4.205 0.250 -19.416 1.00 1.41 C ATOM 882 C ASN A 53 4.670 1.699 -19.309 1.00 44.43 C ATOM 883 O ASN A 53 5.561 2.133 -20.041 1.00 33.10 O ATOM 884 CB ASN A 53 3.584 0.002 -20.792 1.00 11.30 C ATOM 885 CG ASN A 53 3.757 -1.432 -21.254 1.00 53.43 C ATOM 886 OD1 ASN A 53 3.375 -2.371 -20.556 1.00 41.00 O ATOM 887 ND2 ASN A 53 4.335 -1.606 -22.437 1.00 31.10 N ATOM 0 H ASN A 53 2.276 -0.115 -18.677 1.00 4.45 H new ATOM 0 HA ASN A 53 5.071 -0.401 -19.293 1.00 1.41 H new ATOM 0 HB2 ASN A 53 2.522 0.244 -20.757 1.00 11.30 H new ATOM 0 HB3 ASN A 53 4.040 0.673 -21.520 1.00 11.30 H new ATOM 0 HD21 ASN A 53 4.478 -2.548 -22.801 1.00 31.10 H new ATOM 0 HD22 ASN A 53 4.636 -0.798 -22.981 1.00 31.10 H new ATOM 894 N LYS A 54 4.062 2.444 -18.392 1.00 44.44 N ATOM 895 CA LYS A 54 4.414 3.844 -18.187 1.00 42.41 C ATOM 896 C LYS A 54 5.545 3.978 -17.172 1.00 13.02 C ATOM 897 O LYS A 54 6.443 4.803 -17.336 1.00 21.12 O ATOM 898 CB LYS A 54 3.192 4.634 -17.713 1.00 4.42 C ATOM 899 CG LYS A 54 1.981 4.481 -18.616 1.00 33.34 C ATOM 900 CD LYS A 54 0.795 5.277 -18.098 1.00 33.15 C ATOM 901 CE LYS A 54 -0.056 4.453 -17.143 1.00 62.21 C ATOM 902 NZ LYS A 54 -0.928 3.489 -17.869 1.00 72.30 N ATOM 0 H LYS A 54 3.323 2.101 -17.779 1.00 44.44 H new ATOM 0 HA LYS A 54 4.755 4.250 -19.139 1.00 42.41 H new ATOM 0 HB2 LYS A 54 2.928 4.309 -16.707 1.00 4.42 H new ATOM 0 HB3 LYS A 54 3.455 5.690 -17.648 1.00 4.42 H new ATOM 0 HG2 LYS A 54 2.232 4.815 -19.623 1.00 33.34 H new ATOM 0 HG3 LYS A 54 1.710 3.428 -18.687 1.00 33.34 H new ATOM 0 HD2 LYS A 54 1.151 6.173 -17.589 1.00 33.15 H new ATOM 0 HD3 LYS A 54 0.184 5.609 -18.937 1.00 33.15 H new ATOM 0 HE2 LYS A 54 0.592 3.910 -16.455 1.00 62.21 H new ATOM 0 HE3 LYS A 54 -0.674 5.119 -16.540 1.00 62.21 H new ATOM 0 HZ1 LYS A 54 -1.528 2.983 -17.187 1.00 72.30 H new ATOM 0 HZ2 LYS A 54 -1.529 4.004 -18.544 1.00 72.30 H new ATOM 0 HZ3 LYS A 54 -0.337 2.806 -18.384 1.00 72.30 H new ATOM 916 N GLN A 55 5.493 3.161 -16.125 1.00 24.11 N ATOM 917 CA GLN A 55 6.514 3.189 -15.084 1.00 63.52 C ATOM 918 C GLN A 55 7.718 2.339 -15.480 1.00 12.34 C ATOM 919 O GLN A 55 8.842 2.597 -15.047 1.00 31.25 O ATOM 920 CB GLN A 55 5.936 2.689 -13.759 1.00 73.33 C ATOM 921 CG GLN A 55 5.250 3.775 -12.947 1.00 33.03 C ATOM 922 CD GLN A 55 6.234 4.726 -12.295 1.00 21.22 C ATOM 923 OE1 GLN A 55 7.319 4.322 -11.874 1.00 52.51 O ATOM 924 NE2 GLN A 55 5.861 5.997 -12.208 1.00 14.12 N ATOM 0 H GLN A 55 4.756 2.472 -15.975 1.00 24.11 H new ATOM 0 HA GLN A 55 6.844 4.221 -14.962 1.00 63.52 H new ATOM 0 HB2 GLN A 55 5.221 1.892 -13.962 1.00 73.33 H new ATOM 0 HB3 GLN A 55 6.738 2.253 -13.163 1.00 73.33 H new ATOM 0 HG2 GLN A 55 4.580 4.340 -13.595 1.00 33.03 H new ATOM 0 HG3 GLN A 55 4.633 3.312 -12.177 1.00 33.03 H new ATOM 0 HE21 GLN A 55 4.953 6.288 -12.570 1.00 14.12 H new ATOM 0 HE22 GLN A 55 6.483 6.683 -11.779 1.00 14.12 H new ATOM 933 N LEU A 56 7.475 1.326 -16.304 1.00 4.12 N ATOM 934 CA LEU A 56 8.540 0.438 -16.758 1.00 33.20 C ATOM 935 C LEU A 56 9.722 1.236 -17.297 1.00 42.14 C ATOM 936 O LEU A 56 9.557 2.119 -18.140 1.00 64.45 O ATOM 937 CB LEU A 56 8.014 -0.510 -17.838 1.00 1.41 C ATOM 938 CG LEU A 56 9.071 -1.165 -18.728 1.00 33.34 C ATOM 939 CD1 LEU A 56 8.629 -2.561 -19.141 1.00 4.24 C ATOM 940 CD2 LEU A 56 9.344 -0.306 -19.953 1.00 52.33 C ATOM 0 H LEU A 56 6.551 1.099 -16.671 1.00 4.12 H new ATOM 0 HA LEU A 56 8.881 -0.147 -15.904 1.00 33.20 H new ATOM 0 HB2 LEU A 56 7.438 -1.298 -17.353 1.00 1.41 H new ATOM 0 HB3 LEU A 56 7.324 0.044 -18.475 1.00 1.41 H new ATOM 0 HG LEU A 56 9.996 -1.252 -18.158 1.00 33.34 H new ATOM 0 HD11 LEU A 56 9.393 -3.012 -19.774 1.00 4.24 H new ATOM 0 HD12 LEU A 56 8.485 -3.175 -18.252 1.00 4.24 H new ATOM 0 HD13 LEU A 56 7.692 -2.497 -19.693 1.00 4.24 H new ATOM 0 HD21 LEU A 56 10.099 -0.788 -20.575 1.00 52.33 H new ATOM 0 HD22 LEU A 56 8.424 -0.186 -20.526 1.00 52.33 H new ATOM 0 HD23 LEU A 56 9.705 0.673 -19.638 1.00 52.33 H new ATOM 952 N THR A 57 10.917 0.919 -16.807 1.00 53.22 N ATOM 953 CA THR A 57 12.127 1.605 -17.240 1.00 43.53 C ATOM 954 C THR A 57 13.048 0.664 -18.009 1.00 10.35 C ATOM 955 O THR A 57 12.688 -0.479 -18.290 1.00 11.21 O ATOM 956 CB THR A 57 12.897 2.195 -16.044 1.00 3.33 C ATOM 957 OG1 THR A 57 13.444 1.140 -15.245 1.00 3.10 O ATOM 958 CG2 THR A 57 11.987 3.065 -15.190 1.00 31.23 C ATOM 0 H THR A 57 11.072 0.191 -16.110 1.00 53.22 H new ATOM 0 HA THR A 57 11.812 2.417 -17.896 1.00 43.53 H new ATOM 0 HB THR A 57 13.706 2.814 -16.431 1.00 3.33 H new ATOM 0 HG1 THR A 57 13.934 1.523 -14.488 1.00 3.10 H new ATOM 0 HG21 THR A 57 12.553 3.470 -14.352 1.00 31.23 H new ATOM 0 HG22 THR A 57 11.595 3.884 -15.793 1.00 31.23 H new ATOM 0 HG23 THR A 57 11.159 2.465 -14.812 1.00 31.23 H new ATOM 966 N ARG A 58 14.238 1.152 -18.345 1.00 32.34 N ATOM 967 CA ARG A 58 15.210 0.353 -19.081 1.00 42.31 C ATOM 968 C ARG A 58 15.576 -0.909 -18.306 1.00 5.24 C ATOM 969 O ARG A 58 15.613 -2.005 -18.865 1.00 43.52 O ATOM 970 CB ARG A 58 16.469 1.176 -19.362 1.00 23.41 C ATOM 971 CG ARG A 58 17.078 1.801 -18.118 1.00 10.44 C ATOM 972 CD ARG A 58 18.205 2.760 -18.470 1.00 72.34 C ATOM 973 NE ARG A 58 18.400 3.777 -17.441 1.00 40.53 N ATOM 974 CZ ARG A 58 18.991 3.540 -16.276 1.00 32.04 C ATOM 975 NH1 ARG A 58 19.442 2.326 -15.992 1.00 62.15 N ATOM 976 NH2 ARG A 58 19.132 4.518 -15.390 1.00 54.32 N ATOM 0 H ARG A 58 14.552 2.096 -18.119 1.00 32.34 H new ATOM 0 HA ARG A 58 14.758 0.058 -20.028 1.00 42.31 H new ATOM 0 HB2 ARG A 58 17.212 0.536 -19.838 1.00 23.41 H new ATOM 0 HB3 ARG A 58 16.226 1.965 -20.073 1.00 23.41 H new ATOM 0 HG2 ARG A 58 16.306 2.333 -17.562 1.00 10.44 H new ATOM 0 HG3 ARG A 58 17.458 1.016 -17.464 1.00 10.44 H new ATOM 0 HD2 ARG A 58 19.130 2.199 -18.605 1.00 72.34 H new ATOM 0 HD3 ARG A 58 17.985 3.244 -19.421 1.00 72.34 H new ATOM 0 HE ARG A 58 18.064 4.722 -17.627 1.00 40.53 H new ATOM 0 HH11 ARG A 58 19.335 1.571 -16.669 1.00 62.15 H new ATOM 0 HH12 ARG A 58 19.896 2.147 -15.096 1.00 62.15 H new ATOM 0 HH21 ARG A 58 18.786 5.453 -15.604 1.00 54.32 H new ATOM 0 HH22 ARG A 58 19.586 4.334 -14.495 1.00 54.32 H new ATOM 990 N SER A 59 15.847 -0.746 -17.014 1.00 61.24 N ATOM 991 CA SER A 59 16.215 -1.871 -16.163 1.00 32.31 C ATOM 992 C SER A 59 15.073 -2.879 -16.072 1.00 22.43 C ATOM 993 O SER A 59 15.298 -4.070 -15.855 1.00 31.24 O ATOM 994 CB SER A 59 16.588 -1.378 -14.763 1.00 60.55 C ATOM 995 OG SER A 59 16.905 -2.463 -13.909 1.00 23.25 O ATOM 0 H SER A 59 15.818 0.154 -16.535 1.00 61.24 H new ATOM 0 HA SER A 59 17.078 -2.365 -16.609 1.00 32.31 H new ATOM 0 HB2 SER A 59 17.440 -0.701 -14.827 1.00 60.55 H new ATOM 0 HB3 SER A 59 15.759 -0.809 -14.341 1.00 60.55 H new ATOM 0 HG SER A 59 17.141 -2.122 -13.021 1.00 23.25 H new ATOM 1001 N ASP A 60 13.848 -2.393 -16.239 1.00 24.10 N ATOM 1002 CA ASP A 60 12.670 -3.250 -16.177 1.00 23.41 C ATOM 1003 C ASP A 60 12.556 -4.109 -17.433 1.00 2.13 C ATOM 1004 O ASP A 60 12.062 -5.235 -17.384 1.00 34.34 O ATOM 1005 CB ASP A 60 11.407 -2.406 -16.005 1.00 50.52 C ATOM 1006 CG ASP A 60 11.353 -1.712 -14.658 1.00 51.02 C ATOM 1007 OD1 ASP A 60 12.323 -1.846 -13.882 1.00 53.53 O ATOM 1008 OD2 ASP A 60 10.341 -1.035 -14.380 1.00 44.11 O ATOM 0 H ASP A 60 13.645 -1.410 -16.418 1.00 24.10 H new ATOM 0 HA ASP A 60 12.776 -3.910 -15.316 1.00 23.41 H new ATOM 0 HB2 ASP A 60 11.362 -1.659 -16.797 1.00 50.52 H new ATOM 0 HB3 ASP A 60 10.530 -3.043 -16.118 1.00 50.52 H new ATOM 1013 N ARG A 61 13.016 -3.569 -18.557 1.00 10.35 N ATOM 1014 CA ARG A 61 12.963 -4.284 -19.826 1.00 23.34 C ATOM 1015 C ARG A 61 14.041 -5.363 -19.887 1.00 32.15 C ATOM 1016 O ARG A 61 13.783 -6.487 -20.317 1.00 43.42 O ATOM 1017 CB ARG A 61 13.136 -3.310 -20.992 1.00 75.04 C ATOM 1018 CG ARG A 61 11.925 -3.237 -21.909 1.00 20.23 C ATOM 1019 CD ARG A 61 11.756 -4.518 -22.711 1.00 51.21 C ATOM 1020 NE ARG A 61 10.903 -4.322 -23.881 1.00 25.43 N ATOM 1021 CZ ARG A 61 9.577 -4.274 -23.824 1.00 2.14 C ATOM 1022 NH1 ARG A 61 8.955 -4.406 -22.660 1.00 42.51 N ATOM 1023 NH2 ARG A 61 8.870 -4.093 -24.932 1.00 4.11 N ATOM 0 H ARG A 61 13.430 -2.638 -18.614 1.00 10.35 H new ATOM 0 HA ARG A 61 11.987 -4.764 -19.904 1.00 23.34 H new ATOM 0 HB2 ARG A 61 13.342 -2.316 -20.596 1.00 75.04 H new ATOM 0 HB3 ARG A 61 14.007 -3.607 -21.577 1.00 75.04 H new ATOM 0 HG2 ARG A 61 11.028 -3.057 -21.316 1.00 20.23 H new ATOM 0 HG3 ARG A 61 12.033 -2.392 -22.589 1.00 20.23 H new ATOM 0 HD2 ARG A 61 12.734 -4.877 -23.031 1.00 51.21 H new ATOM 0 HD3 ARG A 61 11.326 -5.291 -22.074 1.00 51.21 H new ATOM 0 HE ARG A 61 11.350 -4.216 -24.791 1.00 25.43 H new ATOM 0 HH11 ARG A 61 9.495 -4.545 -21.806 1.00 42.51 H new ATOM 0 HH12 ARG A 61 7.937 -4.369 -22.619 1.00 42.51 H new ATOM 0 HH21 ARG A 61 9.345 -3.991 -25.829 1.00 4.11 H new ATOM 0 HH22 ARG A 61 7.852 -4.056 -24.887 1.00 4.11 H new ATOM 1037 N GLU A 62 15.248 -5.012 -19.453 1.00 35.32 N ATOM 1038 CA GLU A 62 16.364 -5.951 -19.460 1.00 14.32 C ATOM 1039 C GLU A 62 16.096 -7.122 -18.519 1.00 12.32 C ATOM 1040 O GLU A 62 16.439 -8.265 -18.819 1.00 62.20 O ATOM 1041 CB GLU A 62 17.657 -5.242 -19.054 1.00 44.31 C ATOM 1042 CG GLU A 62 17.854 -5.148 -17.550 1.00 64.04 C ATOM 1043 CD GLU A 62 18.487 -6.396 -16.966 1.00 21.10 C ATOM 1044 OE1 GLU A 62 18.763 -7.339 -17.737 1.00 2.31 O ATOM 1045 OE2 GLU A 62 18.706 -6.429 -15.737 1.00 23.41 O ATOM 0 H GLU A 62 15.478 -4.086 -19.093 1.00 35.32 H new ATOM 0 HA GLU A 62 16.473 -6.339 -20.473 1.00 14.32 H new ATOM 0 HB2 GLU A 62 18.504 -5.771 -19.490 1.00 44.31 H new ATOM 0 HB3 GLU A 62 17.658 -4.237 -19.475 1.00 44.31 H new ATOM 0 HG2 GLU A 62 18.482 -4.286 -17.323 1.00 