USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 744 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 Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 160:sc= 2.42 (180deg=2.2) USER MOD Single : A 18 GLN : amide:sc= -1.54! C(o=-1.5!,f=-6.3!) USER MOD Single : A 20 TYR OH : rot -109:sc= -0.438 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0.0917 USER MOD Single : A 87 ASN : amide:sc= -0.527 K(o=-0.53,f=-6.8!) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0297 USER MOD Single : A 102 THR OG1 : rot 117:sc= 1.11 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 136:sc= -1.82 (180deg=-4.56!) USER MOD Single : A 141 LYS NZ :NH3+ -179:sc= 1.15 (180deg=1.13) USER MOD Single : A 144 GLN : amide:sc= -5.93! C(o=-5.9!,f=-9.6!) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -1.567 3.841 14.324 1.00 4.21 N ATOM 57 CA VAL A 5 -1.800 2.715 13.448 1.00 43.45 C ATOM 58 C VAL A 5 -2.640 3.160 12.264 1.00 0.14 C ATOM 59 O VAL A 5 -3.801 3.538 12.415 1.00 25.11 O ATOM 60 CB VAL A 5 -2.496 1.562 14.197 1.00 4.34 C ATOM 61 CG1 VAL A 5 -2.886 0.444 13.241 1.00 73.01 C ATOM 62 CG2 VAL A 5 -1.598 1.021 15.300 1.00 72.04 C ATOM 0 HA VAL A 5 -0.838 2.346 13.092 1.00 43.45 H new ATOM 0 HB VAL A 5 -3.406 1.958 14.648 1.00 4.34 H new ATOM 0 HG11 VAL A 5 -3.375 -0.356 13.797 1.00 73.01 H new ATOM 0 HG12 VAL A 5 -3.570 0.832 12.487 1.00 73.01 H new ATOM 0 HG13 VAL A 5 -1.992 0.054 12.754 1.00 73.01 H new ATOM 0 HG21 VAL A 5 -2.107 0.208 15.817 1.00 72.04 H new ATOM 0 HG22 VAL A 5 -0.670 0.650 14.865 1.00 72.04 H new ATOM 0 HG23 VAL A 5 -1.373 1.817 16.009 1.00 72.04 H new ATOM 72 N VAL A 6 -2.037 3.140 11.092 1.00 0.15 N ATOM 73 CA VAL A 6 -2.687 3.641 9.898 1.00 25.03 C ATOM 74 C VAL A 6 -3.274 2.501 9.083 1.00 54.22 C ATOM 75 O VAL A 6 -2.565 1.565 8.706 1.00 22.33 O ATOM 76 CB VAL A 6 -1.703 4.444 9.016 1.00 53.34 C ATOM 77 CG1 VAL A 6 -2.409 5.013 7.791 1.00 4.41 C ATOM 78 CG2 VAL A 6 -1.043 5.558 9.819 1.00 61.23 C ATOM 0 H VAL A 6 -1.094 2.781 10.941 1.00 0.15 H new ATOM 0 HA VAL A 6 -3.489 4.303 10.223 1.00 25.03 H new ATOM 0 HB VAL A 6 -0.925 3.761 8.673 1.00 53.34 H new ATOM 0 HG11 VAL A 6 -1.695 5.573 7.187 1.00 4.41 H new ATOM 0 HG12 VAL A 6 -2.824 4.197 7.199 1.00 4.41 H new ATOM 0 HG13 VAL A 6 -3.214 5.676 8.110 1.00 4.41 H new ATOM 0 HG21 VAL A 6 -0.355 6.110 9.178 1.00 61.23 H new ATOM 0 HG22 VAL A 6 -1.808 6.236 10.198 1.00 61.23 H new ATOM 0 HG23 VAL A 6 -0.493 5.127 10.656 1.00 61.23 H new ATOM 88 N ARG A 7 -4.572 2.569 8.842 1.00 31.33 N ATOM 89 CA ARG A 7 -5.221 1.648 7.933 1.00 21.55 C ATOM 90 C ARG A 7 -5.986 2.433 6.882 1.00 31.41 C ATOM 91 O ARG A 7 -7.001 3.063 7.182 1.00 53.21 O ATOM 92 CB ARG A 7 -6.183 0.710 8.665 1.00 45.31 C ATOM 93 CG ARG A 7 -6.874 -0.270 7.727 1.00 60.32 C ATOM 94 CD ARG A 7 -8.090 -0.916 8.364 1.00 51.42 C ATOM 95 NE ARG A 7 -8.768 -1.826 7.438 1.00 13.44 N ATOM 96 CZ ARG A 7 -9.831 -1.492 6.698 1.00 73.11 C ATOM 97 NH1 ARG A 7 -10.362 -0.279 6.789 1.00 41.34 N ATOM 98 NH2 ARG A 7 -10.378 -2.382 5.881 1.00 3.14 N ATOM 0 H ARG A 7 -5.196 3.255 9.266 1.00 31.33 H new ATOM 0 HA ARG A 7 -4.448 1.038 7.465 1.00 21.55 H new ATOM 0 HB2 ARG A 7 -5.634 0.154 9.425 1.00 45.31 H new ATOM 0 HB3 ARG A 7 -6.936 1.302 9.185 1.00 45.31 H new ATOM 0 HG2 ARG A 7 -7.176 0.251 6.819 1.00 60.32 H new ATOM 0 HG3 ARG A 7 -6.167 -1.045 7.430 1.00 60.32 H new ATOM 0 HD2 ARG A 7 -7.786 -1.464 9.255 1.00 51.42 H new ATOM 0 HD3 ARG A 7 -8.786 -0.142 8.688 1.00 51.42 H new ATOM 0 HE ARG A 7 -8.406 -2.776 7.352 1.00 13.44 H new ATOM 0 HH11 ARG A 7 -9.959 0.407 7.427 1.00 41.34 H new ATOM 0 HH12 ARG A 7 -11.173 -0.033 6.221 1.00 41.34 H new ATOM 0 HH21 ARG A 7 -9.988 -3.322 5.816 1.00 3.14 H new ATOM 0 HH22 ARG A 7 -11.189 -2.126 5.317 1.00 3.14 H new ATOM 112 N ASP A 8 -5.495 2.402 5.660 1.00 72.12 N ATOM 113 CA ASP A 8 -6.168 3.059 4.561 1.00 32.41 C ATOM 114 C ASP A 8 -6.268 2.067 3.412 1.00 1.42 C ATOM 115 O ASP A 8 -5.431 1.167 3.301 1.00 70.45 O ATOM 116 CB ASP A 8 -5.402 4.325 4.153 1.00 34.02 C ATOM 117 CG ASP A 8 -6.283 5.356 3.472 1.00 15.35 C ATOM 118 OD1 ASP A 8 -7.467 5.050 3.197 1.00 65.24 O ATOM 119 OD2 ASP A 8 -5.801 6.481 3.217 1.00 35.21 O ATOM 0 H ASP A 8 -4.630 1.927 5.404 1.00 72.12 H new ATOM 0 HA ASP A 8 -7.170 3.373 4.852 1.00 32.41 H new ATOM 0 HB2 ASP A 8 -4.949 4.770 5.039 1.00 34.02 H new ATOM 0 HB3 ASP A 8 -4.588 4.050 3.482 1.00 34.02 H new ATOM 124 N ALA A 9 -7.287 2.200 2.584 1.00 11.30 N ATOM 125 CA ALA A 9 -7.575 1.184 1.585 1.00 22.31 C ATOM 126 C ALA A 9 -7.900 1.794 0.232 1.00 0.14 C ATOM 127 O ALA A 9 -8.744 2.684 0.125 1.00 31.12 O ATOM 128 CB ALA A 9 -8.723 0.306 2.055 1.00 21.02 C ATOM 0 H ALA A 9 -7.926 2.995 2.581 1.00 11.30 H new ATOM 0 HA ALA A 9 -6.678 0.576 1.462 1.00 22.31 H new ATOM 0 HB1 ALA A 9 -8.933 -0.453 1.301 1.00 21.02 H new ATOM 0 HB2 ALA A 9 -8.450 -0.179 2.992 1.00 21.02 H new ATOM 0 HB3 ALA A 9 -9.611 0.919 2.209 1.00 21.02 H new ATOM 134 N VAL A 10 -7.230 1.304 -0.799 1.00 41.54 N ATOM 135 CA VAL A 10 -7.464 1.768 -2.155 1.00 73.10 C ATOM 136 C VAL A 10 -7.906 0.604 -3.042 1.00 0.35 C ATOM 137 O VAL A 10 -7.443 -0.526 -2.874 1.00 61.54 O ATOM 138 CB VAL A 10 -6.210 2.451 -2.754 1.00 22.44 C ATOM 139 CG1 VAL A 10 -5.938 3.783 -2.068 1.00 64.33 C ATOM 140 CG2 VAL A 10 -4.994 1.547 -2.646 1.00 53.52 C ATOM 0 H VAL A 10 -6.515 0.580 -0.720 1.00 41.54 H new ATOM 0 HA VAL A 10 -8.258 2.513 -2.116 1.00 73.10 H new ATOM 0 HB VAL A 10 -6.407 2.639 -3.810 1.00 22.44 H new ATOM 0 HG11 VAL A 10 -5.052 4.244 -2.506 1.00 64.33 H new ATOM 0 HG12 VAL A 10 -6.795 4.443 -2.203 1.00 64.33 H new ATOM 0 HG13 VAL A 10 -5.772 3.617 -1.004 1.00 64.33 H new ATOM 0 HG21 VAL A 10 -4.127 2.051 -3.074 1.00 53.52 H new ATOM 0 HG22 VAL A 10 -4.801 1.320 -1.597 1.00 53.52 H new ATOM 0 HG23 VAL A 10 -5.180 0.620 -3.189 1.00 53.52 H new ATOM 150 N THR A 11 -8.817 0.875 -3.966 1.00 44.44 N ATOM 151 CA THR A 11 -9.352 -0.156 -4.844 1.00 63.25 C ATOM 152 C THR A 11 -8.806 0.005 -6.258 1.00 63.41 C ATOM 153 O THR A 11 -9.097 0.987 -6.933 1.00 11.13 O ATOM 154 CB THR A 11 -10.888 -0.094 -4.890 1.00 35.41 C ATOM 155 OG1 THR A 11 -11.416 -0.099 -3.557 1.00 30.21 O ATOM 156 CG2 THR A 11 -11.457 -1.268 -5.669 1.00 41.45 C ATOM 0 H THR A 11 -9.203 1.805 -4.127 1.00 44.44 H new ATOM 0 HA THR A 11 -9.043 -1.121 -4.443 1.00 63.25 H new ATOM 0 HB THR A 11 -11.177 0.828 -5.395 1.00 35.41 H new ATOM 0 HG1 THR A 11 -12.394 -0.058 -3.593 1.00 30.21 H new ATOM 0 HG21 THR A 11 -12.545 -1.200 -5.686 1.00 41.45 H new ATOM 0 HG22 THR A 11 -11.076 -1.246 -6.690 1.00 41.45 H new ATOM 0 HG23 THR A 11 -11.159 -2.201 -5.190 1.00 41.45 H new ATOM 164 N ILE A 12 -8.018 -0.963 -6.696 1.00 34.21 N ATOM 165 CA ILE A 12 -7.372 -0.893 -8.000 1.00 33.14 C ATOM 166 C ILE A 12 -7.968 -1.921 -8.955 1.00 63.42 C ATOM 167 O ILE A 12 -8.252 -3.055 -8.563 1.00 65.52 O ATOM 168 CB ILE A 12 -5.845 -1.120 -7.894 1.00 2.20 C ATOM 169 CG1 ILE A 12 -5.210 -0.098 -6.951 1.00 31.23 C ATOM 170 CG2 ILE A 12 -5.191 -1.044 -9.263 1.00 20.10 C ATOM 171 CD1 ILE A 12 -5.288 -0.481 -5.491 1.00 51.32 C ATOM 0 H ILE A 12 -7.809 -1.810 -6.167 1.00 34.21 H new ATOM 0 HA ILE A 12 -7.548 0.110 -8.389 1.00 33.14 H new ATOM 0 HB ILE A 12 -5.682 -2.118 -7.487 1.00 2.20 H new ATOM 0 HG12 ILE A 12 -4.164 0.035 -7.226 1.00 31.23 H new ATOM 0 HG13 ILE A 12 -5.701 0.865 -7.091 1.00 31.23 H new ATOM 0 HG21 ILE A 12 -4.118 -1.207 -9.163 1.00 20.10 H new ATOM 0 HG22 ILE A 12 -5.615 -1.810 -9.912 1.00 20.10 H new ATOM 0 HG23 ILE A 12 -5.370 -0.061 -9.698 1.00 20.10 H new ATOM 0 HD11 ILE A 12 -4.816 0.293 -4.886 1.00 51.32 H new ATOM 0 HD12 ILE A 12 -6.333 -0.585 -5.197 1.00 51.32 H new ATOM 0 HD13 ILE A 12 -4.771 -1.428 -5.335 1.00 51.32 H new ATOM 183 N GLY A 13 -8.154 -1.518 -10.205 1.00 73.34 N ATOM 184 CA GLY A 13 -8.716 -2.406 -11.207 1.00 55.44 C ATOM 185 C GLY A 13 -7.693 -3.372 -11.788 1.00 25.35 C ATOM 186 O GLY A 13 -7.428 -3.361 -12.991 1.00 60.25 O ATOM 0 H GLY A 13 -7.924 -0.585 -10.546 1.00 73.34 H new ATOM 0 HA2 GLY A 13 -9.533 -2.975 -10.763 1.00 55.44 H new ATOM 0 HA3 GLY A 13 -9.144 -1.810 -12.013 1.00 55.44 H new ATOM 190 N LYS A 14 -7.109 -4.201 -10.932 1.00 54.22 N ATOM 191 CA LYS A 14 -6.171 -5.234 -11.361 1.00 10.33 C ATOM 192 C LYS A 14 -6.394 -6.515 -10.559 1.00 12.34 C ATOM 193 O LYS A 14 -6.835 -6.452 -9.412 1.00 43.12 O ATOM 194 CB LYS A 14 -4.728 -4.757 -11.228 1.00 5.35 C ATOM 195 CG LYS A 14 -4.237 -3.982 -12.441 1.00 44.51 C ATOM 196 CD LYS A 14 -2.740 -3.785 -12.390 1.00 21.42 C ATOM 197 CE LYS A 14 -2.197 -3.213 -13.692 1.00 71.31 C ATOM 198 NZ LYS A 14 -2.799 -1.895 -14.018 1.00 21.51 N ATOM 0 H LYS A 14 -7.270 -4.178 -9.925 1.00 54.22 H new ATOM 0 HA LYS A 14 -6.354 -5.445 -12.415 1.00 10.33 H new ATOM 0 HB2 LYS A 14 -4.641 -4.127 -10.343 1.00 5.35 H new ATOM 0 HB3 LYS A 14 -4.081 -5.619 -11.070 1.00 5.35 H new ATOM 0 HG2 LYS A 14 -4.506 -4.517 -13.352 1.00 44.51 H new ATOM 0 HG3 LYS A 14 -4.733 -3.013 -12.483 1.00 44.51 H new ATOM 0 HD2 LYS A 14 -2.490 -3.115 -11.567 1.00 21.42 H new ATOM 0 HD3 LYS A 14 -2.255 -4.739 -12.183 1.00 21.42 H new ATOM 0 HE2 LYS A 14 -1.115 -3.108 -13.618 1.00 71.31 H new ATOM 0 HE3 LYS A 14 -2.394 -3.912 -14.505 1.00 71.31 H new ATOM 0 HZ1 LYS A 14 -2.188 -1.392 -14.693 1.00 21.51 H new ATOM 0 HZ2 LYS A 14 -3.738 -2.037 -14.441 1.00 21.51 H new ATOM 0 HZ3 LYS A 14 -2.892 -1.331 -13.149 1.00 21.51 H new ATOM 212 N PRO A 15 -6.108 -7.690 -11.158 1.00 50.31 N ATOM 213 CA PRO A 15 -6.406 -8.994 -10.541 1.00 15.14 C ATOM 214 C PRO A 15 -5.787 -9.186 -9.154 1.00 14.14 C ATOM 215 O PRO A 15 -6.512 -9.431 -8.194 1.00 2.21 O ATOM 216 CB PRO A 15 -5.797 -9.997 -11.527 1.00 43.02 C ATOM 217 CG PRO A 15 -5.757 -9.278 -12.829 1.00 12.44 C ATOM 218 CD PRO A 15 -5.501 -7.838 -12.492 1.00 60.51 C ATOM 0 HA PRO A 15 -7.477 -9.106 -10.374 1.00 15.14 H new ATOM 0 HB2 PRO A 15 -4.799 -10.303 -11.214 1.00 43.02 H new ATOM 0 HB3 PRO A 15 -6.401 -10.902 -11.594 1.00 43.02 H new ATOM 0 HG2 PRO A 15 -4.971 -9.675 -13.471 1.00 12.44 H new ATOM 0 HG3 PRO A 15 -6.697 -9.392 -13.368 1.00 12.44 H new ATOM 0 HD2 PRO A 15 -4.435 -7.612 -12.476 1.00 60.51 H new ATOM 0 HD3 PRO A 15 -5.959 -7.167 -13.219 1.00 60.51 H new ATOM 226 N ALA A 16 -4.454 -9.101 -9.070 1.00 4.33 N ATOM 227 CA ALA A 16 -3.725 -9.160 -7.792 1.00 40.54 C ATOM 228 C ALA A 16 -2.231 -9.266 -8.050 1.00 44.13 C ATOM 229 O ALA A 16 -1.428 -8.536 -7.475 1.00 10.41 O ATOM 230 CB ALA A 16 -4.170 -10.334 -6.921 1.00 65.31 C ATOM 0 H ALA A 16 -3.849 -8.989 -9.883 1.00 4.33 H new ATOM 0 HA ALA A 16 -3.952 -8.240 -7.253 1.00 40.54 H new ATOM 0 HB1 ALA A 16 -3.602 -10.332 -5.991 1.00 65.31 H new ATOM 0 HB2 ALA A 16 -5.233 -10.239 -6.698 1.00 65.31 H new ATOM 0 HB3 ALA A 16 -3.993 -11.269 -7.453 1.00 65.31 H new ATOM 236 N GLU A 17 -1.896 -10.188 -8.945 1.00 5.14 N ATOM 237 CA GLU A 17 -0.518 -10.560 -9.257 1.00 61.30 C ATOM 238 C GLU A 17 0.387 -9.348 -9.504 1.00 13.43 C ATOM 239 O GLU A 17 1.400 -9.163 -8.828 1.00 34.10 O ATOM 240 CB GLU A 17 -0.546 -11.447 -10.503 1.00 12.32 C ATOM 241 CG GLU A 17 0.812 -11.757 -11.095 1.00 33.54 C ATOM 242 CD GLU A 17 0.694 -12.226 -12.526 1.00 15.25 C ATOM 243 OE1 GLU A 17 0.433 -11.375 -13.405 1.00 71.22 O ATOM 244 OE2 GLU A 17 0.847 -13.436 -12.778 1.00 14.41 O ATOM 0 H GLU A 17 -2.587 -10.709 -9.485 1.00 5.14 H new ATOM 0 HA GLU A 17 -0.100 -11.085 -8.398 1.00 61.30 H new ATOM 0 HB2 GLU A 17 -1.040 -12.386 -10.252 1.00 12.32 H new ATOM 0 HB3 GLU A 17 -1.156 -10.960 -11.264 1.00 12.32 H new ATOM 0 HG2 GLU A 17 1.441 -10.868 -11.052 1.00 33.54 H new ATOM 0 HG3 GLU A 17 1.304 -12.525 -10.498 1.00 33.54 H new ATOM 251 N GLN A 18 -0.001 -8.512 -10.451 1.00 13.21 N ATOM 252 CA GLN A 18 0.837 -7.397 -10.868 1.00 4.14 C ATOM 253 C GLN A 18 0.714 -6.214 -9.915 1.00 64.21 C ATOM 254 O GLN A 18 1.451 -5.235 -10.032 1.00 63.44 O ATOM 255 CB GLN A 18 0.521 -6.975 -12.303 1.00 75.55 C ATOM 256 CG GLN A 18 -0.930 -6.617 -12.556 1.00 40.01 C ATOM 257 CD GLN A 18 -1.834 -7.826 -12.702 1.00 40.41 C ATOM 258 OE1 GLN A 18 -2.410 -8.310 -11.726 1.00 74.20 O ATOM 259 NE2 GLN A 18 -1.965 -8.324 -13.921 1.00 34.02 N ATOM 0 H GLN A 18 -0.890 -8.582 -10.946 1.00 13.21 H new ATOM 0 HA GLN A 18 1.871 -7.740 -10.836 1.00 4.14 H new ATOM 0 HB2 GLN A 18 1.142 -6.117 -12.559 1.00 75.55 H new ATOM 0 HB3 GLN A 18 0.803 -7.785 -12.975 1.00 75.55 H new ATOM 0 HG2 GLN A 18 -1.292 -5.999 -11.734 1.00 40.01 H new ATOM 0 HG3 GLN A 18 -0.995 -6.013 -13.461 1.00 40.01 H new ATOM 0 HE21 GLN A 18 -1.471 -7.894 -14.703 1.00 34.02 H new ATOM 0 HE22 GLN A 18 -2.560 -9.138 -14.078 1.00 34.02 H new ATOM 268 N LEU A 19 -0.216 -6.298 -8.976 1.00 40.02 N ATOM 269 CA LEU A 19 -0.381 -5.254 -7.980 1.00 53.14 C ATOM 270 C LEU A 19 0.710 -5.328 -6.920 1.00 5.23 C ATOM 271 O LEU A 19 1.059 -4.318 -6.317 1.00 2.02 O ATOM 272 CB LEU A 19 -1.753 -5.348 -7.328 1.00 41.00 C ATOM 273 CG LEU A 19 -2.908 -4.886 -8.202 1.00 32.34 C ATOM 274 CD1 LEU A 19 -4.228 -5.141 -7.503 1.00 33.13 C ATOM 275 CD2 LEU A 19 -2.751 -3.410 -8.531 1.00 64.31 C ATOM 0 H LEU A 19 -0.867 -7.078 -8.884 1.00 40.02 H new ATOM 0 HA LEU A 19 -0.298 -4.293 -8.488 1.00 53.14 H new ATOM 0 HB2 LEU A 19 -1.930 -6.383 -7.034 1.00 41.00 H new ATOM 0 HB3 LEU A 19 -1.747 -4.754 -6.414 1.00 41.00 H new ATOM 0 HG LEU A 19 -2.899 -5.452 -9.133 1.00 32.34 H new ATOM 0 HD11 LEU A 19 -5.047 -4.806 -8.139 1.00 33.13 H new ATOM 0 HD12 LEU A 19 -4.335 -6.208 -7.305 1.00 33.13 H new ATOM 0 HD13 LEU A 19 -4.253 -4.593 -6.561 1.00 33.13 H new ATOM 0 HD21 LEU A 19 -3.582 -3.086 -9.157 1.00 64.31 H new ATOM 0 HD22 LEU A 19 -2.745 -2.830 -7.608 1.00 64.31 H new ATOM 0 HD23 LEU A 19 -1.813 -3.254 -9.064 1.00 64.31 H new ATOM 287 N TYR A 20 1.255 -6.521 -6.705 1.00 71.43 N ATOM 288 CA TYR A 20 2.346 -6.695 -5.750 1.00 22.23 C ATOM 289 C TYR A 20 3.589 -5.949 -6.220 1.00 11.02 C ATOM 290 O TYR A 20 4.388 -5.470 -5.416 1.00 14.11 O ATOM 291 CB TYR A 20 2.690 -8.174 -5.574 1.00 64.51 C ATOM 292 CG TYR A 20 1.599 -9.003 -4.939 1.00 11.14 C ATOM 293 CD1 TYR A 20 1.119 -8.706 -3.670 1.00 5.15 C ATOM 294 CD2 TYR A 20 1.067 -10.102 -5.599 1.00 1.02 C ATOM 295 CE1 TYR A 20 0.139 -9.479 -3.084 1.00 62.22 C ATOM 296 CE2 TYR A 20 0.090 -10.883 -5.013 1.00 71.10 C ATOM 297 CZ TYR A 20 -0.370 -10.565 -3.755 1.00 12.31 C ATOM 298 OH TYR A 20 -1.328 -11.349 -3.157 1.00 35.22 O ATOM 0 H TYR A 20 0.962 -7.377 -7.175 1.00 71.43 H new ATOM 0 HA TYR A 20 2.015 -6.290 -4.794 1.00 22.23 H new ATOM 0 HB2 TYR A 20 2.928 -8.597 -6.550 1.00 64.51 H new ATOM 0 HB3 TYR A 20 3.590 -8.254 -4.964 1.00 64.51 H new ATOM 0 HD1 TYR A 20 1.519 -7.858 -3.135 1.00 5.15 H new ATOM 0 HD2 TYR A 20 1.423 -10.351 -6.588 1.00 1.02 H new ATOM 0 HE1 TYR A 20 -0.228 -9.231 -2.099 1.00 62.22 H new ATOM 0 HE2 TYR A 20 -0.310 -11.738 -5.538 1.00 71.10 H new ATOM 0 HH TYR A 20 -0.939 -12.216 -2.919 1.00 35.22 H new ATOM 308 N ALA A 21 3.724 -5.832 -7.535 1.00 71.11 N ATOM 309 CA ALA A 21 4.904 -5.235 -8.144 1.00 3.11 C ATOM 310 C ALA A 21 4.913 -3.719 -7.987 1.00 2.53 C ATOM 311 O ALA A 21 5.912 -3.069 -8.275 1.00 52.40 O ATOM 312 CB ALA A 21 4.973 -5.608 -9.617 1.00 14.45 C ATOM 0 H ALA A 21 3.023 -6.147 -8.205 1.00 71.11 H new ATOM 0 HA ALA A 21 5.780 -5.627 -7.628 1.00 3.11 H new ATOM 0 HB1 ALA A 21 5.859 -5.157 -10.065 1.00 14.45 H new ATOM 0 HB2 ALA A 21 5.028 -6.692 -9.716 1.00 14.45 H new ATOM 0 HB3 ALA A 21 4.082 -5.242 -10.127 1.00 14.45 H new ATOM 318 N VAL A 22 3.809 -3.166 -7.500 1.00 23.33 N ATOM 319 CA VAL A 22 3.654 -1.717 -7.393 1.00 74.14 C ATOM 320 C VAL A 22 4.727 -1.096 -6.489 1.00 33.42 C ATOM 321 O VAL A 22 5.027 0.094 -6.592 1.00 55.12 O ATOM 322 CB VAL A 22 2.250 -1.334 -6.868 1.00 15.02 C ATOM 323 CG1 VAL A 22 2.127 -1.603 -5.374 1.00 52.32 C ATOM 324 CG2 VAL A 22 1.934 0.119 -7.192 1.00 4.41 C ATOM 0 H VAL A 22 3.004 -3.700 -7.171 1.00 23.33 H new ATOM 0 HA VAL A 22 3.774 -1.317 -8.400 1.00 74.14 H new ATOM 0 HB VAL A 22 1.517 -1.962 -7.375 1.00 15.02 H new ATOM 0 HG11 VAL A 22 1.129 -1.324 -5.035 1.00 52.32 H new ATOM 0 HG12 VAL A 22 2.293 -2.663 -5.180 1.00 52.32 H new ATOM 0 HG13 VAL A 22 2.871 -1.015 -4.836 1.00 52.32 H new ATOM 0 HG21 VAL A 22 0.942 0.369 -6.814 1.00 4.41 H new ATOM 0 HG22 VAL A 22 2.675 0.766 -6.722 1.00 4.41 H new ATOM 0 HG23 VAL A 22 1.958 0.265 -8.272 1.00 4.41 H new ATOM 334 N TRP A 23 5.307 -1.908 -5.611 1.00 14.01 N ATOM 335 CA TRP A 23 6.329 -1.430 -4.690 1.00 0.43 C ATOM 336 C TRP A 23 7.625 -1.108 -5.437 1.00 22.11 C ATOM 337 O TRP A 23 8.437 -0.303 -4.978 1.00 50.13 O ATOM 338 CB TRP A 23 6.590 -2.478 -3.605 1.00 11.42 C ATOM 339 CG TRP A 23 7.453 -1.977 -2.486 1.00 63.41 C ATOM 340 CD1 TRP A 23 8.800 -2.154 -2.344 1.00 5.12 C ATOM 341 CD2 TRP A 23 7.027 -1.210 -1.351 1.00 54.25 C ATOM 342 NE1 TRP A 23 9.238 -1.541 -1.195 1.00 65.03 N ATOM 343 CE2 TRP A 23 8.166 -0.959 -0.566 1.00 43.25 C ATOM 344 CE3 TRP A 23 5.790 -0.713 -0.924 1.00 33.12 C ATOM 345 CZ2 TRP A 23 8.108 -0.232 0.621 1.00 5.31 C ATOM 346 CZ3 TRP A 23 5.734 0.008 0.256 1.00 53.12 C ATOM 347 CH2 TRP A 23 6.885 0.242 1.015 1.00 51.34 C ATOM 0 H TRP A 23 5.086 -2.900 -5.519 1.00 14.01 H new ATOM 0 HA TRP A 23 5.969 -0.515 -4.220 1.00 0.43 H new ATOM 0 HB2 TRP A 23 5.636 -2.812 -3.196 1.00 11.42 H new ATOM 0 HB3 TRP A 23 7.065 -3.348 -4.058 1.00 11.42 H new ATOM 0 HD1 TRP A 23 9.429 -2.697 -3.034 1.00 5.12 H new ATOM 0 HE1 TRP A 23 10.202 -1.522 -0.864 1.00 65.03 H new ATOM 0 HE3 TRP A 23 4.896 -0.889 -1.504 1.00 33.12 H new ATOM 0 HZ2 TRP A 23 8.995 -0.049 1.209 1.00 5.31 H new ATOM 0 HZ3 TRP A 23 4.785 0.396 0.596 1.00 53.12 H new ATOM 0 HH2 TRP A 23 6.808 0.808 1.931 1.00 51.34 H new ATOM 358 N ARG A 24 7.807 -1.722 -6.596 1.00 71.14 N ATOM 359 CA ARG A 24 9.014 -1.522 -7.382 1.00 72.43 C ATOM 360 C ARG A 24 8.644 -1.154 -8.818 1.00 12.41 C ATOM 361 O ARG A 24 9.471 -1.257 -9.729 1.00 4.44 O ATOM 362 CB ARG A 24 9.871 -2.795 -7.355 1.00 64.41 C ATOM 363 CG ARG A 24 11.324 -2.563 -7.736 1.00 11.22 C ATOM 364 CD ARG A 24 12.023 -1.675 -6.721 1.00 13.13 C ATOM 365 NE ARG A 24 13.371 -1.309 -7.146 1.00 3.33 N ATOM 366 CZ ARG A 24 14.254 -0.691 -6.363 1.00 2.42 C ATOM 367 NH1 ARG A 24 13.952 -0.429 -5.097 1.00 23.34 N ATOM 368 NH2 ARG A 24 15.444 -0.349 -6.849 1.00 72.14 N ATOM 0 H ARG A 24 7.133 -2.364 -7.013 1.00 71.14 H new ATOM 0 HA ARG A 24 9.593 -0.704 -6.952 1.00 72.43 H new ATOM 0 HB2 ARG A 24 9.832 -3.227 -6.355 1.00 64.41 H new ATOM 0 HB3 ARG A 24 9.439 -3.528 -8.036 1.00 64.41 H new ATOM 0 HG2 ARG A 24 11.842 -3.520 -7.804 1.00 11.22 H new ATOM 0 HG3 ARG A 24 11.375 -2.102 -8.722 1.00 11.22 H new ATOM 0 HD2 ARG A 24 11.435 -0.771 -6.565 1.00 13.13 H new ATOM 0 HD3 ARG A 24 12.073 -2.191 -5.762 1.00 13.13 H new ATOM 0 HE ARG A 24 13.653 -1.540 -8.099 1.00 3.33 H new ATOM 0 HH11 ARG A 24 13.043 -0.701 -4.723 1.00 23.34 H new ATOM 0 HH12 ARG A 24 14.629 0.044 -4.499 1.00 23.34 H new ATOM 0 HH21 ARG A 24 15.679 -0.560 -7.819 1.00 72.14 H new ATOM 0 HH22 ARG A 24 16.122 0.124 -6.252 1.00 72.14 H new ATOM 382 N ASP A 25 7.400 -0.692 -8.995 1.00 41.55 N ATOM 383 CA ASP A 25 6.837 -0.395 -10.312 1.00 52.20 C ATOM 384 C ASP A 25 6.709 -1.671 -11.155 1.00 1.51 C ATOM 385 O ASP A 25 7.313 -2.697 -10.843 1.00 23.03 O ATOM 386 CB ASP A 25 7.686 0.673 -11.005 1.00 0.42 C ATOM 387 CG ASP A 25 7.305 0.913 -12.453 1.00 41.13 C ATOM 388 OD1 ASP A 25 6.160 1.337 -12.713 1.00 61.42 O ATOM 389 OD2 ASP A 25 8.158 0.690 -13.338 1.00 60.34 O ATOM 0 H ASP A 25 6.756 -0.514 -8.224 1.00 41.55 H new ATOM 0 HA ASP A 25 5.829 0.001 -10.192 1.00 52.20 H new ATOM 0 HB2 ASP A 25 7.595 1.610 -10.455 1.00 0.42 H new ATOM 0 HB3 ASP A 25 8.734 0.377 -10.959 1.00 0.42 H new ATOM 394 N LEU A 26 5.904 -1.627 -12.207 1.00 31.13 N ATOM 395 CA LEU A 26 5.655 -2.817 -13.008 1.00 54.33 C ATOM 396 C LEU A 26 6.217 -2.682 -14.428 1.00 30.32 C ATOM 397 O LEU A 26 5.524 -2.260 -15.354 1.00 55.24 O ATOM 398 CB LEU A 26 4.153 -3.177 -13.041 1.00 20.53 C ATOM 399 CG LEU A 26 3.187 -2.093 -13.547 1.00 13.24 C ATOM 400 CD1 LEU A 26 1.865 -2.724 -13.959 1.00 43.10 C ATOM 401 CD2 LEU A 26 2.937 -1.037 -12.478 1.00 35.42 C ATOM 0 H LEU A 26 5.416 -0.789 -12.524 1.00 31.13 H new ATOM 0 HA LEU A 26 6.185 -3.637 -12.523 1.00 54.33 H new ATOM 0 HB2 LEU A 26 4.030 -4.060 -13.668 1.00 20.53 H new ATOM 0 HB3 LEU A 26 3.849 -3.457 -12.032 1.00 20.53 H new ATOM 0 HG LEU A 26 3.646 -1.609 -14.409 1.00 13.24 H new ATOM 0 HD11 LEU A 26 1.187 -1.949 -14.316 1.00 43.10 H new ATOM 0 HD12 LEU A 26 2.040 -3.448 -14.755 1.00 43.10 H new ATOM 0 HD13 LEU A 26 1.420 -3.228 -13.101 1.00 43.10 H new ATOM 0 HD21 LEU A 26 2.250 -0.284 -12.864 1.00 35.42 H new ATOM 0 HD22 LEU A 26 2.501 -1.508 -11.597 1.00 35.42 H new ATOM 0 HD23 LEU A 26 3.880 -0.563 -12.207 1.00 35.42 H new ATOM 413 N PRO A 27 7.509 -3.009 -14.612 1.00 72.20 N ATOM 414 CA PRO A 27 8.139 -3.054 -15.927 1.00 62.30 C ATOM 415 C PRO A 27 7.907 -4.398 -16.617 1.00 60.44 C ATOM 416 O PRO A 27 8.167 -4.551 -17.811 1.00 1.32 O ATOM 417 CB PRO A 27 9.635 -2.855 -15.623 1.00 52.15 C ATOM 418 CG PRO A 27 9.751 -2.751 -14.131 1.00 44.23 C ATOM 419 CD PRO A 27 8.481 -3.314 -13.560 1.00 72.31 C ATOM 0 HA PRO A 27 7.733 -2.302 -16.604 1.00 62.30 H new ATOM 0 HB2 PRO A 27 10.223 -3.691 -16.001 1.00 52.15 H new ATOM 0 HB3 PRO A 27 10.014 -1.954 -16.106 1.00 52.15 H new ATOM 0 HG2 PRO A 27 10.617 -3.306 -13.770 1.00 44.23 H new ATOM 0 HG3 PRO A 27 9.887 -1.714 -13.825 1.00 44.23 H new ATOM 0 HD2 PRO A 27 8.558 -4.385 -13.374 1.00 72.31 H new ATOM 0 HD3 PRO A 27 8.217 -2.844 -12.613 1.00 72.31 H new ATOM 998 N ALA A 64 16.156 -7.317 3.464 1.00 33.20 N ATOM 999 CA ALA A 64 14.908 -7.747 4.048 1.00 22.11 C ATOM 1000 C ALA A 64 14.409 -9.016 3.367 1.00 33.44 C ATOM 1001 O ALA A 64 14.569 -9.198 2.155 1.00 71.44 O ATOM 1002 CB ALA A 64 13.867 -6.644 3.943 1.00 44.41 C ATOM 0 HA ALA A 64 15.077 -7.966 5.102 1.00 22.11 H new ATOM 0 HB1 ALA A 64 12.931 -6.983 4.388 1.00 44.41 H new ATOM 0 HB2 ALA A 64 14.220 -5.759 4.472 1.00 44.41 H new ATOM 0 HB3 ALA A 64 13.702 -6.398 2.894 1.00 44.41 H new ATOM 1008 N GLU A 65 13.816 -9.885 4.162 1.00 32.04 N ATOM 1009 CA GLU A 65 13.209 -11.111 3.676 1.00 14.03 C ATOM 1010 C GLU A 65 11.695 -10.955 3.745 1.00 62.54 C ATOM 1011 O GLU A 65 11.199 -9.942 4.231 1.00 5.01 O ATOM 1012 CB GLU A 65 13.662 -12.288 4.546 1.00 72.42 C ATOM 1013 CG GLU A 65 14.288 -13.443 3.779 1.00 10.22 C ATOM 1014 CD GLU A 65 13.318 -14.134 2.844 1.00 51.54 C ATOM 1015 OE1 GLU A 65 12.136 -14.284 3.207 1.00 74.24 O ATOM 1016 OE2 GLU A 65 13.726 -14.516 1.736 1.00 4.44 O ATOM 0 H GLU A 65 13.741 -9.760 5.172 1.00 32.04 H new ATOM 0 HA GLU A 65 13.513 -11.305 2.647 1.00 14.03 H new ATOM 0 HB2 GLU A 65 14.382 -11.924 5.279 1.00 72.42 H new ATOM 0 HB3 GLU A 65 12.803 -12.663 5.102 1.00 72.42 H new ATOM 0 HG2 GLU A 65 15.135 -13.071 3.203 1.00 10.22 H new ATOM 0 HG3 GLU A 65 14.680 -14.172 4.489 1.00 10.22 H new ATOM 1023 N LEU A 66 10.962 -11.932 3.262 1.00 73.44 N ATOM 1024 CA LEU A 66 9.515 -11.864 3.298 1.00 72.03 C ATOM 1025 C LEU A 66 8.976 -13.090 4.020 1.00 43.43 C ATOM 1026 O LEU A 66 9.206 -14.220 3.593 1.00 74.15 O ATOM 1027 CB LEU A 66 8.948 -11.785 1.880 1.00 73.13 C ATOM 1028 CG LEU A 66 7.469 -11.404 1.783 1.00 75.41 C ATOM 1029 CD1 LEU A 66 7.240 -10.006 2.337 1.00 75.23 C ATOM 1030 CD2 LEU A 66 6.997 -11.482 0.342 1.00 1.41 C ATOM 0 H LEU A 66 11.340 -12.781 2.841 1.00 73.44 H new ATOM 0 HA LEU A 66 9.208 -10.966 3.834 1.00 72.03 H new ATOM 0 HB2 LEU A 66 9.531 -11.058 1.314 1.00 73.13 H new ATOM 0 HB3 LEU A 66 9.089 -12.752 1.397 1.00 73.13 H new ATOM 0 HG LEU A 66 6.892 -12.111 2.379 1.00 75.41 H new ATOM 0 HD11 LEU A 66 6.183 -9.753 2.260 1.00 75.23 H new ATOM 0 HD12 LEU A 66 7.545 -9.975 3.383 1.00 75.23 H new ATOM 0 HD13 LEU A 66 7.828 -9.288 1.766 1.00 75.23 H new ATOM 0 HD21 LEU A 66 5.943 -11.208 0.289 1.00 1.41 H new ATOM 0 HD22 LEU A 66 7.582 -10.795 -0.270 1.00 1.41 H new ATOM 0 HD23 LEU A 66 7.127 -12.499 -0.029 1.00 1.41 H new ATOM 1042 N THR A 67 8.265 -12.871 5.115 1.00 64.12 N ATOM 1043 CA THR A 67 7.803 -13.973 5.944 1.00 3.40 C ATOM 1044 C THR A 67 6.530 -14.604 5.375 1.00 4.03 C ATOM 1045 O THR A 67 6.249 -15.779 5.618 1.00 61.12 O ATOM 1046 CB THR A 67 7.592 -13.526 7.416 1.00 35.43 C ATOM 1047 OG1 THR A 67 7.062 -14.599 8.201 1.00 11.30 O ATOM 1048 CG2 THR A 67 6.672 -12.323 7.514 1.00 14.55 C ATOM 0 H THR A 67 7.996 -11.945 5.449 1.00 64.12 H new ATOM 0 HA THR A 67 8.584 -14.734 5.937 1.00 3.40 H new ATOM 0 HB THR A 67 8.569 -13.241 7.805 1.00 35.43 H new ATOM 0 HG1 THR A 67 6.938 -14.298 9.125 1.00 11.30 H new ATOM 0 HG21 THR A 67 6.550 -12.042 8.560 1.00 14.55 H new ATOM 0 HG22 THR A 67 7.104 -11.488 6.962 1.00 14.55 H new ATOM 0 HG23 THR A 67 5.699 -12.573 7.090 1.00 14.55 H new ATOM 1056 N ALA A 68 5.782 -13.842 4.585 1.00 24.12 N ATOM 1057 CA ALA A 68 4.559 -14.352 3.987 1.00 13.32 C ATOM 1058 C ALA A 68 4.360 -13.791 2.590 1.00 31.32 C ATOM 1059 O ALA A 68 4.385 -12.577 2.386 1.00 55.24 O ATOM 1060 CB ALA A 68 3.356 -14.035 4.861 1.00 34.44 C ATOM 0 H ALA A 68 6.001 -12.875 4.346 1.00 24.12 H new ATOM 0 HA ALA A 68 4.654 -15.435 3.910 1.00 13.32 H new ATOM 0 HB1 ALA A 68 2.453 -14.426 4.393 1.00 34.44 H new ATOM 0 HB2 ALA A 68 3.486 -14.496 5.840 1.00 34.44 H new ATOM 0 HB3 ALA A 68 3.265 -12.955 4.977 1.00 34.44 H new ATOM 1066 N ASP A 69 4.153 -14.692 1.644 1.00 1.21 N ATOM 1067 CA ASP A 69 3.945 -14.331 0.246 1.00 32.03 C ATOM 1068 C ASP A 69 2.841 -15.191 -0.349 1.00 53.44 C ATOM 1069 O ASP A 69 3.037 -16.380 -0.628 1.00 34.01 O ATOM 1070 CB ASP A 69 5.238 -14.498 -0.558 1.00 11.43 C ATOM 1071 CG ASP A 69 5.012 -14.422 -2.059 1.00 41.30 C ATOM 1072 OD1 ASP A 69 4.631 -13.348 -2.559 1.00 54.53 O ATOM 1073 OD2 ASP A 69 5.227 -15.449 -2.744 1.00 42.22 O ATOM 0 H ASP A 69 4.124 -15.696 1.821 1.00 1.21 H new ATOM 0 HA ASP A 69 3.649 -13.283 0.198 1.00 32.03 H new ATOM 0 HB2 ASP A 69 5.947 -13.725 -0.262 1.00 11.43 H new ATOM 0 HB3 ASP A 69 5.692 -15.458 -0.312 1.00 11.43 H new ATOM 1078 N GLU A 70 1.674 -14.596 -0.507 1.00 11.32 N ATOM 1079 CA GLU A 70 0.522 -15.300 -1.035 1.00 34.32 C ATOM 1080 C GLU A 70 0.244 -14.841 -2.463 1.00 73.22 C ATOM 1081 O GLU A 70 0.409 -13.663 -2.779 1.00 32.04 O ATOM 1082 CB GLU A 70 -0.699 -15.032 -0.155 1.00 53.54 C ATOM 1083 CG GLU A 70 -0.477 -15.326 1.321 1.00 5.44 C ATOM 1084 CD GLU A 70 -0.293 -16.801 1.609 1.00 53.04 C ATOM 1085 OE1 GLU A 70 0.850 -17.292 1.544 1.00 25.14 O ATOM 1086 OE2 GLU A 70 -1.292 -17.478 1.918 1.00 15.33 O ATOM 0 H GLU A 70 1.499 -13.618 -0.275 1.00 11.32 H new ATOM 0 HA GLU A 70 0.729 -16.370 -1.039 1.00 34.32 H new ATOM 0 HB2 GLU A 70 -0.992 -13.988 -0.267 1.00 53.54 H new ATOM 0 HB3 GLU A 70 -1.532 -15.637 -0.514 1.00 53.54 H new ATOM 0 HG2 GLU A 70 0.402 -14.782 1.666 1.00 5.44 H new ATOM 0 HG3 GLU A 70 -1.327 -14.953 1.892 1.00 5.44 H new ATOM 1093 N PRO A 71 -0.204 -15.757 -3.337 1.00 43.05 N ATOM 1094 