64.04 H new ATOM 0 HG3 GLU A 62 16.890 -4.976 -17.071 1.00 64.04 H new ATOM 1052 N VAL A 63 15.480 -6.828 -17.378 1.00 3.42 N ATOM 1053 CA VAL A 63 15.165 -7.855 -16.392 1.00 44.22 C ATOM 1054 C VAL A 63 14.021 -8.742 -16.869 1.00 41.05 C ATOM 1055 O VAL A 63 14.030 -9.955 -16.655 1.00 11.24 O ATOM 1056 CB VAL A 63 14.787 -7.233 -15.035 1.00 34.01 C ATOM 1057 CG1 VAL A 63 15.959 -6.453 -14.459 1.00 54.22 C ATOM 1058 CG2 VAL A 63 13.562 -6.342 -15.181 1.00 4.03 C ATOM 0 H VAL A 63 15.189 -5.887 -17.114 1.00 3.42 H new ATOM 0 HA VAL A 63 16.063 -8.461 -16.268 1.00 44.22 H new ATOM 0 HB VAL A 63 14.543 -8.038 -14.341 1.00 34.01 H new ATOM 0 HG11 VAL A 63 15.672 -6.021 -13.500 1.00 54.22 H new ATOM 0 HG12 VAL A 63 16.807 -7.123 -14.316 1.00 54.22 H new ATOM 0 HG13 VAL A 63 16.239 -5.655 -15.147 1.00 54.22 H new ATOM 0 HG21 VAL A 63 13.308 -5.910 -14.213 1.00 4.03 H new ATOM 0 HG22 VAL A 63 13.776 -5.542 -15.890 1.00 4.03 H new ATOM 0 HG23 VAL A 63 12.723 -6.934 -15.545 1.00 4.03 H new ATOM 1068 N LEU A 64 13.037 -8.130 -17.519 1.00 32.14 N ATOM 1069 CA LEU A 64 11.884 -8.864 -18.028 1.00 33.30 C ATOM 1070 C LEU A 64 12.313 -9.910 -19.052 1.00 21.32 C ATOM 1071 O LEU A 64 11.846 -11.049 -19.024 1.00 24.23 O ATOM 1072 CB LEU A 64 10.878 -7.900 -18.659 1.00 10.43 C ATOM 1073 CG LEU A 64 9.523 -7.791 -17.959 1.00 12.31 C ATOM 1074 CD1 LEU A 64 9.708 -7.631 -16.458 1.00 24.51 C ATOM 1075 CD2 LEU A 64 8.722 -6.627 -18.525 1.00 71.45 C ATOM 0 H LEU A 64 13.015 -7.128 -17.706 1.00 32.14 H new ATOM 0 HA LEU A 64 11.411 -9.375 -17.189 1.00 33.30 H new ATOM 0 HB2 LEU A 64 11.328 -6.908 -18.693 1.00 10.43 H new ATOM 0 HB3 LEU A 64 10.708 -8.208 -19.691 1.00 10.43 H new ATOM 0 HG LEU A 64 8.968 -8.711 -18.140 1.00 12.31 H new ATOM 0 HD11 LEU A 64 8.733 -7.555 -15.977 1.00 24.51 H new ATOM 0 HD12 LEU A 64 10.241 -8.496 -16.063 1.00 24.51 H new ATOM 0 HD13 LEU A 64 10.283 -6.727 -16.257 1.00 24.51 H new ATOM 0 HD21 LEU A 64 7.761 -6.565 -18.015 1.00 71.45 H new ATOM 0 HD22 LEU A 64 9.273 -5.699 -18.375 1.00 71.45 H new ATOM 0 HD23 LEU A 64 8.558 -6.783 -19.591 1.00 71.45 H new ATOM 1087 N ASP A 65 13.206 -9.517 -19.953 1.00 41.40 N ATOM 1088 CA ASP A 65 13.702 -10.421 -20.984 1.00 54.12 C ATOM 1089 C ASP A 65 14.588 -11.504 -20.377 1.00 43.30 C ATOM 1090 O ASP A 65 14.632 -12.631 -20.868 1.00 3.12 O ATOM 1091 CB ASP A 65 14.481 -9.641 -22.045 1.00 32.53 C ATOM 1092 CG ASP A 65 13.984 -9.921 -23.450 1.00 3.44 C ATOM 1093 OD1 ASP A 65 14.367 -10.965 -24.017 1.00 40.22 O ATOM 1094 OD2 ASP A 65 13.214 -9.094 -23.982 1.00 75.40 O ATOM 0 H ASP A 65 13.602 -8.578 -19.990 1.00 41.40 H new ATOM 0 HA ASP A 65 12.844 -10.901 -21.455 1.00 54.12 H new ATOM 0 HB2 ASP A 65 14.400 -8.574 -21.840 1.00 32.53 H new ATOM 0 HB3 ASP A 65 15.538 -9.899 -21.978 1.00 32.53 H new ATOM 1099 N ASN A 66 15.294 -11.152 -19.307 1.00 30.30 N ATOM 1100 CA ASN A 66 16.181 -12.094 -18.634 1.00 2.23 C ATOM 1101 C ASN A 66 15.384 -13.091 -17.799 1.00 74.42 C ATOM 1102 O ASN A 66 15.710 -14.277 -17.752 1.00 72.42 O ATOM 1103 CB ASN A 66 17.173 -11.344 -17.742 1.00 52.20 C ATOM 1104 CG ASN A 66 18.158 -12.275 -17.062 1.00 33.12 C ATOM 1105 OD1 ASN A 66 18.963 -12.933 -17.720 1.00 61.24 O ATOM 1106 ND2 ASN A 66 18.097 -12.335 -15.737 1.00 11.54 N ATOM 0 H ASN A 66 15.269 -10.222 -18.888 1.00 30.30 H new ATOM 0 HA ASN A 66 16.732 -12.644 -19.397 1.00 2.23 H new ATOM 0 HB2 ASN A 66 17.720 -10.617 -18.343 1.00 52.20 H new ATOM 0 HB3 ASN A 66 16.625 -10.784 -16.985 1.00 52.20 H new ATOM 0 HD21 ASN A 66 18.734 -12.945 -15.224 1.00 11.54 H new ATOM 0 HD22 ASN A 66 17.413 -11.771 -15.232 1.00 11.54 H new ATOM 1113 N TRP A 67 14.337 -12.602 -17.143 1.00 65.34 N ATOM 1114 CA TRP A 67 13.492 -13.451 -16.311 1.00 65.10 C ATOM 1115 C TRP A 67 12.762 -14.489 -17.156 1.00 42.45 C ATOM 1116 O TRP A 67 12.622 -15.644 -16.754 1.00 10.53 O ATOM 1117 CB TRP A 67 12.482 -12.600 -15.540 1.00 72.41 C ATOM 1118 CG TRP A 67 11.059 -12.873 -15.926 1.00 3.31 C ATOM 1119 CD1 TRP A 67 10.257 -12.088 -16.704 1.00 72.42 C ATOM 1120 CD2 TRP A 67 10.271 -14.007 -15.549 1.00 64.11 C ATOM 1121 NE1 TRP A 67 9.017 -12.667 -16.834 1.00 62.00 N ATOM 1122 CE2 TRP A 67 9.001 -13.845 -16.136 1.00 31.24 C ATOM 1123 CE3 TRP A 67 10.516 -15.145 -14.775 1.00 51.24 C ATOM 1124 CZ2 TRP A 67 7.981 -14.778 -15.970 1.00 73.11 C ATOM 1125 CZ3 TRP A 67 9.502 -16.070 -14.612 1.00 2.42 C ATOM 1126 CH2 TRP A 67 8.248 -15.882 -15.207 1.00 73.54 C ATOM 0 H TRP A 67 14.053 -11.623 -17.171 1.00 65.34 H new ATOM 0 HA TRP A 67 14.132 -13.975 -15.601 1.00 65.10 H new ATOM 0 HB2 TRP A 67 12.603 -12.783 -14.472 1.00 72.41 H new ATOM 0 HB3 TRP A 67 12.701 -11.546 -15.709 1.00 72.41 H new ATOM 0 HD1 TRP A 67 10.553 -11.151 -17.151 1.00 72.42 H new ATOM 0 HE1 TRP A 67 8.236 -12.282 -17.364 1.00 62.00 H new ATOM 0 HE3 TRP A 67 11.480 -15.299 -14.313 1.00 51.24 H new ATOM 0 HZ2 TRP A 67 7.013 -14.635 -16.427 1.00 73.11 H new ATOM 0 HZ3 TRP A 67 9.680 -16.953 -14.016 1.00 2.42 H new ATOM 0 HH2 TRP A 67 7.476 -16.623 -15.061 1.00 73.54 H new ATOM 1137 N ARG A 68 12.299 -14.070 -18.330 1.00 21.03 N ATOM 1138 CA ARG A 68 11.582 -14.964 -19.231 1.00 42.11 C ATOM 1139 C ARG A 68 12.547 -15.912 -19.937 1.00 71.23 C ATOM 1140 O ARG A 68 12.161 -17.000 -20.365 1.00 1.44 O ATOM 1141 CB ARG A 68 10.795 -14.157 -20.265 1.00 44.42 C ATOM 1142 CG ARG A 68 11.655 -13.195 -21.070 1.00 30.32 C ATOM 1143 CD ARG A 68 12.318 -13.893 -22.247 1.00 50.12 C ATOM 1144 NE ARG A 68 12.316 -13.061 -23.448 1.00 23.42 N ATOM 1145 CZ ARG A 68 11.231 -12.824 -24.176 1.00 31.11 C ATOM 1146 NH1 ARG A 68 10.066 -13.352 -23.827 1.00 31.22 N ATOM 1147 NH2 ARG A 68 11.309 -12.057 -25.255 1.00 44.54 N ATOM 0 H ARG A 68 12.408 -13.118 -18.679 1.00 21.03 H new ATOM 0 HA ARG A 68 10.886 -15.557 -18.637 1.00 42.11 H new ATOM 0 HB2 ARG A 68 10.297 -14.845 -20.948 1.00 44.42 H new ATOM 0 HB3 ARG A 68 10.014 -13.593 -19.755 1.00 44.42 H new ATOM 0 HG2 ARG A 68 11.040 -12.372 -21.433 1.00 30.32 H new ATOM 0 HG3 ARG A 68 12.419 -12.761 -20.425 1.00 30.32 H new ATOM 0 HD2 ARG A 68 13.345 -14.149 -21.985 1.00 50.12 H new ATOM 0 HD3 ARG A 68 11.798 -14.829 -22.453 1.00 50.12 H new ATOM 0 HE ARG A 68 13.196 -12.639 -23.743 1.00 23.42 H new ATOM 0 HH11 ARG A 68 10.001 -13.942 -22.997 1.00 31.22 H new ATOM 0 HH12 ARG A 68 9.234 -13.168 -24.388 1.00 31.22 H new ATOM 0 HH21 ARG A 68 12.203 -11.648 -25.527 1.00 44.54 H new ATOM 0 HH22 ARG A 68 10.475 -11.876 -25.813 1.00 44.54 H new ATOM 1161 N GLU A 69 13.802 -15.491 -20.056 1.00 2.01 N ATOM 1162 CA GLU A 69 14.821 -16.303 -20.711 1.00 52.35 C ATOM 1163 C GLU A 69 15.201 -17.501 -19.847 1.00 20.31 C ATOM 1164 O GLU A 69 15.348 -18.619 -20.344 1.00 54.44 O ATOM 1165 CB GLU A 69 16.063 -15.460 -21.009 1.00 11.13 C ATOM 1166 CG GLU A 69 17.353 -16.074 -20.491 1.00 51.51 C ATOM 1167 CD GLU A 69 18.585 -15.326 -20.963 1.00 11.33 C ATOM 1168 OE1 GLU A 69 18.442 -14.424 -21.814 1.00 44.50 O ATOM 1169 OE2 GLU A 69 19.692 -15.643 -20.479 1.00 70.24 O ATOM 0 H GLU A 69 14.138 -14.593 -19.708 1.00 2.01 H new ATOM 0 HA GLU A 69 14.407 -16.671 -21.650 1.00 52.35 H new ATOM 0 HB2 GLU A 69 16.145 -15.317 -22.086 1.00 11.13 H new ATOM 0 HB3 GLU A 69 15.937 -14.472 -20.565 1.00 11.13 H new ATOM 0 HG2 GLU A 69 17.334 -16.085 -19.401 1.00 51.51 H new ATOM 0 HG3 GLU A 69 17.415 -17.112 -20.819 1.00 51.51 H new ATOM 1176 N LEU A 70 15.360 -17.261 -18.550 1.00 52.01 N ATOM 1177 CA LEU A 70 15.724 -18.320 -17.615 1.00 14.32 C ATOM 1178 C LEU A 70 14.528 -19.220 -17.319 1.00 42.15 C ATOM 1179 O LEU A 70 14.682 -20.424 -17.115 1.00 14.52 O ATOM 1180 CB LEU A 70 16.256 -17.717 -16.314 1.00 24.03 C ATOM 1181 CG LEU A 70 15.427 -16.583 -15.710 1.00 51.03 C ATOM 1182 CD1 LEU A 70 14.487 -17.119 -14.642 1.00 32.20 C ATOM 1183 CD2 LEU A 70 16.335 -15.507 -15.133 1.00 11.11 C ATOM 0 H LEU A 70 15.243 -16.343 -18.122 1.00 52.01 H new ATOM 0 HA LEU A 70 16.506 -18.925 -18.075 1.00 14.32 H new ATOM 0 HB2 LEU A 70 16.338 -18.514 -15.575 1.00 24.03 H new ATOM 0 HB3 LEU A 70 17.265 -17.346 -16.495 1.00 24.03 H new ATOM 0 HG LEU A 70 14.826 -16.136 -16.502 1.00 51.03 H new ATOM 0 HD11 LEU A 70 13.905 -16.298 -14.224 1.00 32.20 H new ATOM 0 HD12 LEU A 70 13.813 -17.852 -15.085 1.00 32.20 H new ATOM 0 HD13 LEU A 70 15.068 -17.592 -13.850 1.00 32.20 H new ATOM 0 HD21 LEU A 70 15.728 -14.708 -14.708 1.00 11.11 H new ATOM 0 HD22 LEU A 70 16.963 -15.940 -14.354 1.00 11.11 H new ATOM 0 HD23 LEU A 70 16.966 -15.101 -15.924 1.00 11.11 H new ATOM 1195 N GLU A 71 13.338 -18.628 -17.301 1.00 41.33 N ATOM 1196 CA GLU A 71 12.117 -19.377 -17.033 1.00 34.45 C ATOM 1197 C GLU A 71 11.822 -20.360 -18.162 1.00 31.51 C ATOM 1198 O GLU A 71 11.288 -21.445 -17.931 1.00 63.12 O ATOM 1199 CB GLU A 71 10.935 -18.422 -16.852 1.00 31.33 C ATOM 1200 CG GLU A 71 9.605 -19.130 -16.654 1.00 70.13 C ATOM 1201 CD GLU A 71 8.622 -18.847 -17.773 1.00 73.15 C ATOM 1202 OE1 GLU A 71 9.029 -18.910 -18.952 1.00 62.41 O ATOM 1203 OE2 GLU A 71 7.444 -18.562 -17.470 1.00 22.41 O ATOM 0 H GLU A 71 13.194 -17.632 -17.469 1.00 41.33 H new ATOM 0 HA GLU A 71 12.263 -19.941 -16.112 1.00 34.45 H new ATOM 0 HB2 GLU A 71 11.126 -17.779 -15.993 1.00 31.33 H new ATOM 0 HB3 GLU A 71 10.865 -17.774 -17.726 1.00 31.33 H new ATOM 0 HG2 GLU A 71 9.776 -20.205 -16.588 1.00 70.13 H new ATOM 0 HG3 GLU A 71 9.169 -18.818 -15.705 1.00 70.13 H new ATOM 1210 N MET A 72 12.173 -19.972 -19.383 1.00 42.13 N ATOM 1211 CA MET A 72 11.947 -20.819 -20.549 1.00 2.22 C ATOM 1212 C MET A 72 13.126 -21.760 -20.773 1.00 70.54 C ATOM 1213 O MET A 72 13.011 -22.757 -21.487 1.00 73.11 O ATOM 1214 CB MET A 72 11.721 -19.959 -21.794 1.00 64.42 C ATOM 1215 CG MET A 72 12.982 -19.273 -22.296 1.00 33.14 C ATOM 1216 SD MET A 72 13.309 -19.608 -24.037 1.00 12.40 S ATOM 1217 CE MET A 72 12.841 -18.044 -24.776 1.00 32.43 C ATOM 0 H MET A 72 12.615 -19.077 -19.591 1.00 42.13 H new ATOM 0 HA MET A 72 11.056 -21.419 -20.365 1.00 2.22 H new ATOM 0 HB2 MET A 72 11.317 -20.585 -22.589 1.00 64.42 H new ATOM 0 HB3 MET A 72 10.969 -19.202 -21.571 1.00 64.42 H new ATOM 0 HG2 MET A 72 12.889 -18.197 -22.148 1.00 33.14 H new ATOM 0 HG3 MET A 72 13.833 -19.604 -21.700 1.00 33.14 H new ATOM 0 HE1 MET A 72 12.987 -18.093 -25.855 1.00 32.43 H new ATOM 0 HE2 MET A 72 11.792 -17.839 -24.561 1.00 32.43 H new ATOM 0 HE3 MET A 72 13.458 -17.247 -24.362 1.00 32.43 H new ATOM 1227 N LYS A 73 14.260 -21.438 -20.160 1.00 71.42 N ATOM 1228 CA LYS A 73 15.460 -22.256 -20.292 1.00 3.41 C ATOM 1229 C LYS A 73 15.448 -23.405 -19.290 1.00 24.42 C ATOM 1230 O LYS A 73 16.202 -24.368 -19.427 1.00 21.50 O ATOM 1231 CB LYS A 73 16.711 -21.398 -20.086 1.00 30.14 C ATOM 1232 CG LYS A 73 17.256 -20.799 -21.370 1.00 43.32 C ATOM 1233 CD LYS A 73 18.759 -20.991 -21.481 1.00 64.23 C ATOM 1234 CE LYS A 73 19.104 -22.223 -22.304 1.00 43.04 C ATOM 1235 NZ LYS A 73 20.310 -22.005 -23.151 1.00 0.24 N ATOM 0 H LYS A 73 14.373 -20.616 -19.567 1.00 71.42 H new ATOM 0 HA LYS A 73 15.475 -22.675 -21.298 1.00 3.41 H new ATOM 0 HB2 LYS A 73 16.478 -20.593 -19.390 1.00 30.14 H new ATOM 0 HB3 LYS A 73 17.486 -22.007 -19.621 1.00 30.14 H new ATOM 0 HG2 LYS A 73 16.765 -21.262 -22.226 1.00 43.32 H new ATOM 0 HG3 LYS A 73 17.021 -19.735 -21.405 1.00 43.32 H new ATOM 0 HD2 LYS A 73 19.207 -20.109 -21.939 1.00 64.23 H new ATOM 0 HD3 LYS A 73 19.189 -21.086 -20.484 1.00 64.23 H new ATOM 0 HE2 LYS A 73 19.276 -23.068 -21.638 1.00 43.04 H new ATOM 0 HE3 LYS A 73 18.257 -22.485 -22.938 1.00 43.04 H new ATOM 0 HZ1 LYS A 73 20.512 -22.867 -23.696 1.00 0.24 H new ATOM 0 HZ2 LYS A 73 20.137 -21.215 -23.805 1.00 0.24 H new ATOM 0 HZ3 LYS A 73 21.124 -21.780 -22.544 1.00 0.24 H new ATOM 1249 N ALA A 74 14.587 -23.298 -18.283 1.00 62.22 N ATOM 1250 CA ALA A 74 14.475 -24.331 -17.261 1.00 1.24 C ATOM 1251 C ALA A 74 13.795 -25.579 -17.813 1.00 21.00 C ATOM 1252 O ALA A 74 13.615 -26.566 -17.100 1.00 30.22 O ATOM 1253 CB ALA A 74 13.711 -23.800 -16.056 1.00 61.35 C ATOM 0 H ALA A 74 13.957 -22.506 -18.153 1.00 62.22 H new ATOM 0 HA ALA A 74 15.482 -24.607 -16.947 1.00 1.24 H new ATOM 0 HB1 ALA A 74 13.635 -24.582 -15.300 1.00 61.35 H new ATOM 0 HB2 ALA A 74 14.239 -22.943 -15.639 1.00 61.35 H new ATOM 0 HB3 ALA A 74 12.711 -23.495 -16.365 1.00 61.35 H new ATOM 1259 N ARG A 75 13.419 -25.528 -19.087 1.00 1.24 N ATOM 1260 CA ARG A 75 12.757 -26.654 -19.734 1.00 21.14 C ATOM 1261 C ARG A 75 11.613 -27.180 -18.872 1.00 72.11 C ATOM 1262 O ARG A 75 11.365 -28.385 -18.818 1.00 55.12 O ATOM 1263 CB ARG A 75 13.761 -27.775 -20.006 1.00 64.35 C ATOM 1264 CG ARG A 75 14.638 -27.525 -21.222 1.00 62.05 C ATOM 1265 CD ARG A 75 15.688 -28.613 -21.386 1.00 73.30 C ATOM 1266 NE ARG A 75 16.777 -28.195 -22.264 1.00 25.22 N ATOM 1267 CZ ARG A 75 17.946 -28.823 -22.334 1.00 42.33 C ATOM 1268 NH1 ARG A 75 18.175 -29.891 -21.583 1.00 61.14 N ATOM 1269 NH2 ARG A 75 18.889 -28.382 -23.158 1.00 13.22 N ATOM 0 H ARG A 75 13.562 -24.719 -19.691 1.00 1.24 H new ATOM 0 HA ARG A 75 12.345 -26.306 -20.681 1.00 21.14 H new ATOM 0 HB2 ARG A 75 14.397 -27.902 -19.130 1.00 64.35 H new ATOM 0 HB3 ARG A 75 13.219 -28.711 -20.145 1.00 64.35 H new ATOM 0 HG2 ARG A 75 14.017 -27.480 -22.117 1.00 62.05 H new ATOM 0 HG3 ARG A 75 15.128 -26.556 -21.125 1.00 62.05 H new ATOM 0 HD2 ARG A 75 16.092 -28.877 -20.409 1.00 73.30 H new ATOM 0 HD3 ARG A 75 15.220 -29.510 -21.791 1.00 73.30 H new ATOM 0 HE ARG A 75 16.633 -27.377 -22.856 1.00 25.22 H new ATOM 0 HH11 ARG A 75 17.453 -30.233 -20.949 1.00 61.14 H new ATOM 0 HH12 ARG A 75 19.073 -30.371 -21.639 1.00 61.14 H new ATOM 0 HH21 ARG A 75 18.716 -27.561 -23.738 1.00 13.22 H new ATOM 0 HH22 ARG A 75 19.786 -28.864 -23.211 1.00 13.22 H new ATOM 1283 N LYS A 76 10.919 -26.269 -18.199 1.00 12.22 N ATOM 1284 CA LYS A 76 9.800 -26.639 -17.340 1.00 22.01 C ATOM 1285 C LYS A 76 9.144 -25.401 -16.737 1.00 51.14 C ATOM 1286 O LYS A 76 9.667 -24.292 -16.851 1.00 74.15 O ATOM 1287 CB LYS A 76 10.275 -27.572 -16.224 1.00 33.15 C ATOM 1288 CG LYS A 76 9.821 -29.011 -16.399 1.00 51.15 C ATOM 1289 CD LYS A 76 8.712 -29.369 -15.424 1.00 63.30 C ATOM 1290 CE LYS A 76 8.730 -30.851 -15.080 1.00 51.21 C ATOM 1291 NZ LYS A 76 9.371 -31.106 -13.760 1.00 75.23 N ATOM 0 H LYS A 76 11.112 -25.268 -18.232 1.00 12.22 H new ATOM 0 HA LYS A 76 9.062 -27.158 -17.951 1.00 22.01 H new ATOM 0 HB2 LYS A 76 11.364 -27.546 -16.179 1.00 33.15 H new ATOM 0 HB3 LYS A 76 9.908 -27.198 -15.268 1.00 33.15 H new ATOM 0 HG2 LYS A 76 9.471 -29.161 -17.420 1.00 51.15 H new ATOM 0 HG3 LYS A 76 10.668 -29.681 -16.250 1.00 51.15 H new ATOM 0 HD2 LYS A 76 8.823 -28.781 -14.513 1.00 63.30 H new ATOM 0 HD3 LYS A 76 7.747 -29.106 -15.857 1.00 63.30 H new ATOM 0 HE2 LYS A 76 7.709 -31.234 -15.068 1.00 51.21 H new ATOM 0 HE3 LYS A 76 9.266 -31.397 -15.856 1.00 51.21 H new ATOM 0 HZ1 LYS A 76 9.364 -32.127 -13.562 1.00 75.23 H new ATOM 0 HZ2 LYS A 76 10.353 -30.764 -13.779 1.00 75.23 H new ATOM 0 HZ3 LYS A 76 8.845 -30.605 -13.016 1.00 75.23 H new ATOM 1305 N ARG A 77 7.997 -25.598 -16.095 1.00 42.11 N ATOM 1306 CA ARG A 77 7.270 -24.497 -15.474 1.00 63.04 C ATOM 1307 C ARG A 77 7.351 -24.582 -13.953 1.00 13.30 C ATOM 1308 O ARG A 77 6.531 -25.242 -13.313 1.00 24.20 O ATOM 1309 CB ARG A 77 5.807 -24.509 -15.920 1.00 12.22 C ATOM 1310 CG ARG A 77 5.175 -25.891 -15.900 1.00 21.04 C ATOM 1311 CD ARG A 77 3.666 -25.811 -15.728 1.00 22.53 C ATOM 1312 NE ARG A 77 2.984 -25.560 -16.994 1.00 53.40 N ATOM 1313 CZ ARG A 77 2.852 -26.470 -17.952 1.00 23.40 C ATOM 1314 NH1 ARG A 77 3.354 -27.687 -17.788 1.00 51.31 N ATOM 1315 NH2 ARG A 77 2.218 -26.165 -19.077 1.00 34.44 N ATOM 0 H ARG A 77 7.551 -26.510 -15.991 1.00 42.11 H new ATOM 0 HA ARG A 77 7.732 -23.563 -15.793 1.00 63.04 H new ATOM 0 HB2 ARG A 77 5.233 -23.847 -15.272 1.00 12.22 H new ATOM 0 HB3 ARG A 77 5.740 -24.103 -16.929 1.00 12.22 H new ATOM 0 HG2 ARG A 77 5.409 -26.413 -16.828 1.00 21.04 H new ATOM 0 HG3 ARG A 77 5.604 -26.477 -15.087 1.00 21.04 H new ATOM 0 HD2 ARG A 77 3.300 -26.743 -15.298 1.00 22.53 H new ATOM 0 HD3 ARG A 77 3.423 -25.017 -15.022 1.00 22.53 H new ATOM 0 HE ARG A 77 2.587 -24.634 -17.152 1.00 53.40 H new ATOM 0 HH11 ARG A 77 3.842 -27.925 -16.925 1.00 51.31 H new ATOM 0 HH12 ARG A 77 3.251 -28.385 -18.525 1.00 51.31 H new ATOM 0 HH21 ARG A 77 1.831 -25.230 -19.207 1.00 34.44 H new ATOM 0 HH22 ARG A 77 2.118 -26.865 -19.812 1.00 34.44 H new ATOM 1329 N LEU A 78 8.343 -23.910 -13.380 1.00 40.51 N ATOM 1330 CA LEU A 78 8.531 -23.909 -11.933 1.00 44.34 C ATOM 1331 C LEU A 78 7.232 -23.559 -11.215 1.00 41.43 C ATOM 1332 O LEU A 78 6.296 -23.017 -11.803 1.00 53.11 O ATOM 1333 CB LEU A 78 9.627 -22.915 -11.543 1.00 21.33 C ATOM 1334 CG LEU A 78 11.033 -23.495 -11.385 1.00 2.15 C ATOM 1335 CD1 LEU A 78 11.377 -24.390 -12.565 1.00 24.33 C ATOM 1336 CD2 LEU A 78 12.058 -22.378 -11.243 1.00 75.42 C ATOM 0 H LEU A 78 9.030 -23.359 -13.895 1.00 40.51 H new ATOM 0 HA LEU A 78 8.833 -24.911 -11.630 1.00 44.34 H new ATOM 0 HB2 LEU A 78 9.662 -22.129 -12.298 1.00 21.33 H new ATOM 0 HB3 LEU A 78 9.343 -22.442 -10.603 1.00 21.33 H new ATOM 0 HG LEU A 78 11.056 -24.100 -10.478 1.00 2.15 H new ATOM 0 HD11 LEU A 78 12.381 -24.794 -12.435 1.00 24.33 H new ATOM 0 HD12 LEU A 78 10.661 -25.210 -12.621 1.00 24.33 H new ATOM 0 HD13 LEU A 78 11.336 -23.809 -13.486 1.00 24.33 H new ATOM 0 HD21 LEU A 78 13.053 -22.809 -11.132 1.00 75.42 H new ATOM 0 HD22 LEU A 78 12.034 -21.747 -12.131 1.00 75.42 H new ATOM 0 HD23 LEU A 78 11.822 -21.777 -10.364 1.00 75.42 H new ATOM 1348 N PRO A 79 7.173 -23.872 -9.913 1.00 35.54 N ATOM 1349 CA PRO A 79 5.994 -23.598 -9.085 1.00 41.42 C ATOM 1350 C PRO A 79 5.796 -22.106 -8.835 1.00 62.44 C ATOM 1351 O PRO A 79 4.677 -21.597 -8.906 1.00 42.05 O ATOM 1352 CB PRO A 79 6.305 -24.323 -7.773 1.00 53.15 C ATOM 1353 CG PRO A 79 7.792 -24.391 -7.721 1.00 10.50 C ATOM 1354 CD PRO A 79 8.251 -24.519 -9.147 1.00 23.50 C ATOM 0 HA PRO A 79 5.073 -23.931 -9.564 1.00 41.42 H new ATOM 0 HB2 PRO A 79 5.903 -23.781 -6.917 1.00 53.15 H new ATOM 0 HB3 PRO A 79 5.862 -25.319 -7.756 1.00 53.15 H new ATOM 0 HG2 PRO A 79 8.207 -23.497 -7.256 1.00 10.50 H new ATOM 0 HG3 PRO A 79 8.123 -25.243 -7.127 1.00 10.50 H new ATOM 0 HD2 PRO A 79 9.209 -24.025 -9.306 1.00 23.50 H new ATOM 0 HD3 PRO A 79 8.379 -25.562 -9.436 1.00 23.50 H new ATOM 1362 N THR A 80 6.890 -21.410 -8.543 1.00 0.34 N ATOM 1363 CA THR A 80 6.836 -19.977 -8.282 1.00 5.14 C ATOM 1364 C THR A 80 7.177 -19.177 -9.534 1.00 2.24 C ATOM 1365 O THR A 80 7.719 -19.716 -10.500 1.00 14.53 O ATOM 1366 CB THR A 80 7.802 -19.575 -7.151 1.00 24.31 C ATOM 1367 OG1 THR A 80 7.799 -18.153 -6.985 1.00 75.03 O ATOM 1368 CG2 THR A 80 9.215 -20.052 -7.451 1.00 64.14 C ATOM 0 H THR A 80 7.824 -21.815 -8.481 1.00 0.34 H new ATOM 0 HA THR A 80 5.815 -19.750 -7.976 1.00 5.14 H new ATOM 0 HB THR A 80 7.463 -20.048 -6.229 1.00 24.31 H new ATOM 0 HG1 THR A 80 8.414 -17.907 -6.263 1.00 75.03 H new ATOM 0 HG21 THR A 80 9.879 -19.757 -6.639 1.00 64.14 H new ATOM 0 HG22 THR A 80 9.220 -21.138 -7.547 1.00 64.14 H new ATOM 0 HG23 THR A 80 9.560 -19.604 -8.383 1.00 64.14 H new ATOM 1376 N THR A 81 6.858 -17.887 -9.511 1.00 54.51 N ATOM 1377 CA THR A 81 7.129 -17.012 -10.645 1.00 5.12 C ATOM 1378 C THR A 81 8.029 -15.850 -10.239 1.00 55.42 C ATOM 1379 O THR A 81 8.494 -15.087 -11.087 1.00 3.44 O ATOM 1380 CB THR A 81 5.827 -16.453 -11.248 1.00 1.42 C ATOM 1381 OG1 THR A 81 4.894 -17.516 -11.471 1.00 2.23 O ATOM 1382 CG2 THR A 81 6.104 -15.731 -12.558 1.00 53.20 C ATOM 0 H THR A 81 6.411 -17.425 -8.719 1.00 54.51 H new ATOM 0 HA THR A 81 7.637 -17.616 -11.396 1.00 5.12 H new ATOM 0 HB THR A 81 5.402 -15.740 -10.541 1.00 1.42 H new ATOM 0 HG1 THR A 81 4.068 -17.152 -11.853 1.00 2.23 H new ATOM 0 HG21 THR A 81 5.170 -15.345 -12.965 1.00 53.20 H new ATOM 0 HG22 THR A 81 6.791 -14.904 -12.379 1.00 53.20 H new ATOM 0 HG23 THR A 81 6.550 -16.426 -13.269 1.00 53.20 H new ATOM 1390 N LEU A 82 8.270 -15.720 -8.939 1.00 73.04 N ATOM 1391 CA LEU A 82 9.115 -14.650 -8.421 1.00 12.10 C ATOM 1392 C LEU A 82 10.458 -15.197 -7.949 1.00 62.12 C ATOM 1393 O LEU A 82 10.693 -15.347 -6.750 1.00 34.21 O ATOM 1394 CB LEU A 82 8.411 -13.930 -7.269 1.00 23.41 C ATOM 1395 CG LEU A 82 7.674 -12.641 -7.633 1.00 4.01 C ATOM 1396 CD1 LEU A 82 7.064 -12.007 -6.393 1.00 12.21 C ATOM 1397 CD2 LEU A 82 8.616 -11.666 -8.324 1.00 51.34 C ATOM 0 H LEU A 82 7.892 -16.342 -8.225 1.00 73.04 H new ATOM 0 HA LEU A 82 9.296 -13.940 -9.228 1.00 12.10 H new ATOM 0 HB2 LEU A 82 7.696 -14.619 -6.819 1.00 23.41 H new ATOM 0 HB3 LEU A 82 9.153 -13.697 -6.505 1.00 23.41 H new ATOM 0 HG LEU A 82 6.868 -12.888 -8.324 1.00 4.01 H new ATOM 0 HD11 LEU A 82 6.544 -11.091 -6.671 1.00 12.21 H new ATOM 0 HD12 LEU A 82 6.358 -12.702 -5.939 1.00 12.21 H new ATOM 0 HD13 LEU A 82 7.853 -11.773 -5.678 1.00 12.21 H new ATOM 0 HD21 LEU A 82 8.075 -10.754 -8.576 1.00 51.34 H new ATOM 0 HD22 LEU A 82 9.443 -11.424 -7.657 1.00 51.34 H new ATOM 0 HD23 LEU A 82 9.006 -12.120 -9.235 1.00 51.34 H new ATOM 1409 N PHE A 83 11.338 -15.492 -8.900 1.00 43.53 N ATOM 1410 CA PHE A 83 12.659 -16.021 -8.582 1.00 44.23 C ATOM 1411 C PHE A 83 13.738 -15.323 -9.406 1.00 13.33 C ATOM 1412 O PHE A 83 13.455 -14.385 -10.152 1.00 22.01 O ATOM 1413 CB PHE A 83 12.703 -17.529 -8.838 1.00 10.22 C ATOM 1414 CG PHE A 83 12.101 -17.932 -10.153 1.00 54.54 C ATOM 1415 CD1 PHE A 83 12.467 -17.288 -11.324 1.00 43.23 C ATOM 1416 CD2 PHE A 83 11.168 -18.954 -10.219 1.00 61.13 C ATOM 1417 CE1 PHE A 83 11.914 -17.656 -12.536 1.00 11.00 C ATOM 1418 CE2 PHE A 83 10.611 -19.327 -11.428 1.00 64.04 C ATOM 1419 CZ PHE A 83 10.986 -18.678 -12.588 1.00 52.43 C ATOM 0 H PHE A 83 11.160 -15.374 -9.897 1.00 43.53 H new ATOM 0 HA PHE A 83 12.853 -15.832 -7.526 1.00 44.23 H new ATOM 0 HB2 PHE A 83 13.739 -17.865 -8.804 1.00 10.22 H new ATOM 0 HB3 PHE A 83 12.175 -18.041 -8.034 1.00 10.22 H new ATOM 0 HD1 PHE A 83 13.193 -16.489 -11.289 1.00 43.23 H new ATOM 0 HD2 PHE A 83 10.872 -19.466 -9.315 1.00 61.13 H new ATOM 0 HE1 PHE A 83 12.207 -17.145 -13.441 1.00 11.00 H new ATOM 0 HE2 PHE A 83 9.884 -20.125 -11.465 1.00 64.04 H new ATOM 0 HZ PHE A 83 10.554 -18.969 -13.534 1.00 52.43 H new ATOM 1429 N PHE A 84 14.975 -15.786 -9.264 1.00 30.41 N ATOM 1430 CA PHE A 84 16.097 -15.206 -9.993 1.00 20.53 C ATOM 1431 C PHE A 84 17.229 -16.219 -10.144 1.00 53.32 C ATOM 1432 O PHE A 84 17.246 -17.251 -9.473 1.00 60.13 O ATOM 1433 CB PHE A 84 16.608 -13.957 -9.273 1.00 45.44 C ATOM 1434 CG PHE A 84 17.261 -14.250 -7.953 1.00 1.12 C ATOM 1435 CD1 PHE A 84 18.456 -14.948 -7.896 1.00 24.25 C ATOM 1436 CD2 PHE A 84 16.679 -13.828 -6.768 1.00 52.34 C ATOM 1437 CE1 PHE A 84 19.060 -15.219 -6.682 1.00 32.51 C ATOM 1438 CE2 PHE A 84 17.278 -14.096 -5.552 1.00 53.40 C ATOM 1439 CZ PHE A 84 18.469 -14.793 -5.509 1.00 31.44 C ATOM 0 H PHE A 84 15.226 -16.561 -8.651 1.00 30.41 H new ATOM 0 HA PHE A 84 15.748 -14.927 -10.987 1.00 20.53 H new ATOM 0 HB2 PHE A 84 17.322 -13.443 -9.916 1.00 45.44 H new ATOM 0 HB3 PHE A 84 15.774 -13.273 -9.113 1.00 45.44 H new ATOM 0 HD1 PHE A 84 18.922 -15.285 -8.811 1.00 24.25 H new ATOM 0 HD2 PHE A 84 15.747 -13.284 -6.795 1.00 52.34 H new ATOM 0 HE1 PHE A 84 19.992 -15.763 -6.651 1.00 32.51 H new ATOM 0 HE2 PHE A 84 16.815 -13.760 -4.636 1.00 53.40 H new ATOM 0 HZ PHE A 84 18.938 -15.005 -4.559 1.00 31.44 H new ATOM 1449 N ILE A 85 18.171 -15.915 -11.030 1.00 61.34 N ATOM 1450 CA ILE A 85 19.306 -16.798 -11.270 1.00 3.41 C ATOM 1451 C ILE A 85 20.537 -16.332 -10.499 1.00 33.03 C ATOM 1452 O ILE A 85 20.702 -15.142 -10.235 1.00 15.43 O ATOM 1453 CB ILE A 85 19.653 -16.875 -12.769 1.00 34.14 C ATOM 1454 CG1 ILE A 85 20.048 -15.494 -13.295 1.00 41.01 C ATOM 1455 CG2 ILE A 85 18.476 -17.431 -13.556 1.00 73.21 C ATOM 1456 CD1 ILE A 85 20.186 -15.438 -14.800 1.00 53.24 C ATOM 0 H ILE A 85 18.171 -15.065 -11.593 1.00 61.34 H new ATOM 0 HA ILE A 85 19.014 -17.789 -10.921 1.00 3.41 H new ATOM 0 HB ILE A 85 20.501 -17.547 -12.897 1.00 34.14 H new ATOM 0 HG12 ILE A 85 19.300 -14.766 -12.979 1.00 41.01 H new ATOM 0 HG13 ILE A 85 20.993 -15.198 -12.840 1.00 41.01 H new ATOM 0 HG21 ILE A 85 18.736 -17.480 -14.613 1.00 73.21 H new ATOM 0 HG22 ILE A 85 18.237 -18.431 -13.195 1.00 73.21 H new ATOM 0 HG23 ILE A 85 17.611 -16.781 -13.424 1.00 73.21 H new ATOM 0 HD11 ILE A 85 20.468 -14.429 -15.102 1.00 53.24 H new ATOM 0 HD12 ILE A 85 20.954 -16.141 -15.121 1.00 53.24 H new ATOM 0 HD13 ILE A 85 19.235 -15.703 -15.263 1.00 53.24 H new ATOM 1468 N GLU A 86 21.398 -17.279 -10.142 1.00 64.41 N ATOM 1469 CA GLU A 86 22.615 -16.965 -9.402 1.00 32.31 C ATOM 1470 C GLU A 86 23.644 -16.294 -10.306 1.00 50.45 C ATOM 1471 O GLU A 86 24.520 -15.566 -9.837 1.00 61.23 O ATOM 1472 CB GLU A 86 23.209 -18.236 -8.791 1.00 30.02 C ATOM 1473 CG GLU A 86 24.446 -17.984 -7.945 1.00 50.12 C ATOM 1474 CD GLU A 86 24.345 -18.603 -6.565 1.00 22.42 C ATOM 1475 OE1 GLU A 86 23.333 -18.355 -5.876 1.00 61.43 O ATOM 1476 OE2 GLU A 86 25.278 -19.336 -6.173 1.00 13.51 O ATOM 0 H GLU A 86 21.276 -18.269 -10.353 1.00 64.41 H new ATOM 0 HA GLU A 86 22.354 -16.273 -8.601 1.00 32.31 H new ATOM 0 HB2 GLU A 86 22.451 -18.722 -8.176 1.00 30.02 H new ATOM 0 HB3 GLU A 86 23.462 -18.930 -9.592 1.00 30.02 H new ATOM 0 HG2 GLU A 86 25.320 -18.387 -8.457 1.00 50.12 H new ATOM 0 HG3 GLU A 86 24.602 -16.910 -7.847 1.00 50.12 H new ATOM 1483 N THR A 87 23.532 -16.543 -11.608 1.00 1.04 N ATOM 1484 CA THR A 87 24.453 -15.965 -12.578 1.00 55.15 C ATOM 1485 C THR A 87 24.152 -14.489 -12.810 1.00 54.41 C ATOM 1486 O THR A 87 24.915 -13.786 -13.473 1.00 70.33 O ATOM 1487 CB THR A 87 24.387 -16.708 -13.926 1.00 62.11 C ATOM 1488 OG1 THR A 87 25.375 -16.186 -14.822 1.00 21.32 O ATOM 1489 CG2 THR A 87 23.007 -16.574 -14.552 1.00 30.04 C ATOM 0 H THR A 87 22.812 -17.141 -12.014 1.00 1.04 H new ATOM 0 HA THR A 87 25.455 -16.068 -12.163 1.00 55.15 H new ATOM 0 HB THR A 87 24.584 -17.764 -13.743 1.00 62.11 H new ATOM 0 HG1 THR A 87 25.501 -15.230 -14.649 1.00 21.32 H new ATOM 0 HG21 THR A 87 22.985 -17.107 -15.503 1.00 30.04 H new ATOM 0 HG22 THR A 87 22.260 -16.999 -13.881 1.00 30.04 H new ATOM 0 HG23 THR A 87 22.785 -15.520 -14.722 1.00 30.04 H new ATOM 1497 N ASP A 88 23.036 -14.024 -12.259 1.00 53.33 N ATOM 1498 CA ASP A 88 22.635 -12.629 -12.405 1.00 32.14 C ATOM 1499 C ASP A 88 22.878 -11.856 -11.112 1.00 71.30 C ATOM 1500 O ASP A 88 22.900 -10.625 -11.108 1.00 62.25 O ATOM 1501 CB ASP A 88 21.160 -12.539 -12.798 1.00 15.32 C ATOM 1502 CG ASP A 88 20.739 -11.125 -13.148 1.00 44.22 C ATOM 1503 OD1 ASP A 88 21.630 -10.269 -13.332 1.00 4.14 O ATOM 1504 OD2 ASP A 88 19.520 -10.874 -13.240 1.00 34.32 O ATOM 0 H ASP A 88 22.393 -14.592 -11.707 1.00 53.33 H new ATOM 0 HA ASP A 88 23.241 -12.183 -13.194 1.00 32.14 H new ATOM 0 HB2 ASP A 88 20.974 -13.192 -13.651 1.00 15.32 H new ATOM 0 HB3 ASP A 88 20.545 -12.905 -11.976 1.00 15.32 H new ATOM 1509 N ILE A 89 23.058 -12.587 -10.017 1.00 2.10 N ATOM 1510 CA ILE A 89 23.299 -11.970 -8.719 1.00 4.23 C ATOM 1511 C ILE A 89 24.757 -12.123 -8.299 1.00 65.34 C ATOM 1512 O ILE A 89 25.321 -11.246 -7.645 1.00 24.21 O ATOM 1513 CB ILE A 89 22.397 -12.579 -7.629 1.00 51.14 C ATOM 1514 CG1 ILE A 89 20.948 -12.649 -8.117 1.00 3.20 C ATOM 1515 CG2 ILE A 89 22.491 -11.765 -6.347 1.00 63.33 C ATOM 1516 CD1 ILE A 89 20.315 -11.291 -8.326 1.00 70.23 C ATOM 0 H ILE A 89 23.041 -13.607 -10.003 1.00 2.10 H new ATOM 0 HA ILE A 89 23.063 -10.911 -8.825 1.00 4.23 H new ATOM 0 HB ILE A 89 22.740 -13.592 -7.418 1.00 51.14 H new ATOM 0 HG12 ILE A 89 20.915 -13.204 -9.054 1.00 3.20 H new ATOM 0 HG13 ILE A 89 20.356 -13.209 -7.393 1.00 3.20 H new ATOM 0 HG21 ILE A 89 21.848 -12.208 -5.587 1.00 63.33 H new ATOM 0 HG22 ILE A 89 23.522 -11.761 -5.993 1.00 63.33 H new ATOM 0 HG23 ILE A 89 22.171 -10.741 -6.542 1.00 63.33 H new ATOM 0 HD11 ILE A 89 19.289 -11.417 -8.672 1.00 70.23 H new ATOM 0 HD12 ILE A 89 20.316 -10.741 -7.385 1.00 70.23 H new ATOM 0 HD13 ILE A 89 20.884 -10.735 -9.072 1.00 70.23 H new ATOM 1528 N ARG A 90 25.363 -13.243 -8.682 1.00 51.34 N ATOM 1529 CA ARG A 90 26.756 -13.511 -8.347 1.00 20.11 C ATOM 1530 C ARG A 90 27.655 -12.364 -8.798 1.00 52.53 C ATOM 1531 O ARG A 90 28.351 -11.737 -8.000 1.00 5.03 O ATOM 1532 CB ARG A 90 27.216 -14.818 -8.994 1.00 61.45 C ATOM 1533 CG ARG A 90 28.697 -14.841 -9.336 1.00 21.04 C ATOM 1534 CD ARG A 90 29.210 -16.263 -9.499 1.00 35.44 C ATOM 1535 NE ARG A 90 28.768 -16.864 -10.754 1.00 54.14 N ATOM 1536 CZ ARG A 90 28.764 -18.173 -10.982 1.00 51.40 C ATOM 1537 NH1 ARG A 90 29.176 -19.013 -10.043 1.00 71.32 N ATOM 1538 NH2 ARG A 90 28.347 -18.643 -12.151 1.00 11.23 N ATOM 0 H ARG A 90 24.911 -13.979 -9.224 1.00 51.34 H new ATOM 0 HA ARG A 90 26.831 -13.604 -7.264 1.00 20.11 H new ATOM 0 HB2 ARG A 90 26.995 -15.645 -8.319 1.00 61.45 H new ATOM 0 HB3 ARG A 90 26.639 -14.986 -9.904 1.00 61.45 H new ATOM 0 HG2 ARG A 90 28.867 -14.284 -10.257 1.00 21.04 H new ATOM 0 HG3 ARG A 90 29.261 -14.338 -8.550 1.00 21.04 H new ATOM 0 HD2 ARG A 90 30.299 -16.262 -9.462 1.00 35.44 H new ATOM 0 HD3 ARG A 90 28.863 -16.871 -8.664 1.00 35.44 H new ATOM 0 HE ARG A 90 28.444 -16.245 -11.497 1.00 54.14 H new ATOM 0 HH11 ARG A 90 29.497 -18.655 -9.143 1.00 71.32 H new ATOM 0 HH12 ARG A 90 29.172 -20.018 -10.220 1.00 71.32 H new ATOM 0 HH21 ARG A 90 28.029 -17.999 -12.875 1.00 11.23 H new ATOM 0 HH22 ARG A 90 28.344 -19.648 -12.325 1.00 11.23 H new ATOM 1552 N PRO A 91 27.640 -12.081 -10.109 1.00 45.14 N ATOM 1553 CA PRO A 91 28.448 -11.008 -10.697 1.00 3.02 C ATOM 1554 C PRO A 91 27.954 -9.623 -10.293 1.00 44.00 C ATOM 1555 O PRO A 91 28.463 -8.609 -10.770 1.00 71.13 O ATOM 1556 CB PRO A 91 28.277 -11.219 -12.203 1.00 53.22 C ATOM 1557 CG PRO A 91 26.970 -11.920 -12.341 1.00 33.50 C ATOM 1558 CD PRO A 91 26.834 -12.787 -11.119 1.00 40.34 C ATOM 0 HA PRO A 91 29.485 -11.049 -10.363 1.00 3.02 H new ATOM 0 HB2 PRO A 91 28.275 -10.269 -12.738 1.00 53.22 H new ATOM 0 HB3 PRO A 91 29.091 -11.815 -12.614 1.00 53.22 H new ATOM 0 HG2 PRO A 91 26.149 -11.206 -12.406 1.00 33.50 H new ATOM 0 HG3 PRO A 91 26.943 -12.520 -13.250 1.00 33.50 H new ATOM 0 HD2 PRO A 91 25.794 -12.883 -10.808 1.00 40.34 H new ATOM 0 HD3 PRO A 91 27.207 -13.795 -11.298 1.00 40.34 H new ATOM 1566 N MET A 92 26.961 -9.588 -9.411 1.00 21.02 N ATOM 1567 CA MET A 92 26.400 -8.326 -8.942 1.00 20.21 C ATOM 1568 C MET A 92 26.861 -8.021 -7.520 1.00 64.14 C ATOM 1569 O MET A 92 26.890 -6.863 -7.101 1.00 65.14 O ATOM 1570 CB MET A 92 24.872 -8.372 -8.996 1.00 12.41 C ATOM 1571 CG MET A 92 24.288 -7.729 -10.244 1.00 24.31 C ATOM 1572 SD MET A 92 22.727 -6.886 -9.926 1.00 33.01 S ATOM 1573 CE MET A 92 22.725 -5.670 -11.241 1.00 12.11 C ATOM 0 H MET A 92 26.528 -10.418 -9.007 1.00 21.02 H new ATOM 0 HA MET A 92 26.756 -7.532 -9.599 1.00 20.21 H new ATOM 0 HB2 MET A 92 24.546 -9.411 -8.946 1.00 12.41 H new ATOM 0 HB3 MET A 92 24.470 -7.869 -8.116 1.00 12.41 H new ATOM 0 HG2 MET A 92 25.005 -7.016 -10.650 1.00 24.31 H new ATOM 0 HG3 MET A 92 24.135 -8.495 -11.004 1.00 24.31 H new ATOM 0 HE1 MET A 92 21.819 -5.068 -11.178 1.00 12.11 H new ATOM 0 HE2 MET A 92 23.597 -5.024 -11.141 1.00 12.11 H new ATOM 0 HE3 MET A 92 22.758 -6.177 -12.205 1.00 12.11 H new ATOM 1583 N LEU A 93 27.221 -9.066 -6.783 1.00 11.22 N ATOM 1584 CA LEU A 93 27.681 -8.909 -5.407 1.00 60.33 C ATOM 1585 C LEU A 93 29.053 -8.244 -5.364 1.00 53.54 C ATOM 1586 O LEU A 93 29.183 -7.052 -5.643 1.00 2.12 O ATOM 1587 CB LEU A 93 27.740 -10.270 -4.710 1.00 53.34 C ATOM 1588 CG LEU A 93 26.402 -10.987 -4.526 1.00 22.44 C ATOM 1589 CD1 LEU A 93 26.624 -12.420 -4.065 1.00 42.30 C ATOM 1590 CD2 LEU A 93 25.526 -10.236 -3.534 1.00 4.14 C ATOM 0 H LEU A 93 27.203 -10.030 -7.115 1.00 11.22 H new ATOM 0 HA LEU A 93 26.971 -8.269 -4.883 1.00 60.33 H new ATOM 0 HB2 LEU A 93 28.403 -10.920 -5.281 1.00 53.34 H new ATOM 0 HB3 LEU A 93 28.195 -10.134 -3.729 1.00 53.34 H new ATOM 0 HG LEU A 93 25.889 -11.011 -5.487 1.00 22.44 H new ATOM 0 HD11 LEU A 93 25.661 -12.915 -3.939 1.00 42.30 H new ATOM 0 HD12 LEU A 93 27.212 -12.955 -4.810 1.00 42.30 H new ATOM 0 HD13 LEU A 93 27.158 -12.418 -3.115 1.00 42.30 H new ATOM 0 HD21 LEU A 93 24.578 -10.761 -3.416 1.00 4.14 H new ATOM 0 HD22 LEU A 93 26.033 -10.180 -2.571 1.00 4.14 H new ATOM 0 HD23 LEU A 93 25.339 -9.228 -3.904 1.00 4.14 H new ATOM 1602 N GLN A 94 30.072 -9.022 -5.016 1.00 30.11 N ATOM 1603 CA GLN A 94 31.434 -8.507 -4.938 1.00 61.54 C ATOM 1604 C GLN A 94 32.418 -9.470 -5.595 1.00 31.31 C ATOM 1605 O GLN A 94 32.342 -10.683 -5.395 1.00 3.32 O ATOM 1606 CB GLN A 94 31.830 -8.271 -3.480 1.00 41.41 C ATOM 1607 CG GLN A 94 31.918 -6.800 -3.105 1.00 30.24 C ATOM 1608 CD GLN A 94 33.110 -6.494 -2.220 1.00 3.01 C ATOM 1609 OE1 GLN A 94 33.436 -7.258 -1.311 1.00 13.25 O ATOM 1610 NE2 GLN A 94 33.770 -5.372 -2.482 1.00 53.43 N ATOM 0 H GLN A 94 29.981 -10.011 -4.784 1.00 30.11 H new ATOM 0 HA GLN A 94 31.468 -7.559 -5.474 1.00 61.54 H new ATOM 0 HB2 GLN A 94 31.104 -8.760 -2.831 1.00 41.41 H new ATOM 0 HB3 GLN A 94 32.794 -8.744 -3.293 1.00 41.41 H new ATOM 0 HG2 GLN A 94 31.981 -6.201 -4.013 1.00 30.24 H new ATOM 0 HG3 GLN A 94 31.003 -6.505 -2.591 1.00 30.24 H new ATOM 0 HE21 GLN A 94 33.466 -4.768 -3.245 1.00 53.43 H new ATOM 0 HE22 GLN A 94 34.581 -5.115 -1.920 1.00 53.43 H new ATOM 1619 N ASP A 95 33.340 -8.923 -6.379 1.00 53.32 N ATOM 1620 CA ASP A 95 34.339 -9.733 -7.065 1.00 65.11 C ATOM 1621 C ASP A 95 35.262 -10.421 -6.063 1.00 51.33 C ATOM 1622 O ASP A 95 35.905 -11.421 -6.382 1.00 43.21 O ATOM 1623 CB ASP A 95 35.160 -8.867 -8.022 1.00 2.12 C ATOM 1624 CG ASP A 95 35.528 -9.601 -9.296 1.00 52.24 C ATOM 1625 OD1 ASP A 95 34.743 -9.536 -10.265 1.00 51.23 O ATOM 1626 OD2 ASP A 95 36.600 -10.241 -9.325 1.00 0.21 O ATOM 0 H ASP A 95 33.416 -7.921 -6.555 1.00 53.32 H new ATOM 0 HA ASP A 95 33.818 -10.500 -7.638 1.00 65.11 H new ATOM 0 HB2 ASP A 95 34.593 -7.971 -8.273 1.00 2.12 H new ATOM 0 HB3 ASP A 95 36.070 -8.538 -7.520 1.00 2.12 H new ATOM 1631 N ARG A 96 35.322 -9.877 -4.852 1.00 72.20 N ATOM 1632 CA ARG A 96 36.167 -10.437 -3.804 1.00 43.05 C ATOM 1633 C ARG A 96 35.341 -11.259 -2.820 1.00 73.42 C ATOM 1634 O ARG A 96 35.883 -11.882 -1.906 1.00 71.43 O ATOM 1635 CB ARG A 96 36.902 -9.320 -3.061 1.00 51.22 C ATOM 1636 CG ARG A 96 36.001 -8.166 -2.651 1.00 62.14 C ATOM 1637 CD ARG A 96 36.770 -7.108 -1.875 1.00 74.02 C ATOM 1638 NE ARG A 96 37.913 -6.600 -2.628 1.00 3.22 N ATOM 1639 CZ ARG A 96 38.924 -5.940 -2.073 1.00 13.13 C ATOM 1640 NH1 ARG A 96 38.932 -5.710 -0.767 1.00 1.00 N ATOM 1641 NH2 ARG A 96 39.929 -5.509 -2.824 1.00 52.11 N ATOM 0 H ARG A 96 34.796 -9.049 -4.572 1.00 72.20 H new ATOM 0 HA ARG A 96 36.898 -11.094 -4.275 1.00 43.05 H new ATOM 0 HB2 ARG A 96 37.373 -9.736 -2.171 1.00 51.22 H new ATOM 0 HB3 ARG A 96 37.702 -8.938 -3.696 1.00 51.22 H new ATOM 0 HG2 ARG A 96 35.557 -7.716 -3.539 1.00 62.14 H new ATOM 0 HG3 ARG A 96 35.181 -8.543 -2.040 1.00 62.14 H new ATOM 0 HD2 ARG A 96 36.102 -6.282 -1.629 1.00 74.02 H new ATOM 0 HD3 ARG A 96 37.116 -7.530 -0.932 1.00 74.02 H new ATOM 0 HE ARG A 96 37.937 -6.760 -3.635 1.00 3.22 H new ATOM 0 HH11 ARG A 96 38.161 -6.040 -0.186 1.00 1.00 H new ATOM 0 HH12 ARG A 96 39.709 -5.203 -0.343 1.00 1.00 H new ATOM 0 HH21 ARG A 96 39.926 -5.684 -3.829 1.00 52.11 H new ATOM 0 HH22 ARG A 96 40.704 -5.003 -2.397 1.00 52.11 H new ATOM 1655 N LEU A 97 34.026 -11.257 -3.013 1.00 4.54 N ATOM 1656 CA LEU A 97 33.124 -12.002 -2.142 1.00 10.12 C ATOM 1657 C LEU A 97 33.358 -13.503 -2.272 1.00 63.50 C ATOM 1658 O LEU A 97 33.041 -14.272 -1.364 1.00 61.23 O ATOM 1659 CB LEU A 97 31.669 -11.670 -2.478 1.00 61.22 C ATOM 1660 CG LEU A 97 30.613 -12.254 -1.539 1.00 1.32 C ATOM 1661 CD1 LEU A 97 30.972 -11.968 -0.089 1.00 23.31 C ATOM 1662 CD2 LEU A 97 29.237 -11.694 -1.870 1.00 3.15 C ATOM 0 H LEU A 97 33.561 -10.748 -3.765 1.00 4.54 H new ATOM 0 HA LEU A 97 33.329 -11.709 -1.112 1.00 10.12 H new ATOM 0 HB2 LEU A 97 31.558 -10.586 -2.488 1.00 61.22 H new ATOM 0 HB3 LEU A 97 31.461 -12.021 -3.489 1.00 61.22 H new ATOM 0 HG LEU A 97 30.587 -13.335 -1.679 1.00 1.32 H new ATOM 0 HD11 LEU A 97 30.209 -12.391 0.565 1.00 23.31 H new ATOM 0 HD12 LEU A 97 31.938 -12.417 0.142 1.00 23.31 H new ATOM 0 HD13 LEU A 97 31.026 -10.891 0.067 1.00 23.31 H new ATOM 0 HD21 LEU A 97 28.498 -12.121 -1.192 1.00 3.15 H new ATOM 0 HD22 LEU A 97 29.249 -10.610 -1.758 1.00 3.15 H new ATOM 0 HD23 LEU A 97 28.977 -11.950 -2.897 1.00 3.15 H new ATOM 1674 N ARG A 98 33.917 -13.914 -3.406 1.00 4.33 N ATOM 1675 CA ARG A 98 34.195 -15.323 -3.654 1.00 64.22 C ATOM 1676 C ARG A 98 32.902 -16.131 -3.711 1.00 10.33 C ATOM 1677 O ARG A 98 31.842 -15.682 -3.275 1.00 34.14 O ATOM 1678 CB ARG A 98 35.112 -15.884 -2.565 1.00 41.23 C ATOM 1679 CG ARG A 98 36.550 -16.076 -3.019 1.00 72.41 C ATOM 1680 CD ARG A 98 37.166 -17.323 -2.404 1.00 71.31 C ATOM 1681 NE ARG A 98 38.210 -17.893 -3.252 1.00 33.22 N ATOM 1682 CZ ARG A 98 39.096 -18.786 -2.826 1.00 3.01 C ATOM 1683 NH1 ARG A 98 39.065 -19.209 -1.570 1.00 4.44 N ATOM 1684 NH2 ARG A 98 40.016 -19.258 -3.658 1.00 22.14 N ATOM 0 H ARG A 98 34.186 -13.291 -4.167 1.00 4.33 H new ATOM 0 HA ARG A 98 34.696 -15.404 -4.619 1.00 64.22 H new ATOM 0 HB2 ARG A 98 35.097 -15.211 -1.707 1.00 41.23 H new ATOM 0 HB3 ARG A 98 34.716 -16.841 -2.226 1.00 41.23 H new ATOM 0 HG2 ARG A 98 36.583 -16.151 -4.106 1.00 72.41 H new ATOM 0 HG3 ARG A 98 37.140 -15.203 -2.742 1.00 72.41 H new ATOM 0 HD2 ARG A 98 37.586 -17.077 -1.429 1.00 71.31 H new ATOM 0 HD3 ARG A 98 36.388 -18.068 -2.237 1.00 71.31 H new ATOM 0 HE ARG A 98 38.261 -17.589 -4.224 1.00 33.22 H new ATOM 0 HH11 ARG A 98 38.359 -18.849 -0.928 1.00 4.44 H new ATOM 0 HH12 ARG A 98 39.747 -19.895 -1.246 1.00 4.44 H new ATOM 0 HH21 ARG A 98 40.043 -18.935 -4.625 1.00 22.14 H new ATOM 0 HH22 ARG A 98 40.696 -19.944 -3.330 1.00 22.14 H new ATOM 1698 N PRO A 99 32.989 -17.351 -4.261 1.00 43.21 N ATOM 1699 CA PRO A 99 31.836 -18.246 -4.388 1.00 32.52 C ATOM 1700 C PRO A 99 31.366 -18.781 -3.039 1.00 62.22 C ATOM 1701 O PRO A 99 31.526 -19.965 -2.740 1.00 52.43 O ATOM 1702 CB PRO A 99 32.367 -19.387 -5.260 1.00 34.11 C ATOM 1703 CG PRO A 99 33.838 -19.386 -5.030 1.00 65.22 C ATOM 1704 CD PRO A 99 34.221 -17.950 -4.802 1.00 21.04 C ATOM 0 HA PRO A 99 30.969 -17.737 -4.809 1.00 32.52 H new ATOM 0 HB2 PRO A 99 31.923 -20.341 -4.977 1.00 34.11 H new ATOM 0 HB3 PRO A 99 32.131 -19.225 -6.312 1.00 34.11 H new ATOM 0 HG2 PRO A 99 34.099 -20.001 -4.168 1.00 65.22 H new ATOM 0 HG3 PRO A 99 34.367 -19.799 -5.888 1.00 