CA PRO A 71 -0.470 -15.450 -4.751 1.00 45.11 C ATOM 1095 C PRO A 71 -1.565 -14.400 -4.926 1.00 50.11 C ATOM 1096 O PRO A 71 -1.619 -13.705 -5.941 1.00 3.11 O ATOM 1097 CB PRO A 71 -0.924 -16.793 -5.335 1.00 42.23 C ATOM 1098 CG PRO A 71 -0.438 -17.822 -4.372 1.00 41.11 C ATOM 1099 CD PRO A 71 -0.474 -17.168 -3.024 1.00 42.31 C ATOM 0 HA PRO A 71 0.408 -15.031 -5.242 1.00 45.11 H new ATOM 0 HB2 PRO A 71 -2.008 -16.831 -5.438 1.00 42.23 H new ATOM 0 HB3 PRO A 71 -0.504 -16.953 -6.328 1.00 42.23 H new ATOM 0 HG2 PRO A 71 -1.072 -18.708 -4.394 1.00 41.11 H new ATOM 0 HG3 PRO A 71 0.572 -18.146 -4.623 1.00 41.11 H new ATOM 0 HD2 PRO A 71 -1.441 -17.296 -2.538 1.00 42.31 H new ATOM 0 HD3 PRO A 71 0.277 -17.584 -2.353 1.00 42.31 H new ATOM 1107 N GLY A 72 -2.435 -14.294 -3.931 1.00 75.04 N ATOM 1108 CA GLY A 72 -3.496 -13.309 -3.972 1.00 63.40 C ATOM 1109 C GLY A 72 -4.287 -13.289 -2.683 1.00 40.12 C ATOM 1110 O GLY A 72 -5.500 -13.496 -2.688 1.00 23.41 O ATOM 0 H GLY A 72 -2.424 -14.875 -3.093 1.00 75.04 H new ATOM 0 HA2 GLY A 72 -3.070 -12.322 -4.154 1.00 63.40 H new ATOM 0 HA3 GLY A 72 -4.163 -13.527 -4.806 1.00 63.40 H new ATOM 1114 N LYS A 73 -3.594 -13.067 -1.570 1.00 74.45 N ATOM 1115 CA LYS A 73 -4.235 -13.091 -0.259 1.00 31.42 C ATOM 1116 C LYS A 73 -3.668 -12.001 0.648 1.00 32.41 C ATOM 1117 O LYS A 73 -4.361 -11.036 0.964 1.00 41.13 O ATOM 1118 CB LYS A 73 -4.073 -14.463 0.411 1.00 53.01 C ATOM 1119 CG LYS A 73 -4.564 -15.626 -0.439 1.00 10.23 C ATOM 1120 CD LYS A 73 -4.505 -16.940 0.319 1.00 54.15 C ATOM 1121 CE LYS A 73 -5.567 -17.010 1.405 1.00 43.34 C ATOM 1122 NZ LYS A 73 -5.506 -18.290 2.159 1.00 31.45 N ATOM 0 H LYS A 73 -2.594 -12.869 -1.549 1.00 74.45 H new ATOM 0 HA LYS A 73 -5.297 -12.901 -0.412 1.00 31.42 H new ATOM 0 HB2 LYS A 73 -3.021 -14.618 0.649 1.00 53.01 H new ATOM 0 HB3 LYS A 73 -4.616 -14.461 1.356 1.00 53.01 H new ATOM 0 HG2 LYS A 73 -5.589 -15.436 -0.759 1.00 10.23 H new ATOM 0 HG3 LYS A 73 -3.957 -15.699 -1.341 1.00 10.23 H new ATOM 0 HD2 LYS A 73 -4.641 -17.768 -0.377 1.00 54.15 H new ATOM 0 HD3 LYS A 73 -3.518 -17.058 0.767 1.00 54.15 H new ATOM 0 HE2 LYS A 73 -5.436 -16.176 2.095 1.00 43.34 H new ATOM 0 HE3 LYS A 73 -6.554 -16.900 0.955 1.00 43.34 H new ATOM 0 HZ1 LYS A 73 -6.246 -18.298 2.890 1.00 31.45 H new ATOM 0 HZ2 LYS A 73 -5.656 -19.085 1.506 1.00 31.45 H new ATOM 0 HZ3 LYS A 73 -4.573 -18.383 2.610 1.00 31.45 H new ATOM 1136 N ARG A 74 -2.412 -12.144 1.057 1.00 2.54 N ATOM 1137 CA ARG A 74 -1.809 -11.187 1.979 1.00 64.23 C ATOM 1138 C ARG A 74 -0.293 -11.129 1.813 1.00 10.44 C ATOM 1139 O ARG A 74 0.328 -12.084 1.347 1.00 43.10 O ATOM 1140 CB ARG A 74 -2.147 -11.548 3.429 1.00 60.55 C ATOM 1141 CG ARG A 74 -1.552 -12.869 3.888 1.00 53.31 C ATOM 1142 CD ARG A 74 -1.829 -13.128 5.358 1.00 55.32 C ATOM 1143 NE ARG A 74 -1.166 -14.342 5.830 1.00 42.33 N ATOM 1144 CZ ARG A 74 -0.551 -14.451 7.005 1.00 75.34 C ATOM 1145 NH1 ARG A 74 -0.558 -13.435 7.860 1.00 24.14 N ATOM 1146 NH2 ARG A 74 0.057 -15.580 7.336 1.00 11.54 N ATOM 0 H ARG A 74 -1.797 -12.905 0.769 1.00 2.54 H new ATOM 0 HA ARG A 74 -2.222 -10.206 1.742 1.00 64.23 H new ATOM 0 HB2 ARG A 74 -1.791 -10.753 4.084 1.00 60.55 H new ATOM 0 HB3 ARG A 74 -3.231 -11.590 3.540 1.00 60.55 H new ATOM 0 HG2 ARG A 74 -1.966 -13.682 3.291 1.00 53.31 H new ATOM 0 HG3 ARG A 74 -0.476 -12.863 3.716 1.00 53.31 H new ATOM 0 HD2 ARG A 74 -1.490 -12.276 5.947 1.00 55.32 H new ATOM 0 HD3 ARG A 74 -2.904 -13.216 5.515 1.00 55.32 H new ATOM 0 HE ARG A 74 -1.175 -15.159 5.219 1.00 42.33 H new ATOM 0 HH11 ARG A 74 -1.036 -12.567 7.617 1.00 24.14 H new ATOM 0 HH12 ARG A 74 -0.085 -13.522 8.760 1.00 24.14 H new ATOM 0 HH21 ARG A 74 0.055 -16.369 6.690 1.00 11.54 H new ATOM 0 HH22 ARG A 74 0.528 -15.661 8.237 1.00 11.54 H new ATOM 1160 N ILE A 75 0.287 -9.996 2.195 1.00 51.24 N ATOM 1161 CA ILE A 75 1.737 -9.834 2.218 1.00 62.15 C ATOM 1162 C ILE A 75 2.181 -9.391 3.600 1.00 72.02 C ATOM 1163 O ILE A 75 1.894 -8.269 4.016 1.00 41.13 O ATOM 1164 CB ILE A 75 2.239 -8.778 1.209 1.00 33.33 C ATOM 1165 CG1 ILE A 75 1.784 -9.109 -0.207 1.00 11.23 C ATOM 1166 CG2 ILE A 75 3.760 -8.662 1.262 1.00 71.03 C ATOM 1167 CD1 ILE A 75 2.282 -10.439 -0.698 1.00 61.13 C ATOM 0 H ILE A 75 -0.230 -9.170 2.495 1.00 51.24 H new ATOM 0 HA ILE A 75 2.158 -10.802 1.948 1.00 62.15 H new ATOM 0 HB ILE A 75 1.805 -7.818 1.490 1.00 33.33 H new ATOM 0 HG12 ILE A 75 0.695 -9.102 -0.242 1.00 11.23 H new ATOM 0 HG13 ILE A 75 2.130 -8.328 -0.884 1.00 11.23 H new ATOM 0 HG21 ILE A 75 4.093 -7.913 0.544 1.00 71.03 H new ATOM 0 HG22 ILE A 75 4.068 -8.365 2.265 1.00 71.03 H new ATOM 0 HG23 ILE A 75 4.207 -9.625 1.016 1.00 71.03 H new ATOM 0 HD11 ILE A 75 1.921 -10.611 -1.712 1.00 61.13 H new ATOM 0 HD12 ILE A 75 3.372 -10.443 -0.695 1.00 61.13 H new ATOM 0 HD13 ILE A 75 1.915 -11.229 -0.043 1.00 61.13 H new ATOM 1179 N ALA A 76 2.865 -10.268 4.308 1.00 71.25 N ATOM 1180 CA ALA A 76 3.432 -9.917 5.596 1.00 22.43 C ATOM 1181 C ALA A 76 4.941 -9.827 5.463 1.00 34.12 C ATOM 1182 O ALA A 76 5.600 -10.798 5.082 1.00 42.33 O ATOM 1183 CB ALA A 76 3.031 -10.924 6.661 1.00 44.35 C ATOM 0 H ALA A 76 3.042 -11.229 4.014 1.00 71.25 H new ATOM 0 HA ALA A 76 3.043 -8.949 5.911 1.00 22.43 H new ATOM 0 HB1 ALA A 76 3.470 -10.637 7.617 1.00 44.35 H new ATOM 0 HB2 ALA A 76 1.945 -10.945 6.752 1.00 44.35 H new ATOM 0 HB3 ALA A 76 3.390 -11.914 6.380 1.00 44.35 H new ATOM 1189 N TRP A 77 5.482 -8.661 5.758 1.00 10.03 N ATOM 1190 CA TRP A 77 6.879 -8.389 5.478 1.00 20.35 C ATOM 1191 C TRP A 77 7.724 -8.370 6.740 1.00 30.14 C ATOM 1192 O TRP A 77 7.320 -7.847 7.780 1.00 32.11 O ATOM 1193 CB TRP A 77 7.027 -7.060 4.725 1.00 54.21 C ATOM 1194 CG TRP A 77 6.451 -5.881 5.457 1.00 31.14 C ATOM 1195 CD1 TRP A 77 5.132 -5.621 5.679 1.00 53.21 C ATOM 1196 CD2 TRP A 77 7.175 -4.795 6.050 1.00 42.25 C ATOM 1197 NE1 TRP A 77 4.988 -4.456 6.387 1.00 13.45 N ATOM 1198 CE2 TRP A 77 6.226 -3.926 6.621 1.00 11.04 C ATOM 1199 CE3 TRP A 77 8.528 -4.474 6.156 1.00 64.41 C ATOM 1200 CZ2 TRP A 77 6.587 -2.761 7.291 1.00 64.34 C ATOM 1201 CZ3 TRP A 77 8.886 -3.315 6.820 1.00 44.04 C ATOM 1202 CH2 TRP A 77 7.920 -2.471 7.379 1.00 2.13 C ATOM 0 H TRP A 77 4.977 -7.888 6.191 1.00 10.03 H new ATOM 0 HA TRP A 77 7.244 -9.202 4.851 1.00 20.35 H new ATOM 0 HB2 TRP A 77 8.085 -6.877 4.535 1.00 54.21 H new ATOM 0 HB3 TRP A 77 6.539 -7.147 3.754 1.00 54.21 H new ATOM 0 HD1 TRP A 77 4.316 -6.244 5.345 1.00 53.21 H new ATOM 0 HE1 TRP A 77 4.102 -4.051 6.690 1.00 13.45 H new ATOM 0 HE3 TRP A 77 9.282 -5.118 5.728 1.00 64.41 H new ATOM 0 HZ2 TRP A 77 5.842 -2.110 7.725 1.00 64.34 H new ATOM 0 HZ3 TRP A 77 9.931 -3.056 6.909 1.00 44.04 H new ATOM 0 HH2 TRP A 77 8.234 -1.573 7.890 1.00 2.13 H new ATOM 1213 N ARG A 78 8.900 -8.955 6.628 1.00 2.24 N ATOM 1214 CA ARG A 78 9.907 -8.866 7.667 1.00 61.11 C ATOM 1215 C ARG A 78 11.069 -8.059 7.115 1.00 54.42 C ATOM 1216 O ARG A 78 11.075 -7.715 5.937 1.00 65.15 O ATOM 1217 CB ARG A 78 10.385 -10.254 8.120 1.00 35.23 C ATOM 1218 CG ARG A 78 10.934 -11.103 6.989 1.00 63.20 C ATOM 1219 CD ARG A 78 11.780 -12.262 7.487 1.00 63.54 C ATOM 1220 NE ARG A 78 11.010 -13.244 8.242 1.00 51.13 N ATOM 1221 CZ ARG A 78 10.815 -14.503 7.840 1.00 12.23 C ATOM 1222 NH1 ARG A 78 11.227 -14.889 6.637 1.00 64.33 N ATOM 1223 NH2 ARG A 78 10.200 -15.370 8.636 1.00 4.33 N ATOM 0 H ARG A 78 9.184 -9.504 5.817 1.00 2.24 H new ATOM 0 HA ARG A 78 9.480 -8.381 8.545 1.00 61.11 H new ATOM 0 HB2 ARG A 78 11.156 -10.134 8.881 1.00 35.23 H new ATOM 0 HB3 ARG A 78 9.554 -10.781 8.589 1.00 35.23 H new ATOM 0 HG2 ARG A 78 10.106 -11.491 6.396 1.00 63.20 H new ATOM 0 HG3 ARG A 78 11.534 -10.477 6.328 1.00 63.20 H new ATOM 0 HD2 ARG A 78 12.251 -12.754 6.636 1.00 63.54 H new ATOM 0 HD3 ARG A 78 12.582 -11.876 8.116 1.00 63.54 H new ATOM 0 HE ARG A 78 10.597 -12.953 9.128 1.00 51.13 H new ATOM 0 HH11 ARG A 78 11.693 -14.224 6.020 1.00 64.33 H new ATOM 0 HH12 ARG A 78 11.078 -15.850 6.331 1.00 64.33 H new ATOM 0 HH21 ARG A 78 9.875 -15.075 9.557 1.00 4.33 H new ATOM 0 HH22 ARG A 78 10.052 -16.331 8.326 1.00 4.33 H new ATOM 1237 N SER A 79 12.038 -7.744 7.943 1.00 2.33 N ATOM 1238 CA SER A 79 13.168 -6.955 7.484 1.00 13.22 C ATOM 1239 C SER A 79 14.457 -7.510 8.068 1.00 53.32 C ATOM 1240 O SER A 79 15.421 -6.779 8.279 1.00 2.00 O ATOM 1241 CB SER A 79 12.979 -5.492 7.893 1.00 1.21 C ATOM 1242 OG SER A 79 11.663 -5.051 7.593 1.00 52.01 O ATOM 0 H SER A 79 12.072 -8.015 8.926 1.00 2.33 H new ATOM 0 HA SER A 79 13.228 -7.008 6.397 1.00 13.22 H new ATOM 0 HB2 SER A 79 13.170 -5.380 8.960 1.00 1.21 H new ATOM 0 HB3 SER A 79 13.704 -4.867 7.372 1.00 1.21 H new ATOM 0 HG SER A 79 11.562 -4.114 7.863 1.00 52.01 H new ATOM 1248 N LEU A 80 14.454 -8.824 8.298 1.00 51.33 N ATOM 1249 CA LEU A 80 15.568 -9.522 8.937 1.00 13.20 C ATOM 1250 C LEU A 80 15.727 -9.086 10.398 1.00 32.20 C ATOM 1251 O LEU A 80 15.446 -7.942 10.759 1.00 50.01 O ATOM 1252 CB LEU A 80 16.874 -9.313 8.153 1.00 64.40 C ATOM 1253 CG LEU A 80 16.848 -9.816 6.712 1.00 72.11 C ATOM 1254 CD1 LEU A 80 18.247 -9.847 6.142 1.00 71.53 C ATOM 1255 CD2 LEU A 80 16.217 -11.191 6.621 1.00 24.45 C ATOM 0 H LEU A 80 13.677 -9.434 8.045 1.00 51.33 H new ATOM 0 HA LEU A 80 15.341 -10.588 8.930 1.00 13.20 H new ATOM 0 HB2 LEU A 80 17.110 -8.249 8.146 1.00 64.40 H new ATOM 0 HB3 LEU A 80 17.683 -9.816 8.683 1.00 64.40 H new ATOM 0 HG LEU A 80 16.240 -9.126 6.127 1.00 72.11 H new ATOM 0 HD11 LEU A 80 18.213 -10.208 5.114 1.00 71.53 H new ATOM 0 HD12 LEU A 80 18.670 -8.842 6.160 1.00 71.53 H new ATOM 0 HD13 LEU A 80 18.869 -10.513 6.740 1.00 71.53 H new ATOM 0 HD21 LEU A 80 16.213 -11.522 5.582 1.00 24.45 H new ATOM 0 HD22 LEU A 80 16.790 -11.895 7.224 1.00 24.45 H new ATOM 0 HD23 LEU A 80 15.193 -11.147 6.991 1.00 24.45 H new ATOM 1267 N PRO A 81 16.165 -10.012 11.264 1.00 64.51 N ATOM 1268 CA PRO A 81 16.257 -9.777 12.713 1.00 33.02 C ATOM 1269 C PRO A 81 17.140 -8.586 13.083 1.00 55.23 C ATOM 1270 O PRO A 81 16.980 -7.992 14.153 1.00 34.40 O ATOM 1271 CB PRO A 81 16.868 -11.077 13.253 1.00 24.25 C ATOM 1272 CG PRO A 81 17.467 -11.753 12.067 1.00 63.45 C ATOM 1273 CD PRO A 81 16.605 -11.368 10.905 1.00 31.02 C ATOM 0 HA PRO A 81 15.280 -9.534 13.131 1.00 33.02 H new ATOM 0 HB2 PRO A 81 17.623 -10.871 14.011 1.00 24.25 H new ATOM 0 HB3 PRO A 81 16.109 -11.704 13.721 1.00 24.25 H new ATOM 0 HG2 PRO A 81 18.498 -11.434 11.913 1.00 63.45 H new ATOM 0 HG3 PRO A 81 17.485 -12.835 12.200 1.00 63.45 H new ATOM 0 HD2 PRO A 81 17.161 -11.378 9.968 1.00 31.02 H new ATOM 0 HD3 PRO A 81 15.762 -12.048 10.783 1.00 31.02 H new ATOM 1281 N GLY A 82 18.054 -8.226 12.191 1.00 60.10 N ATOM 1282 CA GLY A 82 18.987 -7.154 12.478 1.00 64.01 C ATOM 1283 C GLY A 82 18.425 -5.775 12.183 1.00 13.14 C ATOM 1284 O GLY A 82 19.087 -4.768 12.438 1.00 20.41 O ATOM 0 H GLY A 82 18.166 -8.658 11.274 1.00 60.10 H new ATOM 0 HA2 GLY A 82 19.276 -7.204 13.528 1.00 64.01 H new ATOM 0 HA3 GLY A 82 19.893 -7.303 11.891 1.00 64.01 H new ATOM 1288 N ALA A 83 17.212 -5.716 11.649 1.00 75.31 N ATOM 1289 CA ALA A 83 16.612 -4.438 11.285 1.00 21.23 C ATOM 1290 C ALA A 83 15.146 -4.357 11.708 1.00 34.21 C ATOM 1291 O ALA A 83 14.363 -3.610 11.121 1.00 32.51 O ATOM 1292 CB ALA A 83 16.747 -4.214 9.786 1.00 61.45 C ATOM 0 H ALA A 83 16.628 -6.530 11.459 1.00 75.31 H new ATOM 0 HA ALA A 83 17.146 -3.652 11.818 1.00 21.23 H new ATOM 0 HB1 ALA A 83 16.297 -3.258 9.519 1.00 61.45 H new ATOM 0 HB2 ALA A 83 17.802 -4.208 9.513 1.00 61.45 H new ATOM 0 HB3 ALA A 83 16.239 -5.016 9.251 1.00 61.45 H new ATOM 1298 N ARG A 84 14.773 -5.109 12.736 1.00 51.22 N ATOM 1299 CA ARG A 84 13.398 -5.093 13.223 1.00 3.44 C ATOM 1300 C ARG A 84 13.340 -4.812 14.717 1.00 32.23 C ATOM 1301 O ARG A 84 13.713 -5.656 15.533 1.00 41.31 O ATOM 1302 CB ARG A 84 12.693 -6.417 12.918 1.00 71.51 C ATOM 1303 CG ARG A 84 12.430 -6.642 11.439 1.00 13.14 C ATOM 1304 CD ARG A 84 11.401 -5.660 10.895 1.00 70.23 C ATOM 1305 NE ARG A 84 10.032 -6.033 11.257 1.00 4.31 N ATOM 1306 CZ ARG A 84 9.046 -6.190 10.372 1.00 73.01 C ATOM 1307 NH1 ARG A 84 9.260 -5.955 9.079 1.00 55.10 N ATOM 1308 NH2 ARG A 84 7.839 -6.566 10.780 1.00 22.43 N ATOM 0 H ARG A 84 15.398 -5.734 13.246 1.00 51.22 H new ATOM 0 HA ARG A 84 12.881 -4.288 12.700 1.00 3.44 H new ATOM 0 HB2 ARG A 84 13.300 -7.238 13.299 1.00 71.51 H new ATOM 0 HB3 ARG A 84 11.745 -6.446 13.455 1.00 71.51 H new ATOM 0 HG2 ARG A 84 13.362 -6.538 10.884 1.00 13.14 H new ATOM 0 HG3 ARG A 84 12.078 -7.662 11.283 1.00 13.14 H new ATOM 0 HD2 ARG A 84 11.617 -4.662 11.277 1.00 70.23 H new ATOM 0 HD3 ARG A 84 11.487 -5.611 9.810 1.00 70.23 H new ATOM 0 HE ARG A 84 9.820 -6.181 12.244 1.00 4.31 H new ATOM 0 HH11 ARG A 84 10.181 -5.653 8.761 1.00 55.10 H new ATOM 0 HH12 ARG A 84 8.503 -6.077 8.406 1.00 55.10 H new ATOM 0 HH21 ARG A 84 7.665 -6.735 11.771 1.00 22.43 H new ATOM 0 HH22 ARG A 84 7.086 -6.686 10.102 1.00 22.43 H new ATOM 1322 N ILE A 85 12.893 -3.615 15.067 1.00 31.44 N ATOM 1323 CA ILE A 85 12.662 -3.271 16.462 1.00 52.41 C ATOM 1324 C ILE A 85 11.220 -3.593 16.856 1.00 25.20 C ATOM 1325 O ILE A 85 10.981 -4.456 17.699 1.00 63.31 O ATOM 1326 CB ILE A 85 12.994 -1.787 16.766 1.00 45.34 C ATOM 1327 CG1 ILE A 85 12.365 -0.845 15.727 1.00 61.52 C ATOM 1328 CG2 ILE A 85 14.502 -1.591 16.821 1.00 53.12 C ATOM 1329 CD1 ILE A 85 12.577 0.629 16.019 1.00 24.23 C ATOM 0 H ILE A 85 12.683 -2.867 14.406 1.00 31.44 H new ATOM 0 HA ILE A 85 13.340 -3.877 17.062 1.00 52.41 H new ATOM 0 HB ILE A 85 12.567 -1.537 17.737 1.00 45.34 H new ATOM 0 HG12 ILE A 85 12.781 -1.074 14.746 1.00 61.52 H new ATOM 0 HG13 ILE A 85 11.295 -1.044 15.673 1.00 61.52 H new ATOM 0 HG21 ILE A 85 14.725 -0.546 17.035 1.00 53.12 H new ATOM 0 HG22 ILE A 85 14.922 -2.220 17.606 1.00 53.12 H new ATOM 0 HG23 ILE A 85 14.940 -1.867 15.862 1.00 53.12 H new ATOM 0 HD11 ILE A 85 12.103 1.226 15.240 1.00 24.23 H new ATOM 0 HD12 ILE A 85 12.135 0.876 16.984 1.00 24.23 H new ATOM 0 HD13 ILE A 85 13.645 0.845 16.043 1.00 24.23 H new ATOM 1341 N GLU A 86 10.264 -2.920 16.227 1.00 4.24 N ATOM 1342 CA GLU A 86 8.852 -3.194 16.450 1.00 31.02 C ATOM 1343 C GLU A 86 8.012 -2.582 15.339 1.00 74.20 C ATOM 1344 O GLU A 86 7.897 -1.359 15.233 1.00 73.45 O ATOM 1345 CB GLU A 86 8.388 -2.658 17.807 1.00 2.11 C ATOM 1346 CG GLU A 86 6.930 -2.974 18.105 1.00 34.22 C ATOM 1347 CD GLU A 86 6.497 -2.543 19.491 1.00 72.24 C ATOM 1348 OE1 GLU A 86 6.859 -3.232 20.469 1.00 62.04 O ATOM 1349 OE2 GLU A 86 5.784 -1.523 19.606 1.00 74.34 O ATOM 0 H GLU A 86 10.444 -2.175 15.554 1.00 4.24 H new ATOM 0 HA GLU A 86 8.720 -4.276 16.447 1.00 31.02 H new ATOM 0 HB2 GLU A 86 9.014 -3.083 18.592 1.00 2.11 H new ATOM 0 HB3 GLU A 86 8.532 -1.578 17.833 1.00 2.11 H new ATOM 0 HG2 GLU A 86 6.300 -2.481 17.365 1.00 34.22 H new ATOM 0 HG3 GLU A 86 6.768 -4.047 17.998 1.00 34.22 H new ATOM 1356 N ASN A 87 7.457 -3.444 14.499 1.00 2.35 N ATOM 1357 CA ASN A 87 6.550 -3.029 13.440 1.00 14.32 C ATOM 1358 C ASN A 87 5.767 -4.244 12.965 1.00 12.41 C ATOM 1359 O ASN A 87 6.309 -5.349 12.899 1.00 24.25 O ATOM 1360 CB ASN A 87 7.327 -2.404 12.267 1.00 22.24 C ATOM 1361 CG ASN A 87 6.437 -1.637 11.294 1.00 34.23 C ATOM 1362 OD1 ASN A 87 5.254 -1.929 11.135 1.00 75.22 O ATOM 1363 ND2 ASN A 87 7.010 -0.650 10.623 1.00 75.41 N ATOM 0 H ASN A 87 7.623 -4.450 14.533 1.00 2.35 H new ATOM 0 HA ASN A 87 5.866 -2.273 13.826 1.00 14.32 H new ATOM 0 HB2 ASN A 87 8.087 -1.730 12.662 1.00 22.24 H new ATOM 0 HB3 ASN A 87 7.850 -3.192 11.726 1.00 22.24 H new ATOM 0 HD21 ASN A 87 6.467 -0.107 9.951 1.00 75.41 H new ATOM 0 HD22 ASN A 87 7.994 -0.432 10.778 1.00 75.41 H new ATOM 1370 N SER A 88 4.492 -4.057 12.676 1.00 25.33 N ATOM 1371 CA SER A 88 3.646 -5.134 12.195 1.00 70.34 C ATOM 1372 C SER A 88 2.538 -4.576 11.312 1.00 31.01 C ATOM 1373 O SER A 88 1.853 -3.624 11.692 1.00 75.11 O ATOM 1374 CB SER A 88 3.044 -5.907 13.370 1.00 62.02 C ATOM 1375 OG SER A 88 4.064 -6.455 14.189 1.00 52.45 O ATOM 0 H SER A 88 4.016 -3.160 12.767 1.00 25.33 H new ATOM 0 HA SER A 88 4.257 -5.818 11.606 1.00 70.34 H new ATOM 0 HB2 SER A 88 2.413 -5.244 13.962 1.00 62.02 H new ATOM 0 HB3 SER A 88 2.404 -6.706 12.996 1.00 62.02 H new ATOM 0 HG SER A 88 3.657 -6.944 14.935 1.00 52.45 H new ATOM 1381 N GLY A 89 2.383 -5.152 10.129 1.00 32.12 N ATOM 1382 CA GLY A 89 1.331 -4.723 9.235 1.00 34.24 C ATOM 1383 C GLY A 89 1.398 -5.419 7.899 1.00 13.50 C ATOM 1384 O GLY A 89 2.313 -5.179 7.113 1.00 0.34 O ATOM 0 H GLY A 89 2.968 -5.909 9.773 1.00 32.12 H new ATOM 0 HA2 GLY A 89 0.363 -4.918 9.696 1.00 34.24 H new ATOM 0 HA3 GLY A 89 1.401 -3.646 9.085 1.00 34.24 H new ATOM 1388 N GLU A 90 0.434 -6.287 7.645 1.00 24.33 N ATOM 1389 CA GLU A 90 0.376 -7.021 6.393 1.00 33.30 C ATOM 1390 C GLU A 90 -0.669 -6.403 5.466 1.00 12.45 C ATOM 1391 O GLU A 90 -1.650 -5.818 5.929 1.00 73.31 O ATOM 1392 CB GLU A 90 0.043 -8.504 6.637 1.00 2.04 C ATOM 1393 CG GLU A 90 -1.274 -8.752 7.363 1.00 14.52 C ATOM 1394 CD GLU A 90 -1.179 -8.539 8.859 1.00 43.45 C ATOM 1395 OE1 GLU A 90 -1.408 -7.405 9.323 1.00 11.12 O ATOM 1396 OE2 GLU A 90 -0.882 -9.511 9.584 1.00 13.41 O ATOM 0 H GLU A 90 -0.323 -6.501 8.294 1.00 24.33 H new ATOM 0 HA GLU A 90 1.357 -6.960 5.922 1.00 33.30 H new ATOM 0 HB2 GLU A 90 0.015 -9.018 5.676 1.00 2.04 H new ATOM 0 HB3 GLU A 90 0.851 -8.953 7.215 1.00 2.04 H new ATOM 0 HG2 GLU A 90 -2.037 -8.088 6.956 1.00 14.52 H new ATOM 0 HG3 GLU A 90 -1.603 -9.773 7.168 1.00 14.52 H new ATOM 1403 N VAL A 91 -0.448 -6.510 4.161 1.00 45.40 N ATOM 1404 CA VAL A 91 -1.442 -6.067 3.191 1.00 1.33 C ATOM 1405 C VAL A 91 -2.388 -7.215 2.885 1.00 21.55 C ATOM 1406 O VAL A 91 -1.966 -8.370 2.813 1.00 14.12 O ATOM 1407 CB VAL A 91 -0.813 -5.570 1.860 1.00 4.33 C ATOM 1408 CG1 VAL A 91 -0.202 -6.702 1.082 1.00 74.13 C ATOM 1409 CG2 VAL A 91 -1.840 -4.837 1.008 1.00 53.12 C ATOM 0 H VAL A 91 0.403 -6.896 3.753 1.00 45.40 H new ATOM 