65.22 H new ATOM 0 HD2 PRO A 99 35.052 -17.862 -4.102 1.00 21.04 H new ATOM 0 HD3 PRO A 99 34.531 -17.465 -5.727 1.00 21.04 H new ATOM 1712 N SER A 100 30.786 -17.902 -2.229 1.00 1.14 N ATOM 1713 CA SER A 100 30.296 -18.285 -0.910 1.00 21.42 C ATOM 1714 C SER A 100 28.793 -18.547 -0.944 1.00 3.45 C ATOM 1715 O SER A 100 28.240 -19.176 -0.041 1.00 5.40 O ATOM 1716 CB SER A 100 30.612 -17.192 0.113 1.00 64.42 C ATOM 1717 OG SER A 100 30.328 -15.907 -0.411 1.00 4.43 O ATOM 0 H SER A 100 30.644 -16.919 -2.463 1.00 1.14 H new ATOM 0 HA SER A 100 30.801 -19.205 -0.615 1.00 21.42 H new ATOM 0 HB2 SER A 100 30.027 -17.357 1.018 1.00 64.42 H new ATOM 0 HB3 SER A 100 31.663 -17.248 0.397 1.00 64.42 H new ATOM 0 HG SER A 100 31.164 -15.469 -0.675 1.00 4.43 H new ATOM 1723 N PHE A 101 28.138 -18.059 -1.991 1.00 53.34 N ATOM 1724 CA PHE A 101 26.699 -18.238 -2.144 1.00 14.42 C ATOM 1725 C PHE A 101 26.312 -19.704 -1.977 1.00 62.43 C ATOM 1726 O PHE A 101 25.415 -20.037 -1.203 1.00 5.11 O ATOM 1727 CB PHE A 101 26.242 -17.731 -3.514 1.00 5.24 C ATOM 1728 CG PHE A 101 24.904 -17.050 -3.486 1.00 1.45 C ATOM 1729 CD1 PHE A 101 23.811 -17.664 -2.896 1.00 24.34 C ATOM 1730 CD2 PHE A 101 24.739 -15.794 -4.048 1.00 72.45 C ATOM 1731 CE1 PHE A 101 22.579 -17.040 -2.869 1.00 53.12 C ATOM 1732 CE2 PHE A 101 23.508 -15.165 -4.025 1.00 5.13 C ATOM 1733 CZ PHE A 101 22.427 -15.788 -3.433 1.00 63.22 C ATOM 0 H PHE A 101 28.581 -17.536 -2.747 1.00 53.34 H new ATOM 0 HA PHE A 101 26.202 -17.658 -1.366 1.00 14.42 H new ATOM 0 HB2 PHE A 101 26.986 -17.036 -3.902 1.00 5.24 H new ATOM 0 HB3 PHE A 101 26.199 -18.571 -4.207 1.00 5.24 H new ATOM 0 HD1 PHE A 101 23.924 -18.642 -2.452 1.00 24.34 H new ATOM 0 HD2 PHE A 101 25.582 -15.301 -4.509 1.00 72.45 H new ATOM 0 HE1 PHE A 101 21.735 -17.531 -2.407 1.00 53.12 H new ATOM 0 HE2 PHE A 101 23.392 -14.188 -4.469 1.00 5.13 H new ATOM 0 HZ PHE A 101 21.465 -15.298 -3.411 1.00 63.22 H new ATOM 1743 N ALA A 102 26.996 -20.577 -2.711 1.00 34.05 N ATOM 1744 CA ALA A 102 26.726 -22.008 -2.644 1.00 12.13 C ATOM 1745 C ALA A 102 26.800 -22.514 -1.207 1.00 55.10 C ATOM 1746 O ALA A 102 26.222 -23.548 -0.871 1.00 70.25 O ATOM 1747 CB ALA A 102 27.703 -22.771 -3.525 1.00 25.00 C ATOM 0 H ALA A 102 27.741 -20.318 -3.358 1.00 34.05 H new ATOM 0 HA ALA A 102 25.714 -22.179 -3.010 1.00 12.13 H new ATOM 0 HB1 ALA A 102 27.490 -23.838 -3.465 1.00 25.00 H new ATOM 0 HB2 ALA A 102 27.599 -22.437 -4.557 1.00 25.00 H new ATOM 0 HB3 ALA A 102 28.722 -22.585 -3.185 1.00 25.00 H new ATOM 1753 N LYS A 103 27.514 -21.779 -0.362 1.00 3.02 N ATOM 1754 CA LYS A 103 27.664 -22.152 1.040 1.00 71.23 C ATOM 1755 C LYS A 103 26.650 -21.417 1.910 1.00 53.31 C ATOM 1756 O LYS A 103 26.328 -21.858 3.012 1.00 31.44 O ATOM 1757 CB LYS A 103 29.083 -21.845 1.522 1.00 44.11 C ATOM 1758 CG LYS A 103 30.050 -23.003 1.345 1.00 30.21 C ATOM 1759 CD LYS A 103 30.698 -22.984 -0.029 1.00 51.12 C ATOM 1760 CE LYS A 103 31.429 -24.286 -0.319 1.00 54.03 C ATOM 1761 NZ LYS A 103 32.745 -24.350 0.374 1.00 40.51 N ATOM 0 H LYS A 103 27.999 -20.920 -0.624 1.00 3.02 H new ATOM 0 HA LYS A 103 27.482 -23.223 1.126 1.00 71.23 H new ATOM 0 HB2 LYS A 103 29.463 -20.979 0.979 1.00 44.11 H new ATOM 0 HB3 LYS A 103 29.048 -21.570 2.576 1.00 44.11 H new ATOM 0 HG2 LYS A 103 30.822 -22.954 2.113 1.00 30.21 H new ATOM 0 HG3 LYS A 103 29.520 -23.945 1.485 1.00 30.21 H new ATOM 0 HD2 LYS A 103 29.935 -22.816 -0.790 1.00 51.12 H new ATOM 0 HD3 LYS A 103 31.398 -22.151 -0.091 1.00 51.12 H new ATOM 0 HE2 LYS A 103 30.811 -25.127 -0.004 1.00 54.03 H new ATOM 0 HE3 LYS A 103 31.579 -24.386 -1.394 1.00 54.03 H new ATOM 0 HZ1 LYS A 103 33.211 -25.252 0.151 1.00 40.51 H new ATOM 0 HZ2 LYS A 103 33.344 -23.562 0.055 1.00 40.51 H new ATOM 0 HZ3 LYS A 103 32.600 -24.280 1.401 1.00 40.51 H new ATOM 1775 N ALA A 104 26.149 -20.293 1.406 1.00 31.51 N ATOM 1776 CA ALA A 104 25.169 -19.499 2.136 1.00 33.21 C ATOM 1777 C ALA A 104 23.754 -20.015 1.894 1.00 42.21 C ATOM 1778 O ALA A 104 22.840 -19.734 2.670 1.00 70.14 O ATOM 1779 CB ALA A 104 25.274 -18.035 1.738 1.00 41.51 C ATOM 0 H ALA A 104 26.406 -19.913 0.495 1.00 31.51 H new ATOM 0 HA ALA A 104 25.384 -19.591 3.201 1.00 33.21 H new ATOM 0 HB1 ALA A 104 24.536 -17.454 2.291 1.00 41.51 H new ATOM 0 HB2 ALA A 104 26.273 -17.666 1.969 1.00 41.51 H new ATOM 0 HB3 ALA A 104 25.088 -17.934 0.669 1.00 41.51 H new ATOM 1785 N ILE A 105 23.581 -20.769 0.814 1.00 42.14 N ATOM 1786 CA ILE A 105 22.278 -21.323 0.470 1.00 34.44 C ATOM 1787 C ILE A 105 21.613 -21.960 1.687 1.00 45.23 C ATOM 1788 O ILE A 105 20.465 -21.668 2.022 1.00 43.12 O ATOM 1789 CB ILE A 105 22.390 -22.376 -0.648 1.00 44.23 C ATOM 1790 CG1 ILE A 105 22.801 -21.711 -1.964 1.00 21.40 C ATOM 1791 CG2 ILE A 105 21.072 -23.118 -0.812 1.00 44.22 C ATOM 1792 CD1 ILE A 105 21.997 -20.473 -2.292 1.00 4.41 C ATOM 0 H ILE A 105 24.327 -21.010 0.162 1.00 42.14 H new ATOM 0 HA ILE A 105 21.666 -20.493 0.116 1.00 34.44 H new ATOM 0 HB ILE A 105 23.158 -23.098 -0.371 1.00 44.23 H new ATOM 0 HG12 ILE A 105 23.857 -21.446 -1.913 1.00 21.40 H new ATOM 0 HG13 ILE A 105 22.692 -22.431 -2.775 1.00 21.40 H new ATOM 0 HG21 ILE A 105 21.168 -23.859 -1.606 1.00 44.22 H new ATOM 0 HG22 ILE A 105 20.817 -23.618 0.122 1.00 44.22 H new ATOM 0 HG23 ILE A 105 20.285 -22.409 -1.070 1.00 44.22 H new ATOM 0 HD11 ILE A 105 22.342 -20.055 -3.237 1.00 4.41 H new ATOM 0 HD12 ILE A 105 20.942 -20.736 -2.375 1.00 4.41 H new ATOM 0 HD13 ILE A 105 22.126 -19.735 -1.500 1.00 4.41 H new ATOM 1804 N PRO A 106 22.352 -22.850 2.366 1.00 51.10 N ATOM 1805 CA PRO A 106 21.856 -23.545 3.558 1.00 50.24 C ATOM 1806 C PRO A 106 21.706 -22.610 4.753 1.00 34.21 C ATOM 1807 O PRO A 106 20.899 -22.859 5.650 1.00 54.13 O ATOM 1808 CB PRO A 106 22.936 -24.594 3.832 1.00 63.02 C ATOM 1809 CG PRO A 106 24.175 -24.029 3.227 1.00 60.44 C ATOM 1810 CD PRO A 106 23.728 -23.246 2.023 1.00 22.23 C ATOM 0 HA PRO A 106 20.863 -23.967 3.401 1.00 50.24 H new ATOM 0 HB2 PRO A 106 23.060 -24.765 4.901 1.00 63.02 H new ATOM 0 HB3 PRO A 106 22.679 -25.554 3.384 1.00 63.02 H new ATOM 0 HG2 PRO A 106 24.699 -23.389 3.937 1.00 60.44 H new ATOM 0 HG3 PRO A 106 24.867 -24.822 2.942 1.00 60.44 H new ATOM 0 HD2 PRO A 106 24.364 -22.378 1.849 1.00 22.23 H new ATOM 0 HD3 PRO A 106 23.758 -23.851 1.116 1.00 22.23 H new ATOM 1818 N CYS A 107 22.486 -21.535 4.760 1.00 61.44 N ATOM 1819 CA CYS A 107 22.440 -20.563 5.846 1.00 75.20 C ATOM 1820 C CYS A 107 21.269 -19.602 5.666 1.00 70.22 C ATOM 1821 O CYS A 107 20.834 -18.951 6.617 1.00 70.32 O ATOM 1822 CB CYS A 107 23.752 -19.781 5.914 1.00 13.35 C ATOM 1823 SG CYS A 107 25.230 -20.799 5.701 1.00 25.13 S ATOM 0 H CYS A 107 23.158 -21.314 4.025 1.00 61.44 H new ATOM 0 HA CYS A 107 22.301 -21.106 6.781 1.00 75.20 H new ATOM 0 HB2 CYS A 107 23.742 -19.008 5.145 1.00 13.35 H new ATOM 0 HB3 CYS A 107 23.810 -19.272 6.876 1.00 13.35 H new ATOM 0 HG CYS A 107 25.292 -21.222 4.473 1.00 25.13 H new ATOM 1829 N LEU A 108 20.764 -19.517 4.440 1.00 0.41 N ATOM 1830 CA LEU A 108 19.644 -18.633 4.134 1.00 61.31 C ATOM 1831 C LEU A 108 18.316 -19.370 4.272 1.00 72.33 C ATOM 1832 O LEU A 108 17.305 -18.781 4.654 1.00 34.32 O ATOM 1833 CB LEU A 108 19.784 -18.072 2.718 1.00 43.30 C ATOM 1834 CG LEU A 108 20.490 -16.721 2.599 1.00 42.43 C ATOM 1835 CD1 LEU A 108 19.586 -15.601 3.089 1.00 53.41 C ATOM 1836 CD2 LEU A 108 21.798 -16.732 3.377 1.00 40.44 C ATOM 0 H LEU A 108 21.112 -20.049 3.642 1.00 0.41 H new ATOM 0 HA LEU A 108 19.657 -17.809 4.848 1.00 61.31 H new ATOM 0 HB2 LEU A 108 20.327 -18.798 2.113 1.00 43.30 H new ATOM 0 HB3 LEU A 108 18.788 -17.978 2.286 1.00 43.30 H new ATOM 0 HG LEU A 108 20.717 -16.543 1.548 1.00 42.43 H new ATOM 0 HD11 LEU A 108 20.106 -14.647 2.997 1.00 53.41 H new ATOM 0 HD12 LEU A 108 18.677 -15.578 2.489 1.00 53.41 H new ATOM 0 HD13 LEU A 108 19.327 -15.773 4.134 1.00 53.41 H new ATOM 0 HD21 LEU A 108 22.287 -15.762 3.281 1.00 40.44 H new ATOM 0 HD22 LEU A 108 21.594 -16.933 4.429 1.00 40.44 H new ATOM 0 HD23 LEU A 108 22.451 -17.509 2.979 1.00 40.44 H new ATOM 1848 N ARG A 109 18.327 -20.662 3.960 1.00 74.14 N ATOM 1849 CA ARG A 109 17.123 -21.480 4.050 1.00 40.14 C ATOM 1850 C ARG A 109 16.939 -22.023 5.464 1.00 41.22 C ATOM 1851 O ARG A 109 15.817 -22.283 5.899 1.00 30.21 O ATOM 1852 CB ARG A 109 17.192 -22.638 3.052 1.00 12.23 C ATOM 1853 CG ARG A 109 18.370 -23.570 3.281 1.00 5.32 C ATOM 1854 CD ARG A 109 18.611 -24.469 2.079 1.00 20.41 C ATOM 1855 NE ARG A 109 17.395 -25.164 1.663 1.00 4.40 N ATOM 1856 CZ ARG A 109 17.364 -26.075 0.697 1.00 35.12 C ATOM 1857 NH1 ARG A 109 18.475 -26.401 0.052 1.00 51.24 N ATOM 1858 NH2 ARG A 109 16.218 -26.663 0.376 1.00 63.22 N ATOM 0 H ARG A 109 19.156 -21.165 3.643 1.00 74.14 H new ATOM 0 HA ARG A 109 16.267 -20.850 3.807 1.00 40.14 H new ATOM 0 HB2 ARG A 109 16.268 -23.213 3.111 1.00 12.23 H new ATOM 0 HB3 ARG A 109 17.251 -22.233 2.042 1.00 12.23 H new ATOM 0 HG2 ARG A 109 19.266 -22.983 3.483 1.00 5.32 H new ATOM 0 HG3 ARG A 109 18.185 -24.182 4.163 1.00 5.32 H new ATOM 0 HD2 ARG A 109 18.989 -23.872 1.249 1.00 20.41 H new ATOM 0 HD3 ARG A 109 19.382 -25.201 2.322 1.00 20.41 H new ATOM 0 HE ARG A 109 16.523 -24.937 2.140 1.00 4.40 H new ATOM 0 HH11 ARG A 109 19.357 -25.952 0.297 1.00 51.24 H new ATOM 0 HH12 ARG A 109 18.448 -27.101 -0.689 1.00 51.24 H new ATOM 0 HH21 ARG A 109 15.361 -26.415 0.871 1.00 63.22 H new ATOM 0 HH22 ARG A 109 16.194 -27.363 -0.366 1.00 63.22 H new ATOM 1872 N HIS A 110 18.049 -22.192 6.176 1.00 15.33 N ATOM 1873 CA HIS A 110 18.010 -22.704 7.542 1.00 52.35 C ATOM 1874 C HIS A 110 17.106 -21.843 8.419 1.00 33.20 C ATOM 1875 O HIS A 110 16.628 -22.291 9.462 1.00 61.22 O ATOM 1876 CB HIS A 110 19.419 -22.749 8.132 1.00 65.22 C ATOM 1877 CG HIS A 110 19.444 -23.023 9.604 1.00 32.40 C ATOM 1878 ND1 HIS A 110 18.988 -24.201 10.158 1.00 53.11 N ATOM 1879 CD2 HIS A 110 19.875 -22.265 10.639 1.00 51.32 C ATOM 1880 CE1 HIS A 110 19.136 -24.154 11.470 1.00 75.02 C ATOM 1881 NE2 HIS A 110 19.672 -22.990 11.787 1.00 3.33 N ATOM 0 H HIS A 110 18.985 -21.982 5.830 1.00 15.33 H new ATOM 0 HA HIS A 110 17.603 -23.715 7.514 1.00 52.35 H new ATOM 0 HB2 HIS A 110 19.995 -23.519 7.618 1.00 65.22 H new ATOM 0 HB3 HIS A 110 19.915 -21.798 7.939 1.00 65.22 H new ATOM 0 HD2 HIS A 110 20.300 -21.274 10.574 1.00 51.32 H new ATOM 0 HE1 HIS A 110 18.865 -24.935 12.165 1.00 75.02 H new ATOM 0 HE2 HIS A 110 19.899 -22.680 12.732 1.00 3.33 H new ATOM 1889 N ILE A 111 16.876 -20.607 7.990 1.00 1.32 N ATOM 1890 CA ILE A 111 16.029 -19.685 8.737 1.00 44.42 C ATOM 1891 C ILE A 111 14.627 -19.622 8.142 1.00 51.53 C ATOM 1892 O ILE A 111 13.702 -19.094 8.760 1.00 4.20 O ATOM 1893 CB ILE A 111 16.628 -18.266 8.763 1.00 42.12 C ATOM 1894 CG1 ILE A 111 17.064 -17.847 7.357 1.00 13.21 C ATOM 1895 CG2 ILE A 111 17.803 -18.204 9.728 1.00 71.34 C ATOM 1896 CD1 ILE A 111 17.526 -16.409 7.271 1.00 22.13 C ATOM 0 H ILE A 111 17.264 -20.221 7.129 1.00 1.32 H new ATOM 0 HA ILE A 111 15.971 -20.065 9.757 1.00 44.42 H new ATOM 0 HB ILE A 111 15.863 -17.571 9.108 1.00 42.12 H new ATOM 0 HG12 ILE A 111 17.872 -18.500 7.026 1.00 13.21 H new ATOM 0 HG13 ILE A 111 16.232 -17.995 6.668 1.00 13.21 H new ATOM 0 HG21 ILE A 111 18.215 -17.195 9.735 1.00 71.34 H new ATOM 0 HG22 ILE A 111 17.464 -18.465 10.731 1.00 71.34 H new ATOM 0 HG23 ILE A 111 18.572 -18.908 9.410 1.00 71.34 H new ATOM 0 HD11 ILE A 111 17.820 -16.182 6.246 1.00 22.13 H new ATOM 0 HD12 ILE A 111 16.713 -15.747 7.571 1.00 22.13 H new ATOM 0 HD13 ILE A 111 18.378 -16.260 7.934 1.00 22.13 H new ATOM 1908 N ARG A 112 14.476 -20.165 6.938 1.00 13.23 N ATOM 1909 CA ARG A 112 13.186 -20.171 6.259 1.00 15.04 C ATOM 1910 C ARG A 112 12.846 -18.783 5.724 1.00 2.11 C ATOM 1911 O ARG A 112 11.801 -18.220 6.050 1.00 42.41 O ATOM 1912 CB ARG A 112 12.086 -20.645 7.212 1.00 3.41 C ATOM 1913 CG ARG A 112 11.048 -21.536 6.549 1.00 3.44 C ATOM 1914 CD ARG A 112 11.480 -22.994 6.557 1.00 53.24 C ATOM 1915 NE ARG A 112 10.361 -23.894 6.825 1.00 64.14 N ATOM 1916 CZ ARG A 112 9.743 -23.969 7.998 1.00 41.01 C ATOM 1917 NH1 ARG A 112 10.132 -23.201 9.006 1.00 1.21 N ATOM 1918 NH2 ARG A 112 8.733 -24.813 8.164 1.00 21.33 N ATOM 0 H ARG A 112 15.231 -20.606 6.413 1.00 13.23 H new ATOM 0 HA ARG A 112 13.251 -20.860 5.417 1.00 15.04 H new ATOM 0 HB2 ARG A 112 12.543 -21.188 8.040 1.00 3.41 H new ATOM 0 HB3 ARG A 112 11.587 -19.775 7.638 1.00 3.41 H new ATOM 0 HG2 ARG A 112 10.095 -21.435 7.068 1.00 3.44 H new ATOM 0 HG3 ARG A 112 10.888 -21.208 5.522 1.00 3.44 H new ATOM 0 HD2 ARG A 112 11.925 -23.246 5.594 1.00 53.24 H new ATOM 0 HD3 ARG A 112 12.252 -23.140 7.313 1.00 53.24 H new ATOM 0 HE ARG A 112 10.037 -24.498 6.070 1.00 64.14 H new ATOM 0 HH11 ARG A 112 10.908 -22.550 8.882 1.00 1.21 H new ATOM 0 HH12 ARG A 112 9.656 -23.261 9.906 1.00 1.21 H new ATOM 0 HH21 ARG A 112 8.431 -25.405 7.390 1.00 21.33 H new ATOM 0 HH22 ARG A 112 8.259 -24.870 9.065 1.00 21.33 H new ATOM 1932 N ARG A 113 13.737 -18.238 4.902 1.00 55.42 N ATOM 1933 CA ARG A 113 13.532 -16.915 4.323 1.00 63.21 C ATOM 1934 C ARG A 113 13.525 -16.984 2.799 1.00 72.34 C ATOM 1935 O ARG A 113 12.818 -16.223 2.137 1.00 64.34 O ATOM 1936 CB ARG A 113 14.625 -15.954 4.795 1.00 32.12 C ATOM 1937 CG ARG A 113 14.530 -15.602 6.271 1.00 51.23 C ATOM 1938 CD ARG A 113 15.246 -14.296 6.579 1.00 61.22 C ATOM 1939 NE ARG A 113 14.364 -13.141 6.435 1.00 22.01 N ATOM 1940 CZ ARG A 113 13.411 -12.831 7.307 1.00 22.00 C ATOM 1941 NH1 ARG A 113 13.218 -13.586 8.380 1.00 63.14 N ATOM 1942 NH2 ARG A 113 12.649 -11.763 7.107 1.00 21.30 N ATOM 0 H ARG A 113 14.607 -18.691 4.622 1.00 55.42 H new ATOM 0 HA ARG A 113 12.563 -16.545 4.658 1.00 63.21 H new ATOM 0 HB2 ARG A 113 15.600 -16.401 4.599 1.00 32.12 H new ATOM 0 HB3 ARG A 113 14.570 -15.038 4.207 1.00 32.12 H new ATOM 0 HG2 ARG A 113 13.482 -15.521 6.560 1.00 51.23 H new ATOM 0 HG3 ARG A 113 14.964 -16.405 6.867 1.00 51.23 H new ATOM 0 HD2 ARG A 113 15.638 -14.328 7.596 1.00 61.22 H new ATOM 0 HD3 ARG A 113 16.101 -14.185 5.912 1.00 61.22 H new ATOM 0 HE ARG A 113 14.486 -12.539 5.620 1.00 22.01 H new ATOM 0 HH11 ARG A 113 13.802 -14.407 8.538 1.00 63.14 H new ATOM 0 HH12 ARG A 113 12.485 -13.345 9.048 1.00 63.14 H new ATOM 0 HH21 ARG A 113 12.795 -11.179 6.283 1.00 21.30 H new ATOM 0 HH22 ARG A 113 11.917 -11.526 7.777 1.00 21.30 H new ATOM 1956 N ILE A 114 14.315 -17.900 2.249 1.00 21.21 N ATOM 1957 CA ILE A 114 14.399 -18.068 0.804 1.00 73.53 C ATOM 1958 C ILE A 114 14.485 -19.543 0.426 1.00 73.30 C ATOM 1959 O ILE A 114 14.517 -20.416 1.294 1.00 44.12 O ATOM 1960 CB ILE A 114 15.617 -17.329 0.220 1.00 1.23 C ATOM 1961 CG1 ILE A 114 16.907 -18.079 0.560 1.00 51.52 C ATOM 1962 CG2 ILE A 114 15.673 -15.902 0.747 1.00 72.51 C ATOM 1963 CD1 ILE A 114 17.407 -18.960 -0.563 1.00 41.33 C ATOM 0 H ILE A 114 14.906 -18.537 2.783 1.00 21.21 H new ATOM 0 HA ILE A 114 13.489 -17.640 0.384 1.00 73.53 H new ATOM 0 HB ILE A 114 15.516 -17.292 -0.865 1.00 1.23 H new ATOM 0 HG12 ILE A 114 17.681 -17.356 0.816 1.00 51.52 H new ATOM 0 HG13 ILE A 114 16.739 -18.693 1.445 1.00 51.52 H new ATOM 0 HG21 ILE A 114 16.539 -15.392 0.325 1.00 72.51 H new ATOM 0 HG22 ILE A 114 14.765 -15.372 0.460 1.00 72.51 H new ATOM 0 HG23 ILE A 114 15.755 -15.918 1.834 1.00 72.51 H new ATOM 0 HD11 ILE A 114 18.324 -19.461 -0.252 1.00 41.33 H new ATOM 0 HD12 ILE A 114 16.650 -19.706 -0.804 1.00 41.33 H new ATOM 0 HD13 ILE A 114 17.608 -18.349 -1.443 1.00 41.33 H new ATOM 1975 N ARG A 115 14.523 -19.814 -0.875 1.00 30.24 N ATOM 1976 CA ARG A 115 14.606 -21.184 -1.368 1.00 1.43 C ATOM 1977 C ARG A 115 15.461 -21.256 -2.630 1.00 34.12 C ATOM 1978 O ARG A 115 15.908 -20.233 -3.147 1.00 23.13 O ATOM 1979 CB ARG A 115 13.207 -21.731 -1.654 1.00 53.13 C ATOM 1980 CG ARG A 115 12.565 -22.417 -0.460 1.00 35.13 C ATOM 1981 CD ARG A 115 11.334 -23.212 -0.869 1.00 2.24 C ATOM 1982 NE ARG A 115 11.655 -24.259 -1.835 1.00 2.04 N ATOM 1983 CZ ARG A 115 10.795 -25.197 -2.214 1.00 60.33 C ATOM 1984 NH1 ARG A 115 9.568 -25.219 -1.713 1.00 0.35 N ATOM 1985 NH2 ARG A 115 11.162 -26.117 -3.098 1.00 54.53 N ATOM 0 H ARG A 115 14.498 -19.103 -1.606 1.00 30.24 H new ATOM 0 HA ARG A 115 15.076 -21.794 -0.596 1.00 1.43 H new ATOM 0 HB2 ARG A 115 12.566 -20.912 -1.980 1.00 53.13 H new ATOM 0 HB3 ARG A 115 13.265 -22.439 -2.481 1.00 53.13 H new ATOM 0 HG2 ARG A 115 13.289 -23.082 0.011 1.00 35.13 H new ATOM 0 HG3 ARG A 115 12.287 -21.670 0.284 1.00 35.13 H new ATOM 0 HD2 ARG A 115 10.882 -23.661 0.015 1.00 2.24 H new ATOM 0 HD3 ARG A 115 10.593 -22.538 -1.298 1.00 2.24 H new ATOM 0 HE ARG A 115 12.591 -24.270 -2.241 1.00 2.04 H new ATOM 0 HH11 ARG A 115 9.282 -24.514 -1.034 1.00 0.35 H new ATOM 0 HH12 ARG A 115 8.910 -25.941 -2.007 1.00 0.35 H new ATOM 0 HH21 ARG A 115 12.105 -26.104 -3.486 1.00 54.53 H new ATOM 0 HH22 ARG A 115 10.501 -26.837 -3.389 1.00 54.53 H new ATOM 1999 N GLU A 116 15.682 -22.472 -3.119 1.00 64.02 N ATOM 2000 CA GLU A 116 16.484 -22.677 -4.320 1.00 4.03 C ATOM 2001 C GLU A 116 15.991 -23.890 -5.103 1.00 21.10 C ATOM 2002 O GLU A 116 15.818 -24.973 -4.545 1.00 24.10 O ATOM 2003 CB GLU A 116 17.958 -22.859 -3.950 1.00 60.35 C ATOM 2004 CG GLU A 116 18.171 -23.643 -2.667 1.00 23.45 C ATOM 2005 CD GLU A 116 18.051 -22.778 -1.427 1.00 45.45 C ATOM 2006 OE1 GLU A 116 18.518 -21.620 -1.466 1.00 42.32 O ATOM 2007 OE2 GLU A 116 17.492 -23.257 -0.420 1.00 32.24 O ATOM 0 H GLU A 116 15.318 -23.329 -2.703 1.00 64.02 H new ATOM 0 HA GLU A 116 16.381 -21.794 -4.950 1.00 4.03 H new ATOM 0 HB2 GLU A 116 18.468 -23.369 -4.767 1.00 60.35 H new ATOM 0 HB3 GLU A 116 18.422 -21.878 -3.848 1.00 60.35 H new ATOM 0 HG2 GLU A 116 17.441 -24.451 -2.614 1.00 23.45 H new ATOM 0 HG3 GLU A 116 19.158 -24.106 -2.688 1.00 23.45 H new ATOM 2014 N GLU A 117 15.766 -23.699 -6.399 1.00 51.21 N ATOM 2015 CA GLU A 117 15.291 -24.777 -7.259 1.00 1.24 C ATOM 2016 C GLU A 117 16.354 -25.165 -8.282 1.00 43.13 C ATOM 2017 O GLU A 117 16.611 -24.429 -9.235 1.00 45.11 O ATOM 2018 CB GLU A 117 14.006 -24.359 -7.976 1.00 14.15 C ATOM 2019 CG GLU A 117 13.579 -25.322 -9.071 1.00 12.24 C ATOM 2020 CD GLU A 117 12.133 -25.759 -8.933 1.00 3.44 C ATOM 2021 OE1 GLU A 117 11.330 -24.982 -8.375 1.00 1.42 O ATOM 2022 OE2 GLU A 117 11.805 -26.877 -9.382 1.00 2.54 O ATOM 0 H GLU A 117 15.905 -22.808 -6.876 1.00 51.21 H new ATOM 0 HA GLU A 117 15.082 -25.643 -6.631 1.00 1.24 H new ATOM 0 HB2 GLU A 117 13.203 -24.275 -7.244 1.00 14.15 H new ATOM 0 HB3 GLU A 117 14.147 -23.369 -8.409 1.00 14.15 H new ATOM 0 HG2 GLU A 117 13.720 -24.848 -10.042 1.00 12.24 H new ATOM 0 HG3 GLU A 117 14.224 -26.201 -9.049 1.00 12.24 H new ATOM 2029 N ARG A 118 16.969 -26.325 -8.077 1.00 72.34 N ATOM 2030 CA ARG A 118 18.005 -26.811 -8.981 1.00 2.24 C ATOM 2031 C ARG A 118 17.389 -27.454 -10.220 1.00 31.05 C ATOM 2032 O ARG A 118 16.916 -28.590 -10.171 1.00 64.42 O ATOM 2033 CB ARG A 118 18.905 -27.819 -8.264 1.00 20.04 C ATOM 2034 CG ARG A 118 19.683 -28.720 -9.208 1.00 64.22 C ATOM 2035 CD ARG A 118 20.487 -27.911 -10.214 1.00 72.34 C ATOM 2036 NE ARG A 118 21.459 -27.038 -9.563 1.00 25.10 N ATOM 2037 CZ ARG A 118 22.605 -27.470 -9.047 1.00 13.13 C ATOM 2038 NH1 ARG A 118 22.919 -28.757 -9.106 1.00 42.52 