0 HA VAL A 91 -1.970 -5.225 3.638 1.00 1.33 H new ATOM 0 HB VAL A 91 -0.018 -4.871 2.121 1.00 4.33 H new ATOM 0 HG11 VAL A 91 0.228 -6.317 0.157 1.00 74.13 H new ATOM 0 HG12 VAL A 91 0.580 -7.173 1.678 1.00 74.13 H new ATOM 0 HG13 VAL A 91 -0.971 -7.438 0.846 1.00 74.13 H new ATOM 0 HG21 VAL A 91 -1.372 -4.501 0.083 1.00 53.12 H new ATOM 0 HG22 VAL A 91 -2.665 -5.510 0.773 1.00 53.12 H new ATOM 0 HG23 VAL A 91 -2.220 -3.975 1.557 1.00 53.12 H new ATOM 1419 N LEU A 92 -3.661 -6.914 2.738 1.00 25.14 N ATOM 1420 CA LEU A 92 -4.609 -7.911 2.285 1.00 32.31 C ATOM 1421 C LEU A 92 -5.045 -7.577 0.868 1.00 63.54 C ATOM 1422 O LEU A 92 -5.579 -6.497 0.617 1.00 41.24 O ATOM 1423 CB LEU A 92 -5.840 -7.988 3.203 1.00 63.53 C ATOM 1424 CG LEU A 92 -5.619 -8.539 4.622 1.00 23.34 C ATOM 1425 CD1 LEU A 92 -4.942 -9.895 4.573 1.00 65.44 C ATOM 1426 CD2 LEU A 92 -4.821 -7.567 5.480 1.00 24.43 C ATOM 0 H LEU A 92 -4.062 -5.995 2.924 1.00 25.14 H new ATOM 0 HA LEU A 92 -4.118 -8.884 2.311 1.00 32.31 H new ATOM 0 HB2 LEU A 92 -6.261 -6.986 3.290 1.00 63.53 H new ATOM 0 HB3 LEU A 92 -6.591 -8.607 2.712 1.00 63.53 H new ATOM 0 HG LEU A 92 -6.598 -8.660 5.085 1.00 23.34 H new ATOM 0 HD11 LEU A 92 -4.796 -10.265 5.588 1.00 65.44 H new ATOM 0 HD12 LEU A 92 -5.568 -10.594 4.018 1.00 65.44 H new ATOM 0 HD13 LEU A 92 -3.975 -9.801 4.078 1.00 65.44 H new ATOM 0 HD21 LEU A 92 -4.684 -7.989 6.476 1.00 24.43 H new ATOM 0 HD22 LEU A 92 -3.847 -7.393 5.022 1.00 24.43 H new ATOM 0 HD23 LEU A 92 -5.360 -6.623 5.557 1.00 24.43 H new ATOM 1438 N PHE A 93 -4.789 -8.490 -0.056 1.00 24.43 N ATOM 1439 CA PHE A 93 -5.267 -8.350 -1.421 1.00 40.34 C ATOM 1440 C PHE A 93 -6.548 -9.140 -1.573 1.00 41.14 C ATOM 1441 O PHE A 93 -6.533 -10.371 -1.598 1.00 22.21 O ATOM 1442 CB PHE A 93 -4.224 -8.833 -2.433 1.00 52.42 C ATOM 1443 CG PHE A 93 -3.155 -7.824 -2.732 1.00 12.32 C ATOM 1444 CD1 PHE A 93 -2.246 -7.435 -1.762 1.00 42.11 C ATOM 1445 CD2 PHE A 93 -3.063 -7.260 -3.992 1.00 22.02 C ATOM 1446 CE1 PHE A 93 -1.264 -6.505 -2.046 1.00 61.55 C ATOM 1447 CE2 PHE A 93 -2.084 -6.331 -4.279 1.00 55.32 C ATOM 1448 CZ PHE A 93 -1.186 -5.952 -3.306 1.00 51.24 C ATOM 0 H PHE A 93 -4.251 -9.339 0.117 1.00 24.43 H new ATOM 0 HA PHE A 93 -5.451 -7.295 -1.622 1.00 40.34 H new ATOM 0 HB2 PHE A 93 -3.757 -9.741 -2.053 1.00 52.42 H new ATOM 0 HB3 PHE A 93 -4.729 -9.099 -3.362 1.00 52.42 H new ATOM 0 HD1 PHE A 93 -2.305 -7.863 -0.772 1.00 42.11 H new ATOM 0 HD2 PHE A 93 -3.765 -7.550 -4.759 1.00 22.02 H new ATOM 0 HE1 PHE A 93 -0.559 -6.212 -1.282 1.00 61.55 H new ATOM 0 HE2 PHE A 93 -2.022 -5.901 -5.268 1.00 55.32 H new ATOM 0 HZ PHE A 93 -0.422 -5.222 -3.530 1.00 51.24 H new ATOM 1458 N ARG A 94 -7.660 -8.435 -1.640 1.00 72.13 N ATOM 1459 CA ARG A 94 -8.954 -9.083 -1.677 1.00 71.32 C ATOM 1460 C ARG A 94 -9.745 -8.599 -2.882 1.00 41.13 C ATOM 1461 O ARG A 94 -9.665 -7.422 -3.245 1.00 10.14 O ATOM 1462 CB ARG A 94 -9.720 -8.770 -0.389 1.00 60.21 C ATOM 1463 CG ARG A 94 -8.825 -8.692 0.841 1.00 63.45 C ATOM 1464 CD ARG A 94 -9.614 -8.400 2.106 1.00 43.13 C ATOM 1465 NE ARG A 94 -10.317 -9.579 2.602 1.00 63.31 N ATOM 1466 CZ ARG A 94 -11.206 -9.552 3.591 1.00 11.54 C ATOM 1467 NH1 ARG A 94 -11.542 -8.398 4.151 1.00 71.32 N ATOM 1468 NH2 ARG A 94 -11.759 -10.681 4.017 1.00 54.24 N ATOM 0 H ARG A 94 -7.693 -7.416 -1.670 1.00 72.13 H new ATOM 0 HA ARG A 94 -8.813 -10.161 -1.760 1.00 71.32 H new ATOM 0 HB2 ARG A 94 -10.245 -7.822 -0.508 1.00 60.21 H new ATOM 0 HB3 ARG A 94 -10.478 -9.537 -0.230 1.00 60.21 H new ATOM 0 HG2 ARG A 94 -8.289 -9.634 0.958 1.00 63.45 H new ATOM 0 HG3 ARG A 94 -8.076 -7.914 0.694 1.00 63.45 H new ATOM 0 HD2 ARG A 94 -8.938 -8.031 2.877 1.00 43.13 H new ATOM 0 HD3 ARG A 94 -10.334 -7.606 1.908 1.00 43.13 H new ATOM 0 HE ARG A 94 -10.114 -10.478 2.164 1.00 63.31 H new ATOM 0 HH11 ARG A 94 -11.119 -7.530 3.823 1.00 71.32 H new ATOM 0 HH12 ARG A 94 -12.224 -8.379 4.909 1.00 71.32 H new ATOM 0 HH21 ARG A 94 -11.502 -11.569 3.586 1.00 54.24 H new ATOM 0 HH22 ARG A 94 -12.441 -10.661 4.775 1.00 54.24 H new ATOM 1482 N PRO A 95 -10.512 -9.497 -3.518 1.00 42.02 N ATOM 1483 CA PRO A 95 -11.394 -9.131 -4.624 1.00 13.35 C ATOM 1484 C PRO A 95 -12.388 -8.066 -4.187 1.00 74.25 C ATOM 1485 O PRO A 95 -13.215 -8.301 -3.304 1.00 74.15 O ATOM 1486 CB PRO A 95 -12.111 -10.439 -4.968 1.00 52.23 C ATOM 1487 CG PRO A 95 -11.215 -11.510 -4.451 1.00 3.03 C ATOM 1488 CD PRO A 95 -10.569 -10.940 -3.220 1.00 55.30 C ATOM 0 HA PRO A 95 -10.856 -8.711 -5.474 1.00 13.35 H new ATOM 0 HB2 PRO A 95 -13.095 -10.486 -4.501 1.00 52.23 H new ATOM 0 HB3 PRO A 95 -12.264 -10.536 -6.043 1.00 52.23 H new ATOM 0 HG2 PRO A 95 -11.779 -12.412 -4.215 1.00 3.03 H new ATOM 0 HG3 PRO A 95 -10.467 -11.787 -5.194 1.00 3.03 H new ATOM 0 HD2 PRO A 95 -11.155 -11.145 -2.324 1.00 55.30 H new ATOM 0 HD3 PRO A 95 -9.576 -11.358 -3.054 1.00 55.30 H new ATOM 1496 N ALA A 96 -12.282 -6.891 -4.788 1.00 63.52 N ATOM 1497 CA ALA A 96 -13.070 -5.746 -4.368 1.00 63.12 C ATOM 1498 C ALA A 96 -14.554 -5.974 -4.611 1.00 24.55 C ATOM 1499 O ALA A 96 -14.939 -6.595 -5.608 1.00 1.32 O ATOM 1500 CB ALA A 96 -12.604 -4.493 -5.090 1.00 14.13 C ATOM 0 H ALA A 96 -11.655 -6.706 -5.571 1.00 63.52 H new ATOM 0 HA ALA A 96 -12.923 -5.614 -3.296 1.00 63.12 H new ATOM 0 HB1 ALA A 96 -13.203 -3.642 -4.766 1.00 14.13 H new ATOM 0 HB2 ALA A 96 -11.555 -4.308 -4.858 1.00 14.13 H new ATOM 0 HB3 ALA A 96 -12.719 -4.629 -6.165 1.00 14.13 H new ATOM 1506 N PRO A 97 -15.402 -5.473 -3.699 1.00 2.22 N ATOM 1507 CA PRO A 97 -16.858 -5.582 -3.822 1.00 62.33 C ATOM 1508 C PRO A 97 -17.363 -5.002 -5.138 1.00 43.11 C ATOM 1509 O PRO A 97 -16.901 -3.953 -5.588 1.00 62.51 O ATOM 1510 CB PRO A 97 -17.384 -4.765 -2.639 1.00 65.10 C ATOM 1511 CG PRO A 97 -16.271 -4.773 -1.652 1.00 10.44 C ATOM 1512 CD PRO A 97 -15.007 -4.773 -2.462 1.00 34.34 C ATOM 0 HA PRO A 97 -17.193 -6.619 -3.815 1.00 62.33 H new ATOM 0 HB2 PRO A 97 -17.639 -3.749 -2.941 1.00 65.10 H new ATOM 0 HB3 PRO A 97 -18.287 -5.209 -2.221 1.00 65.10 H new ATOM 0 HG2 PRO A 97 -16.319 -3.900 -1.002 1.00 10.44 H new ATOM 0 HG3 PRO A 97 -16.324 -5.652 -1.010 1.00 10.44 H new ATOM 0 HD2 PRO A 97 -14.659 -3.760 -2.666 1.00 34.34 H new ATOM 0 HD3 PRO A 97 -14.198 -5.291 -1.947 1.00 34.34 H new ATOM 1520 N GLY A 98 -18.293 -5.707 -5.763 1.00 3.03 N ATOM 1521 CA GLY A 98 -18.842 -5.261 -7.025 1.00 0.04 C ATOM 1522 C GLY A 98 -17.916 -5.558 -8.186 1.00 61.45 C ATOM 1523 O GLY A 98 -18.071 -4.986 -9.267 1.00 22.14 O ATOM 0 H GLY A 98 -18.679 -6.585 -5.416 1.00 3.03 H new ATOM 0 HA2 GLY A 98 -19.802 -5.748 -7.194 1.00 0.04 H new ATOM 0 HA3 GLY A 98 -19.032 -4.189 -6.978 1.00 0.04 H new ATOM 1527 N ALA A 99 -16.949 -6.452 -7.953 1.00 62.43 N ATOM 1528 CA ALA A 99 -15.959 -6.827 -8.964 1.00 64.22 C ATOM 1529 C ALA A 99 -15.202 -5.602 -9.460 1.00 63.20 C ATOM 1530 O ALA A 99 -14.780 -5.534 -10.615 1.00 12.24 O ATOM 1531 CB ALA A 99 -16.628 -7.554 -10.121 1.00 32.44 C ATOM 0 H ALA A 99 -16.832 -6.933 -7.061 1.00 62.43 H new ATOM 0 HA ALA A 99 -15.239 -7.504 -8.504 1.00 64.22 H new ATOM 0 HB1 ALA A 99 -15.877 -7.825 -10.863 1.00 32.44 H new ATOM 0 HB2 ALA A 99 -17.115 -8.456 -9.751 1.00 32.44 H new ATOM 0 HB3 ALA A 99 -17.372 -6.902 -10.579 1.00 32.44 H new ATOM 1537 N ARG A 100 -14.998 -4.654 -8.555 1.00 64.51 N ATOM 1538 CA ARG A 100 -14.370 -3.381 -8.888 1.00 1.22 C ATOM 1539 C ARG A 100 -12.854 -3.536 -9.027 1.00 2.14 C ATOM 1540 O ARG A 100 -12.135 -2.572 -9.288 1.00 51.23 O ATOM 1541 CB ARG A 100 -14.704 -2.348 -7.808 1.00 71.41 C ATOM 1542 CG ARG A 100 -14.413 -0.916 -8.218 1.00 24.04 C ATOM 1543 CD ARG A 100 -14.687 0.060 -7.085 1.00 10.15 C ATOM 1544 NE ARG A 100 -14.547 1.444 -7.524 1.00 63.10 N ATOM 1545 CZ ARG A 100 -13.924 2.394 -6.832 1.00 65.43 C ATOM 1546 NH1 ARG A 100 -13.376 2.123 -5.651 1.00 43.42 N ATOM 1547 NH2 ARG A 100 -13.850 3.622 -7.326 1.00 31.41 N ATOM 0 H ARG A 100 -15.261 -4.744 -7.574 1.00 64.51 H new ATOM 0 HA ARG A 100 -14.759 -3.040 -9.847 1.00 1.22 H new ATOM 0 HB2 ARG A 100 -15.759 -2.435 -7.550 1.00 71.41 H new ATOM 0 HB3 ARG A 100 -14.135 -2.581 -6.908 1.00 71.41 H new ATOM 0 HG2 ARG A 100 -13.371 -0.831 -8.528 1.00 24.04 H new ATOM 0 HG3 ARG A 100 -15.025 -0.653 -9.081 1.00 24.04 H new ATOM 0 HD2 ARG A 100 -15.694 -0.101 -6.701 1.00 10.15 H new ATOM 0 HD3 ARG A 100 -13.998 -0.133 -6.263 1.00 10.15 H new ATOM 0 HE ARG A 100 -14.955 1.701 -8.423 1.00 63.10 H new ATOM 0 HH11 ARG A 100 -13.431 1.179 -5.268 1.00 43.42 H new ATOM 0 HH12 ARG A 100 -12.901 2.859 -5.129 1.00 43.42 H new ATOM 0 HH21 ARG A 100 -14.269 3.834 -8.231 1.00 31.41 H new ATOM 0 HH22 ARG A 100 -13.374 4.355 -6.801 1.00 31.41 H new ATOM 1561 N GLY A 101 -12.381 -4.757 -8.851 1.00 11.52 N ATOM 1562 CA GLY A 101 -10.967 -5.028 -8.949 1.00 33.05 C ATOM 1563 C GLY A 101 -10.437 -5.662 -7.688 1.00 31.01 C ATOM 1564 O GLY A 101 -10.965 -6.676 -7.229 1.00 70.52 O ATOM 0 H GLY A 101 -12.958 -5.572 -8.640 1.00 11.52 H new ATOM 0 HA2 GLY A 101 -10.780 -5.688 -9.796 1.00 33.05 H new ATOM 0 HA3 GLY A 101 -10.430 -4.100 -9.144 1.00 33.05 H new ATOM 1568 N THR A 102 -9.417 -5.057 -7.113 1.00 50.30 N ATOM 1569 CA THR A 102 -8.830 -5.551 -5.884 1.00 21.11 C ATOM 1570 C THR A 102 -8.587 -4.408 -4.911 1.00 73.15 C ATOM 1571 O THR A 102 -8.026 -3.371 -5.277 1.00 25.14 O ATOM 1572 CB THR A 102 -7.513 -6.290 -6.169 1.00 11.33 C ATOM 1573 OG1 THR A 102 -7.772 -7.364 -7.072 1.00 10.45 O ATOM 1574 CG2 THR A 102 -6.881 -6.835 -4.893 1.00 35.23 C ATOM 0 H THR A 102 -8.974 -4.215 -7.481 1.00 50.30 H new ATOM 0 HA THR A 102 -9.531 -6.253 -5.432 1.00 21.11 H new ATOM 0 HB THR A 102 -6.810 -5.581 -6.608 1.00 11.33 H new ATOM 0 HG1 THR A 102 -7.283 -7.214 -7.908 1.00 10.45 H new ATOM 0 HG21 THR A 102 -5.952 -7.350 -5.138 1.00 35.23 H new ATOM 0 HG22 THR A 102 -6.670 -6.011 -4.211 1.00 35.23 H new ATOM 0 HG23 THR A 102 -7.568 -7.534 -4.416 1.00 35.23 H new ATOM 1582 N GLU A 103 -9.031 -4.592 -3.685 1.00 34.25 N ATOM 1583 CA GLU A 103 -8.858 -3.590 -2.654 1.00 12.13 C ATOM 1584 C GLU A 103 -7.694 -3.980 -1.756 1.00 74.15 C ATOM 1585 O GLU A 103 -7.749 -5.003 -1.072 1.00 62.01 O ATOM 1586 CB GLU A 103 -10.143 -3.453 -1.835 1.00 72.33 C ATOM 1587 CG GLU A 103 -10.067 -2.401 -0.740 1.00 60.31 C ATOM 1588 CD GLU A 103 -11.335 -2.324 0.083 1.00 72.13 C ATOM 1589 OE1 GLU A 103 -11.472 -3.105 1.044 1.00 5.35 O ATOM 1590 OE2 GLU A 103 -12.201 -1.476 -0.222 1.00 53.34 O ATOM 0 H GLU A 103 -9.518 -5.433 -3.377 1.00 34.25 H new ATOM 0 HA GLU A 103 -8.641 -2.628 -3.118 1.00 12.13 H new ATOM 0 HB2 GLU A 103 -10.965 -3.206 -2.506 1.00 72.33 H new ATOM 0 HB3 GLU A 103 -10.379 -4.417 -1.384 1.00 72.33 H new ATOM 0 HG2 GLU A 103 -9.226 -2.625 -0.084 1.00 60.31 H new ATOM 0 HG3 GLU A 103 -9.870 -1.428 -1.190 1.00 60.31 H new ATOM 1597 N VAL A 104 -6.630 -3.191 -1.787 1.00 44.52 N ATOM 1598 CA VAL A 104 -5.509 -3.425 -0.909 1.00 42.42 C ATOM 1599 C VAL A 104 -5.740 -2.681 0.398 1.00 71.22 C ATOM 1600 O VAL A 104 -6.064 -1.489 0.418 1.00 4.43 O ATOM 1601 CB VAL A 104 -4.163 -3.005 -1.542 1.00 30.02 C ATOM 1602 CG1 VAL A 104 -4.014 -3.576 -2.947 1.00 64.03 C ATOM 1603 CG2 VAL A 104 -3.999 -1.500 -1.556 1.00 13.31 C ATOM 0 H VAL A 104 -6.526 -2.389 -2.409 1.00 44.52 H new ATOM 0 HA VAL A 104 -5.442 -4.497 -0.724 1.00 42.42 H new ATOM 0 HB VAL A 104 -3.370 -3.420 -0.920 1.00 30.02 H new ATOM 0 HG11 VAL A 104 -3.058 -3.264 -3.367 1.00 64.03 H new ATOM 0 HG12 VAL A 104 -4.053 -4.664 -2.903 1.00 64.03 H new ATOM 0 HG13 VAL A 104 -4.824 -3.209 -3.577 1.00 64.03 H new ATOM 0 HG21 VAL A 104 -3.041 -1.243 -2.008 1.00 13.31 H new ATOM 0 HG22 VAL A 104 -4.806 -1.051 -2.135 1.00 13.31 H new ATOM 0 HG23 VAL A 104 -4.032 -1.121 -0.535 1.00 13.31 H new ATOM 1613 N VAL A 105 -5.633 -3.409 1.480 1.00 40.05 N ATOM 1614 CA VAL A 105 -5.826 -2.854 2.794 1.00 34.44 C ATOM 1615 C VAL A 105 -4.588 -3.095 3.642 1.00 41.51 C ATOM 1616 O VAL A 105 -4.173 -4.237 3.852 1.00 45.23 O ATOM 1617 CB VAL A 105 -7.072 -3.449 3.487 1.00 42.51 C ATOM 1618 CG1 VAL A 105 -8.348 -2.944 2.835 1.00 35.04 C ATOM 1619 CG2 VAL A 105 -7.048 -4.965 3.464 1.00 25.13 C ATOM 0 H VAL A 105 -5.409 -4.404 1.474 1.00 40.05 H new ATOM 0 HA VAL A 105 -5.990 -1.782 2.686 1.00 34.44 H new ATOM 0 HB VAL A 105 -7.052 -3.121 4.526 1.00 42.51 H new ATOM 0 HG11 VAL A 105 -9.211 -3.377 3.341 1.00 35.04 H new ATOM 0 HG12 VAL A 105 -8.390 -1.857 2.911 1.00 35.04 H new ATOM 0 HG13 VAL A 105 -8.359 -3.235 1.785 1.00 35.04 H new ATOM 0 HG21 VAL A 105 -7.939 -5.351 3.960 1.00 25.13 H new ATOM 0 HG22 VAL A 105 -7.028 -5.313 2.431 1.00 25.13 H new ATOM 0 HG23 VAL A 105 -6.160 -5.323 3.984 1.00 25.13 H new ATOM 1629 N VAL A 106 -3.978 -2.017 4.089 1.00 0.54 N ATOM 1630 CA VAL A 106 -2.795 -2.114 4.921 1.00 73.54 C ATOM 1631 C VAL A 106 -3.024 -1.463 6.274 1.00 23.13 C ATOM 1632 O VAL A 106 -3.370 -0.284 6.360 1.00 34.54 O ATOM 1633 CB VAL A 106 -1.550 -1.487 4.251 1.00 24.44 C ATOM 1634 CG1 VAL A 106 -0.926 -2.453 3.266 1.00 55.42 C ATOM 1635 CG2 VAL A 106 -1.902 -0.187 3.547 1.00 11.42 C ATOM 0 H VAL A 106 -4.281 -1.063 3.891 1.00 0.54 H new ATOM 0 HA VAL A 106 -2.604 -3.178 5.058 1.00 73.54 H new ATOM 0 HB VAL A 106 -0.828 -1.270 5.038 1.00 24.44 H new ATOM 0 HG11 VAL A 106 -0.052 -1.991 2.807 1.00 55.42 H new ATOM 0 HG12 VAL A 106 -0.624 -3.361 3.788 1.00 55.42 H new ATOM 0 HG13 VAL A 106 -1.652 -2.704 2.493 1.00 55.42 H new ATOM 0 HG21 VAL A 106 -1.007 0.231 3.085 1.00 11.42 H new ATOM 0 HG22 VAL A 106 -2.650 -0.381 2.778 1.00 11.42 H new ATOM 0 HG23 VAL A 106 -2.301 0.523 4.272 1.00 11.42 H new ATOM 1645 N ARG A 107 -2.862 -2.251 7.324 1.00 62.15 N ATOM 1646 CA ARG A 107 -2.926 -1.742 8.683 1.00 43.23 C ATOM 1647 C ARG A 107 -1.545 -1.877 9.317 1.00 2.33 C ATOM 1648 O ARG A 107 -1.061 -2.977 9.552 1.00 41.04 O ATOM 1649 CB ARG A 107 -4.011 -2.481 9.494 1.00 75.30 C ATOM 1650 CG ARG A 107 -3.785 -3.982 9.641 1.00 11.14 C ATOM 1651 CD ARG A 107 -3.256 -4.328 11.025 1.00 11.33 C ATOM 1652 NE ARG A 107 -2.392 -5.506 11.009 1.00 44.25 N ATOM 1653 CZ ARG A 107 -1.702 -5.933 12.062 1.00 52.05 C ATOM 1654 NH1 ARG A 107 -1.843 -5.348 13.243 1.00 12.54 N ATOM 1655 NH2 ARG A 107 -0.884 -6.967 11.937 1.00 21.02 N ATOM 0 H ARG A 107 -2.684 -3.253 7.259 1.00 62.15 H new ATOM 0 HA ARG A 107 -3.208 -0.689 8.677 1.00 43.23 H new ATOM 0 HB2 ARG A 107 -4.068 -2.037 10.488 1.00 75.30 H new ATOM 0 HB3 ARG A 107 -4.977 -2.318 9.016 1.00 75.30 H new ATOM 0 HG2 ARG A 107 -4.721 -4.512 9.464 1.00 11.14 H new ATOM 0 HG3 ARG A 107 -3.078 -4.322 8.884 1.00 11.14 H new ATOM 0 HD2 ARG A 107 -2.701 -3.478 11.422 1.00 11.33 H new ATOM 0 HD3 ARG A 107 -4.095 -4.504 11.699 1.00 11.33 H new ATOM 0 HE ARG A 107 -2.314 -6.032 10.139 1.00 44.25 H new ATOM 0 HH11 ARG A 107 -2.485 -4.563 13.350 1.00 12.54 H new ATOM 0 HH12 ARG A 107 -1.309 -5.683 14.045 1.00 12.54 H new ATOM 0 HH21 ARG A 107 -0.785 -7.433 11.035 1.00 21.02 H new ATOM 0 HH22 ARG A 107 -0.353 -7.297 12.743 1.00 21.02 H new ATOM 1669 N LEU A 108 -0.886 -0.756 9.534 1.00 11.02 N ATOM 1670 CA LEU A 108 0.485 -0.771 10.022 1.00 43.54 C ATOM 1671 C LEU A 108 0.730 0.339 11.036 1.00 75.11 C ATOM 1672 O LEU A 108 0.077 1.382 11.006 1.00 11.30 O ATOM 1673 CB LEU A 108 1.472 -0.678 8.846 1.00 71.23 C ATOM 1674 CG LEU A 108 0.960 0.047 7.592 1.00 72.30 C ATOM 1675 CD1 LEU A 108 0.761 1.536 7.846 1.00 71.32 C ATOM 1676 CD2 LEU A 108 1.913 -0.177 6.429 1.00 73.22 C ATOM 0 H LEU A 108 -1.273 0.175 9.382 1.00 11.02 H new ATOM 0 HA LEU A 108 0.650 -1.718 10.536 1.00 43.54 H new ATOM 0 HB2 LEU A 108 2.372 -0.171 9.193 1.00 71.23 H new ATOM 0 HB3 LEU A 108 1.765 -1.689 8.563 1.00 71.23 H new ATOM 0 HG LEU A 108 -0.013 -0.373 7.336 1.00 72.30 H new ATOM 0 HD11 LEU A 108 0.398 2.015 6.937 1.00 71.32 H new ATOM 0 HD12 LEU A 108 0.032 1.675 8.645 1.00 71.32 H new ATOM 0 HD13 LEU A 108 1.710 1.985 8.139 1.00 71.32 H new ATOM 0 HD21 LEU A 108 1.539 0.342 5.547 1.00 73.22 H new ATOM 0 HD22 LEU A 108 2.899 0.210 6.687 1.00 73.22 H new ATOM 0 HD23 LEU A 108 1.986 -1.244 6.219 1.00 73.22 H new ATOM 1688 N THR A 109 1.660 0.101 11.946 1.00 1.43 N ATOM 1689 CA THR A 109 1.943 1.060 12.994 1.00 11.44 C ATOM 1690 C THR A 109 3.167 1.905 12.644 1.00 23.24 C ATOM 1691 O THR A 109 4.194 1.392 12.195 1.00 20.03 O ATOM 1692 CB THR A 109 2.135 0.367 14.365 1.00 52.42 C ATOM 1693 OG1 THR A 109 2.215 1.345 15.410 1.00 40.35 O ATOM 1694 CG2 THR A 109 3.384 -0.504 14.377 1.00 33.41 C ATOM 0 H THR A 109 2.228 -0.745 11.978 1.00 1.43 H new ATOM 0 HA THR A 109 1.079 1.719 13.073 1.00 11.44 H new ATOM 0 HB THR A 109 1.270 -0.274 14.536 1.00 52.42 H new ATOM 0 HG1 THR A 109 2.335 0.894 16.272 1.00 40.35 H new ATOM 0 HG21 THR A 109 3.489 -0.976 15.354 1.00 33.41 H new ATOM 0 HG22 THR A 109 3.298 -1.273 13.610 1.00 33.41 H new ATOM 0 HG23 THR A 109 4.260 0.113 14.176 1.00 33.41 H new ATOM 1702 N TYR A 110 3.019 3.208 12.826 1.00 71.14 N ATOM 1703 CA TYR A 110 4.069 4.175 12.541 1.00 61.40 C ATOM 1704 C TYR A 110 3.898 5.382 13.449 1.00 42.53 C ATOM 1705 O TYR A 110 2.995 5.413 14.283 1.00 60.42 O ATOM 1706 CB TYR A 110 4.029 4.631 11.075 1.00 25.20 C ATOM 1707 CG TYR A 110 4.579 3.624 10.090 1.00 4.11 C ATOM 1708 CD1 TYR A 110 5.947 3.513 9.874 1.00 44.44 C ATOM 1709 CD2 TYR A 110 3.733 2.786 9.375 1.00 1.04 C ATOM 1710 CE1 TYR A 110 6.454 2.597 8.971 1.00 1.42 C ATOM 1711 CE2 TYR A 110 4.233 1.867 8.474 1.00 51.32 C ATOM 1712 CZ TYR A 110 5.593 1.776 8.276 1.00 71.21 C ATOM 1713 OH TYR A 110 6.095 0.859 7.380 1.00 71.43 O ATOM 0 H TYR A 110 2.159 3.628 13.179 1.00 71.14 H new ATOM 0 HA TYR A 110 5.032 3.697 12.722 1.00 61.40 H new ATOM 0 HB2 TYR A 110 2.997 4.857 10.806 1.00 25.20 H new ATOM 0 HB3 TYR A 110 4.594 5.559 10.981 1.00 25.20 H new ATOM 0 HD1 TYR A 110 6.625 4.152 10.420 1.00 44.44 H new ATOM 0 HD2 TYR A 110 2.666 2.854 9.526 1.00 1.04 H new ATOM 0 HE1 TYR A 110 7.520 2.525 8.811 1.00 1.42 H new ATOM 0 HE2 TYR A 110 3.561 1.222 7.927 1.00 51.32 H new ATOM 0 HH TYR