N ATOM 2039 NH2 ARG A 118 23.438 -26.614 -8.470 1.00 4.21 N ATOM 0 H ARG A 118 16.768 -26.946 -7.293 1.00 72.34 H new ATOM 0 HA ARG A 118 18.605 -25.958 -9.297 1.00 2.24 H new ATOM 0 HB2 ARG A 118 19.608 -27.279 -7.629 1.00 20.04 H new ATOM 0 HB3 ARG A 118 18.293 -28.437 -7.607 1.00 20.04 H new ATOM 0 HG2 ARG A 118 20.354 -29.358 -8.633 1.00 64.22 H new ATOM 0 HG3 ARG A 118 18.993 -29.378 -9.737 1.00 64.22 H new ATOM 0 HD2 ARG A 118 21.006 -28.589 -10.892 1.00 72.34 H new ATOM 0 HD3 ARG A 118 19.809 -27.310 -10.820 1.00 72.34 H new ATOM 0 HE ARG A 118 21.247 -26.042 -9.501 1.00 25.10 H new ATOM 0 HH11 ARG A 118 22.280 -29.418 -9.548 1.00 42.52 H new ATOM 0 HH12 ARG A 118 23.799 -29.086 -8.709 1.00 42.52 H new ATOM 0 HH21 ARG A 118 23.199 -25.624 -8.422 1.00 4.21 H new ATOM 0 HH22 ARG A 118 24.317 -26.946 -8.074 1.00 4.21 H new ATOM 2053 N CYS A 119 17.397 -26.720 -11.327 1.00 21.13 N ATOM 2054 CA CYS A 119 16.838 -27.218 -12.578 1.00 72.33 C ATOM 2055 C CYS A 119 17.866 -27.141 -13.702 1.00 52.53 C ATOM 2056 O CYS A 119 18.016 -26.105 -14.350 1.00 75.40 O ATOM 2057 CB CYS A 119 15.589 -26.420 -12.957 1.00 3.04 C ATOM 2058 SG CYS A 119 14.063 -27.041 -12.214 1.00 35.54 S ATOM 0 H CYS A 119 17.784 -25.778 -11.383 1.00 21.13 H new ATOM 0 HA CYS A 119 16.562 -28.263 -12.433 1.00 72.33 H new ATOM 0 HB2 CYS A 119 15.730 -25.381 -12.658 1.00 3.04 H new ATOM 0 HB3 CYS A 119 15.482 -26.427 -14.042 1.00 3.04 H new ATOM 0 HG CYS A 119 13.061 -26.784 -13.002 1.00 35.54 H new ATOM 2064 N GLY A 120 18.574 -28.243 -13.927 1.00 71.32 N ATOM 2065 CA GLY A 120 19.581 -28.278 -14.972 1.00 35.30 C ATOM 2066 C GLY A 120 20.670 -27.245 -14.763 1.00 33.25 C ATOM 2067 O GLY A 120 21.006 -26.886 -13.634 1.00 31.32 O ATOM 0 H GLY A 120 18.469 -29.113 -13.404 1.00 71.32 H new ATOM 0 HA2 GLY A 120 20.029 -29.271 -15.008 1.00 35.30 H new ATOM 0 HA3 GLY A 120 19.104 -28.108 -15.937 1.00 35.30 H new ATOM 2071 N PRO A 121 21.242 -26.750 -15.870 1.00 61.30 N ATOM 2072 CA PRO A 121 22.309 -25.746 -15.828 1.00 63.14 C ATOM 2073 C PRO A 121 21.806 -24.384 -15.362 1.00 21.42 C ATOM 2074 O PRO A 121 22.211 -23.347 -15.889 1.00 21.41 O ATOM 2075 CB PRO A 121 22.783 -25.672 -17.282 1.00 41.31 C ATOM 2076 CG PRO A 121 21.608 -26.111 -18.086 1.00 45.43 C ATOM 2077 CD PRO A 121 20.891 -27.132 -17.248 1.00 62.51 C ATOM 0 HA PRO A 121 23.094 -26.015 -15.122 1.00 63.14 H new ATOM 0 HB2 PRO A 121 23.089 -24.660 -17.548 1.00 41.31 H new ATOM 0 HB3 PRO A 121 23.643 -26.320 -17.452 1.00 41.31 H new ATOM 0 HG2 PRO A 121 20.956 -25.268 -18.317 1.00 45.43 H new ATOM 0 HG3 PRO A 121 21.924 -26.539 -19.037 1.00 45.43 H new ATOM 0 HD2 PRO A 121 19.814 -27.101 -17.411 1.00 62.51 H new ATOM 0 HD3 PRO A 121 21.220 -28.145 -17.480 1.00 62.51 H new ATOM 2085 N LEU A 122 20.922 -24.394 -14.371 1.00 12.35 N ATOM 2086 CA LEU A 122 20.363 -23.158 -13.832 1.00 23.31 C ATOM 2087 C LEU A 122 20.041 -23.308 -12.349 1.00 11.34 C ATOM 2088 O LEU A 122 20.045 -24.415 -11.809 1.00 55.12 O ATOM 2089 CB LEU A 122 19.101 -22.767 -14.603 1.00 22.41 C ATOM 2090 CG LEU A 122 19.316 -22.261 -16.030 1.00 1.14 C ATOM 2091 CD1 LEU A 122 18.021 -22.337 -16.824 1.00 3.34 C ATOM 2092 CD2 LEU A 122 19.852 -20.837 -16.015 1.00 4.21 C ATOM 0 H LEU A 122 20.577 -25.243 -13.924 1.00 12.35 H new ATOM 0 HA LEU A 122 21.109 -22.371 -13.945 1.00 23.31 H new ATOM 0 HB2 LEU A 122 18.440 -23.633 -14.642 1.00 22.41 H new ATOM 0 HB3 LEU A 122 18.580 -21.993 -14.039 1.00 22.41 H new ATOM 0 HG LEU A 122 20.053 -22.901 -16.515 1.00 1.14 H new ATOM 0 HD11 LEU A 122 18.193 -21.973 -17.837 1.00 3.34 H new ATOM 0 HD12 LEU A 122 17.679 -23.371 -16.864 1.00 3.34 H new ATOM 0 HD13 LEU A 122 17.262 -21.722 -16.341 1.00 3.34 H new ATOM 0 HD21 LEU A 122 19.999 -20.493 -17.039 1.00 4.21 H new ATOM 0 HD22 LEU A 122 19.138 -20.185 -15.512 1.00 4.21 H new ATOM 0 HD23 LEU A 122 20.803 -20.812 -15.484 1.00 4.21 H new ATOM 2104 N THR A 123 19.760 -22.186 -11.693 1.00 41.42 N ATOM 2105 CA THR A 123 19.434 -22.191 -10.273 1.00 23.33 C ATOM 2106 C THR A 123 18.549 -21.005 -9.907 1.00 22.32 C ATOM 2107 O THR A 123 18.990 -19.856 -9.936 1.00 25.22 O ATOM 2108 CB THR A 123 20.706 -22.155 -9.404 1.00 61.25 C ATOM 2109 OG1 THR A 123 21.829 -22.619 -10.162 1.00 24.55 O ATOM 2110 CG2 THR A 123 20.537 -23.014 -8.160 1.00 74.24 C ATOM 0 H THR A 123 19.752 -21.261 -12.124 1.00 41.42 H new ATOM 0 HA THR A 123 18.894 -23.118 -10.077 1.00 23.33 H new ATOM 0 HB THR A 123 20.878 -21.125 -9.093 1.00 61.25 H new ATOM 0 HG1 THR A 123 22.634 -22.592 -9.604 1.00 24.55 H new ATOM 0 HG21 THR A 123 21.448 -22.973 -7.563 1.00 74.24 H new ATOM 0 HG22 THR A 123 19.699 -22.640 -7.571 1.00 74.24 H new ATOM 0 HG23 THR A 123 20.342 -24.045 -8.454 1.00 74.24 H new ATOM 2118 N PHE A 124 17.298 -21.291 -9.562 1.00 0.21 N ATOM 2119 CA PHE A 124 16.350 -20.247 -9.190 1.00 42.22 C ATOM 2120 C PHE A 124 16.307 -20.066 -7.676 1.00 0.52 C ATOM 2121 O PHE A 124 16.809 -20.902 -6.925 1.00 21.22 O ATOM 2122 CB PHE A 124 14.953 -20.586 -9.715 1.00 25.34 C ATOM 2123 CG PHE A 124 14.930 -20.937 -11.175 1.00 2.21 C ATOM 2124 CD1 PHE A 124 15.327 -22.192 -11.606 1.00 64.30 C ATOM 2125 CD2 PHE A 124 14.512 -20.011 -12.117 1.00 13.43 C ATOM 2126 CE1 PHE A 124 15.307 -22.518 -12.949 1.00 71.31 C ATOM 2127 CE2 PHE A 124 14.489 -20.331 -13.461 1.00 13.01 C ATOM 2128 CZ PHE A 124 14.888 -21.586 -13.878 1.00 11.12 C ATOM 0 H PHE A 124 16.917 -22.237 -9.532 1.00 0.21 H new ATOM 0 HA PHE A 124 16.682 -19.312 -9.641 1.00 42.22 H new ATOM 0 HB2 PHE A 124 14.551 -21.422 -9.142 1.00 25.34 H new ATOM 0 HB3 PHE A 124 14.293 -19.736 -9.544 1.00 25.34 H new ATOM 0 HD1 PHE A 124 15.656 -22.925 -10.884 1.00 64.30 H new ATOM 0 HD2 PHE A 124 14.201 -19.028 -11.797 1.00 13.43 H new ATOM 0 HE1 PHE A 124 15.619 -23.500 -13.272 1.00 71.31 H new ATOM 0 HE2 PHE A 124 14.159 -19.600 -14.185 1.00 13.01 H new ATOM 0 HZ PHE A 124 14.872 -21.838 -14.928 1.00 11.12 H new ATOM 2138 N TYR A 125 15.704 -18.967 -7.235 1.00 24.14 N ATOM 2139 CA TYR A 125 15.598 -18.673 -5.810 1.00 73.34 C ATOM 2140 C TYR A 125 14.348 -17.849 -5.516 1.00 71.22 C ATOM 2141 O TYR A 125 14.204 -16.725 -5.997 1.00 62.03 O ATOM 2142 CB TYR A 125 16.841 -17.924 -5.328 1.00 62.33 C ATOM 2143 CG TYR A 125 18.138 -18.626 -5.662 1.00 22.33 C ATOM 2144 CD1 TYR A 125 18.791 -18.388 -6.865 1.00 32.01 C ATOM 2145 CD2 TYR A 125 18.711 -19.527 -4.773 1.00 25.42 C ATOM 2146 CE1 TYR A 125 19.975 -19.028 -7.174 1.00 5.22 C ATOM 2147 CE2 TYR A 125 19.897 -20.171 -5.073 1.00 13.33 C ATOM 2148 CZ TYR A 125 20.525 -19.918 -6.275 1.00 14.15 C ATOM 2149 OH TYR A 125 21.705 -20.556 -6.578 1.00 23.20 O ATOM 0 H TYR A 125 15.281 -18.266 -7.843 1.00 24.14 H new ATOM 0 HA TYR A 125 15.522 -19.619 -5.274 1.00 73.34 H new ATOM 0 HB2 TYR A 125 16.851 -16.929 -5.773 1.00 62.33 H new ATOM 0 HB3 TYR A 125 16.778 -17.789 -4.248 1.00 62.33 H new ATOM 0 HD1 TYR A 125 18.365 -17.690 -7.571 1.00 32.01 H new ATOM 0 HD2 TYR A 125 18.222 -19.728 -3.831 1.00 25.42 H new ATOM 0 HE1 TYR A 125 20.468 -18.833 -8.115 1.00 5.22 H new ATOM 0 HE2 TYR A 125 20.329 -20.868 -4.370 1.00 13.33 H new ATOM 0 HH TYR A 125 22.376 -20.343 -5.896 1.00 23.20 H new ATOM 2159 N TYR A 126 13.447 -18.417 -4.722 1.00 52.33 N ATOM 2160 CA TYR A 126 12.208 -17.737 -4.364 1.00 53.21 C ATOM 2161 C TYR A 126 12.068 -17.622 -2.849 1.00 54.23 C ATOM 2162 O TYR A 126 12.657 -18.387 -2.086 1.00 10.35 O ATOM 2163 CB TYR A 126 11.005 -18.484 -4.943 1.00 64.34 C ATOM 2164 CG TYR A 126 11.175 -19.987 -4.956 1.00 44.33 C ATOM 2165 CD1 TYR A 126 11.933 -20.612 -5.939 1.00 2.41 C ATOM 2166 CD2 TYR A 126 10.579 -20.781 -3.985 1.00 33.30 C ATOM 2167 CE1 TYR A 126 12.090 -21.984 -5.955 1.00 4.11 C ATOM 2168 CE2 TYR A 126 10.732 -22.154 -3.992 1.00 73.33 C ATOM 2169 CZ TYR A 126 11.488 -22.751 -4.980 1.00 10.25 C ATOM 2170 OH TYR A 126 11.643 -24.118 -4.991 1.00 64.12 O ATOM 0 H TYR A 126 13.551 -19.346 -4.314 1.00 52.33 H new ATOM 0 HA TYR A 126 12.240 -16.732 -4.786 1.00 53.21 H new ATOM 0 HB2 TYR A 126 10.118 -18.232 -4.362 1.00 64.34 H new ATOM 0 HB3 TYR A 126 10.829 -18.138 -5.961 1.00 64.34 H new ATOM 0 HD1 TYR A 126 12.407 -20.015 -6.703 1.00 2.41 H new ATOM 0 HD2 TYR A 126 9.986 -20.317 -3.211 1.00 33.30 H new ATOM 0 HE1 TYR A 126 12.681 -22.454 -6.727 1.00 4.11 H new ATOM 0 HE2 TYR A 126 10.263 -22.757 -3.229 1.00 73.33 H new ATOM 0 HH TYR A 126 10.765 -24.546 -5.072 1.00 64.12 H new ATOM 2180 N PRO A 127 11.267 -16.642 -2.403 1.00 21.41 N ATOM 2181 CA PRO A 127 11.029 -16.403 -0.976 1.00 74.35 C ATOM 2182 C PRO A 127 10.198 -17.509 -0.334 1.00 55.14 C ATOM 2183 O PRO A 127 8.971 -17.429 -0.287 1.00 52.13 O ATOM 2184 CB PRO A 127 10.260 -15.080 -0.962 1.00 51.33 C ATOM 2185 CG PRO A 127 9.599 -15.011 -2.296 1.00 33.45 C ATOM 2186 CD PRO A 127 10.533 -15.693 -3.256 1.00 72.45 C ATOM 0 HA PRO A 127 11.958 -16.378 -0.406 1.00 74.35 H new ATOM 0 HB2 PRO A 127 9.527 -15.057 -0.156 1.00 51.33 H new ATOM 0 HB3 PRO A 127 10.930 -14.234 -0.808 1.00 51.33 H new ATOM 0 HG2 PRO A 127 8.629 -15.507 -2.277 1.00 33.45 H new ATOM 0 HG3 PRO A 127 9.423 -13.977 -2.591 1.00 33.45 H new ATOM 0 HD2 PRO A 127 9.989 -16.204 -4.050 1.00 72.45 H new ATOM 0 HD3 PRO A 127 11.205 -14.982 -3.736 1.00 72.45 H new ATOM 2194 N GLY A 128 10.875 -18.541 0.160 1.00 74.11 N ATOM 2195 CA GLY A 128 10.182 -19.648 0.793 1.00 12.00 C ATOM 2196 C GLY A 128 9.107 -20.243 -0.095 1.00 31.13 C ATOM 2197 O GLY A 128 8.938 -19.826 -1.241 1.00 33.54 O ATOM 0 H GLY A 128 11.891 -18.630 0.133 1.00 74.11 H new ATOM 0 HA2 GLY A 128 10.903 -20.423 1.054 1.00 12.00 H new ATOM 0 HA3 GLY A 128 9.731 -19.305 1.724 1.00 12.00 H new