A 110 5.356 0.358 6.975 1.00 71.43 H new ATOM 1782 N GLY A 115 7.126 17.090 10.410 1.00 23.42 N ATOM 1783 CA GLY A 115 7.652 18.148 9.558 1.00 32.52 C ATOM 1784 C GLY A 115 6.605 19.174 9.167 1.00 0.40 C ATOM 1785 O GLY A 115 5.659 18.869 8.442 1.00 5.53 O ATOM 0 HA2 GLY A 115 8.469 18.651 10.076 1.00 32.52 H new ATOM 0 HA3 GLY A 115 8.072 17.704 8.655 1.00 32.52 H new ATOM 1789 N SER A 116 6.768 20.387 9.668 1.00 24.24 N ATOM 1790 CA SER A 116 5.839 21.470 9.386 1.00 4.43 C ATOM 1791 C SER A 116 6.212 22.194 8.092 1.00 71.03 C ATOM 1792 O SER A 116 5.345 22.701 7.377 1.00 63.34 O ATOM 1793 CB SER A 116 5.839 22.455 10.554 1.00 61.43 C ATOM 1794 OG SER A 116 5.704 21.772 11.793 1.00 14.51 O ATOM 0 H SER A 116 7.543 20.649 10.278 1.00 24.24 H new ATOM 0 HA SER A 116 4.842 21.048 9.259 1.00 4.43 H new ATOM 0 HB2 SER A 116 6.765 23.030 10.550 1.00 61.43 H new ATOM 0 HB3 SER A 116 5.022 23.166 10.435 1.00 61.43 H new ATOM 0 HG SER A 116 5.708 22.422 12.527 1.00 14.51 H new ATOM 1800 N ALA A 117 7.506 22.220 7.793 1.00 32.40 N ATOM 1801 CA ALA A 117 8.033 22.997 6.675 1.00 25.01 C ATOM 1802 C ALA A 117 7.529 22.485 5.329 1.00 11.25 C ATOM 1803 O ALA A 117 7.274 23.268 4.417 1.00 52.04 O ATOM 1804 CB ALA A 117 9.552 22.981 6.705 1.00 61.02 C ATOM 0 H ALA A 117 8.216 21.707 8.315 1.00 32.40 H new ATOM 0 HA ALA A 117 7.674 24.020 6.788 1.00 25.01 H new ATOM 0 HB1 ALA A 117 9.939 23.563 5.868 1.00 61.02 H new ATOM 0 HB2 ALA A 117 9.902 23.416 7.641 1.00 61.02 H new ATOM 0 HB3 ALA A 117 9.907 21.953 6.627 1.00 61.02 H new ATOM 1810 N GLY A 118 7.380 21.173 5.213 1.00 34.33 N ATOM 1811 CA GLY A 118 6.967 20.573 3.955 1.00 41.14 C ATOM 1812 C GLY A 118 5.608 21.058 3.475 1.00 74.44 C ATOM 1813 O GLY A 118 5.332 21.055 2.272 1.00 43.44 O ATOM 0 H GLY A 118 7.538 20.508 5.970 1.00 34.33 H new ATOM 0 HA2 GLY A 118 7.714 20.794 3.193 1.00 41.14 H new ATOM 0 HA3 GLY A 118 6.939 19.489 4.069 1.00 41.14 H new ATOM 1817 N ALA A 119 4.769 21.492 4.408 1.00 53.43 N ATOM 1818 CA ALA A 119 3.418 21.935 4.081 1.00 54.15 C ATOM 1819 C ALA A 119 3.441 23.159 3.168 1.00 31.22 C ATOM 1820 O ALA A 119 2.747 23.199 2.152 1.00 11.43 O ATOM 1821 CB ALA A 119 2.635 22.236 5.351 1.00 64.14 C ATOM 0 H ALA A 119 5.001 21.547 5.400 1.00 53.43 H new ATOM 0 HA ALA A 119 2.922 21.126 3.545 1.00 54.15 H new ATOM 0 HB1 ALA A 119 1.629 22.565 5.089 1.00 64.14 H new ATOM 0 HB2 ALA A 119 2.574 21.336 5.963 1.00 64.14 H new ATOM 0 HB3 ALA A 119 3.140 23.023 5.912 1.00 64.14 H new ATOM 1827 N VAL A 120 4.266 24.141 3.514 1.00 22.15 N ATOM 1828 CA VAL A 120 4.334 25.378 2.748 1.00 41.41 C ATOM 1829 C VAL A 120 5.087 25.173 1.434 1.00 53.40 C ATOM 1830 O VAL A 120 4.882 25.910 0.472 1.00 52.20 O ATOM 1831 CB VAL A 120 4.995 26.516 3.557 1.00 44.40 C ATOM 1832 CG1 VAL A 120 4.226 26.767 4.844 1.00 33.22 C ATOM 1833 CG2 VAL A 120 6.459 26.209 3.854 1.00 3.10 C ATOM 0 H VAL A 120 4.894 24.104 4.317 1.00 22.15 H new ATOM 0 HA VAL A 120 3.307 25.668 2.525 1.00 41.41 H new ATOM 0 HB VAL A 120 4.964 27.421 2.951 1.00 44.40 H new ATOM 0 HG11 VAL A 120 4.704 27.572 5.403 1.00 33.22 H new ATOM 0 HG12 VAL A 120 3.201 27.050 4.606 1.00 33.22 H new ATOM 0 HG13 VAL A 120 4.221 25.859 5.448 1.00 33.22 H new ATOM 0 HG21 VAL A 120 6.894 27.030 4.424 1.00 3.10 H new ATOM 0 HG22 VAL A 120 6.527 25.288 4.433 1.00 3.10 H new ATOM 0 HG23 VAL A 120 7.003 26.090 2.917 1.00 3.10 H new ATOM 1843 N ILE A 121 5.943 24.157 1.396 1.00 45.24 N ATOM 1844 CA ILE A 121 6.716 23.855 0.198 1.00 75.21 C ATOM 1845 C ILE A 121 5.818 23.248 -0.876 1.00 63.12 C ATOM 1846 O ILE A 121 6.004 23.498 -2.067 1.00 40.11 O ATOM 1847 CB ILE A 121 7.888 22.894 0.509 1.00 42.41 C ATOM 1848 CG1 ILE A 121 8.787 23.498 1.592 1.00 11.41 C ATOM 1849 CG2 ILE A 121 8.698 22.609 -0.750 1.00 63.41 C ATOM 1850 CD1 ILE A 121 9.931 22.596 2.012 1.00 4.21 C ATOM 0 H ILE A 121 6.118 23.530 2.181 1.00 45.24 H new ATOM 0 HA ILE A 121 7.133 24.792 -0.171 1.00 75.21 H new ATOM 0 HB ILE A 121 7.478 21.952 0.873 1.00 42.41 H new ATOM 0 HG12 ILE A 121 9.195 24.441 1.228 1.00 11.41 H new ATOM 0 HG13 ILE A 121 8.180 23.730 2.467 1.00 11.41 H new ATOM 0 HG21 ILE A 121 9.517 21.931 -0.510 1.00 63.41 H new ATOM 0 HG22 ILE A 121 8.055 22.149 -1.500 1.00 63.41 H new ATOM 0 HG23 ILE A 121 9.102 23.542 -1.142 1.00 63.41 H new ATOM 0 HD11 ILE A 121 10.522 23.093 2.781 1.00 4.21 H new ATOM 0 HD12 ILE A 121 9.532 21.662 2.408 1.00 4.21 H new ATOM 0 HD13 ILE A 121 10.563 22.384 1.149 1.00 4.21 H new ATOM 1862 N ALA A 122 4.817 22.485 -0.442 1.00 72.51 N ATOM 1863 CA ALA A 122 3.884 21.835 -1.359 1.00 15.45 C ATOM 1864 C ALA A 122 3.106 22.862 -2.178 1.00 31.45 C ATOM 1865 O ALA A 122 2.614 22.558 -3.262 1.00 13.42 O ATOM 1866 CB ALA A 122 2.930 20.938 -0.586 1.00 1.32 C ATOM 0 H ALA A 122 4.631 22.301 0.544 1.00 72.51 H new ATOM 0 HA ALA A 122 4.461 21.224 -2.053 1.00 15.45 H new ATOM 0 HB1 ALA A 122 2.239 20.459 -1.279 1.00 1.32 H new ATOM 0 HB2 ALA A 122 3.498 20.175 -0.054 1.00 1.32 H new ATOM 0 HB3 ALA A 122 2.368 21.537 0.131 1.00 1.32 H new ATOM 1872 N ARG A 123 3.019 24.082 -1.655 1.00 73.24 N ATOM 1873 CA ARG A 123 2.314 25.172 -2.324 1.00 43.11 C ATOM 1874 C ARG A 123 2.986 25.533 -3.650 1.00 50.21 C ATOM 1875 O ARG A 123 2.336 26.024 -4.574 1.00 23.55 O ATOM 1876 CB ARG A 123 2.264 26.395 -1.401 1.00 4.44 C ATOM 1877 CG ARG A 123 1.713 27.648 -2.060 1.00 31.03 C ATOM 1878 CD ARG A 123 1.723 28.823 -1.098 1.00 53.42 C ATOM 1879 NE ARG A 123 1.423 30.087 -1.769 1.00 72.13 N ATOM 1880 CZ ARG A 123 0.755 31.096 -1.203 1.00 30.10 C ATOM 1881 NH1 ARG A 123 0.290 30.986 0.037 1.00 42.41 N ATOM 1882 NH2 ARG A 123 0.561 32.220 -1.880 1.00 41.23 N ATOM 0 H ARG A 123 3.433 24.342 -0.760 1.00 73.24 H new ATOM 0 HA ARG A 123 1.298 24.844 -2.545 1.00 43.11 H new ATOM 0 HB2 ARG A 123 1.652 26.156 -0.532 1.00 4.44 H new ATOM 0 HB3 ARG A 123 3.270 26.602 -1.035 1.00 4.44 H new ATOM 0 HG2 ARG A 123 2.308 27.890 -2.941 1.00 31.03 H new ATOM 0 HG3 ARG A 123 0.695 27.464 -2.403 1.00 31.03 H new ATOM 0 HD2 ARG A 123 0.992 28.650 -0.308 1.00 53.42 H new ATOM 0 HD3 ARG A 123 2.700 28.890 -0.619 1.00 53.42 H new ATOM 0 HE ARG A 123 1.744 30.206 -2.730 1.00 72.13 H new ATOM 0 HH11 ARG A 123 0.442 30.126 0.564 1.00 42.41 H new ATOM 0 HH12 ARG A 123 -0.219 31.761 0.461 1.00 42.41 H new ATOM 0 HH21 ARG A 123 0.921 32.312 -2.830 1.00 41.23 H new ATOM 0 HH22 ARG A 123 0.051 32.992 -1.451 1.00 41.23 H new ATOM 1896 N MET A 124 4.284 25.275 -3.742 1.00 32.43 N ATOM 1897 CA MET A 124 5.050 25.589 -4.943 1.00 52.24 C ATOM 1898 C MET A 124 4.683 24.645 -6.088 1.00 63.11 C ATOM 1899 O MET A 124 4.790 25.002 -7.263 1.00 22.03 O ATOM 1900 CB MET A 124 6.550 25.494 -4.644 1.00 34.34 C ATOM 1901 CG MET A 124 7.446 25.747 -5.850 1.00 43.22 C ATOM 1902 SD MET A 124 7.283 27.417 -6.511 1.00 72.53 S ATOM 1903 CE MET A 124 8.405 27.325 -7.905 1.00 15.11 C ATOM 0 H MET A 124 4.832 24.847 -2.996 1.00 32.43 H new ATOM 0 HA MET A 124 4.807 26.606 -5.249 1.00 52.24 H new ATOM 0 HB2 MET A 124 6.799 26.213 -3.863 1.00 34.34 H new ATOM 0 HB3 MET A 124 6.767 24.503 -4.246 1.00 34.34 H new ATOM 0 HG2 MET A 124 8.484 25.574 -5.567 1.00 43.22 H new ATOM 0 HG3 MET A 124 7.205 25.027 -6.632 1.00 43.22 H new ATOM 0 HE1 MET A 124 8.420 28.283 -8.424 1.00 15.11 H new ATOM 0 HE2 MET A 124 9.408 27.089 -7.550 1.00 15.11 H new ATOM 0 HE3 MET A 124 8.070 26.546 -8.591 1.00 15.11 H new ATOM 2057 N ARG A 134 -4.480 9.082 3.291 1.00 11.21 N ATOM 2058 CA ARG A 134 -3.092 9.081 2.874 1.00 73.50 C ATOM 2059 C ARG A 134 -2.979 9.472 1.404 1.00 74.20 C ATOM 2060 O ARG A 134 -3.379 8.721 0.512 1.00 52.45 O ATOM 2061 CB ARG A 134 -2.433 7.718 3.122 1.00 4.33 C ATOM 2062 CG ARG A 134 -0.977 7.673 2.685 1.00 43.14 C ATOM 2063 CD ARG A 134 -0.297 6.370 3.076 1.00 73.11 C ATOM 2064 NE ARG A 134 1.024 6.249 2.457 1.00 33.30 N ATOM 2065 CZ ARG A 134 2.183 6.357 3.107 1.00 71.42 C ATOM 2066 NH1 ARG A 134 2.210 6.570 4.419 1.00 34.13 N ATOM 2067 NH2 ARG A 134 3.317 6.256 2.429 1.00 52.32 N ATOM 0 HA ARG A 134 -2.561 9.819 3.475 1.00 73.50 H new ATOM 0 HB2 ARG A 134 -2.495 7.478 4.183 1.00 4.33 H new ATOM 0 HB3 ARG A 134 -2.991 6.949 2.588 1.00 4.33 H new ATOM 0 HG2 ARG A 134 -0.920 7.800 1.604 1.00 43.14 H new ATOM 0 HG3 ARG A 134 -0.440 8.509 3.132 1.00 43.14 H new ATOM 0 HD2 ARG A 134 -0.198 6.321 4.160 1.00 73.11 H new ATOM 0 HD3 ARG A 134 -0.920 5.528 2.774 1.00 73.11 H new ATOM 0 HE ARG A 134 1.060 6.069 1.454 1.00 33.30 H new ATOM 0 HH11 ARG A 134 1.337 6.653 4.940 1.00 34.13 H new ATOM 0 HH12 ARG A 134 3.104 6.651 4.904 1.00 34.13 H new ATOM 0 HH21 ARG A 134 3.297 6.097 1.422 1.00 52.32 H new ATOM 0 HH22 ARG A 134 4.210 6.337 2.914 1.00 52.32 H new ATOM 2081 N ASP A 135 -2.430 10.656 1.172 1.00 65.54 N ATOM 2082 CA ASP A 135 -2.259 11.199 -0.175 1.00 33.02 C ATOM 2083 C ASP A 135 -1.351 10.301 -1.005 1.00 13.33 C ATOM 2084 O ASP A 135 -1.596 10.070 -2.188 1.00 53.32 O ATOM 2085 CB ASP A 135 -1.687 12.627 -0.106 1.00 44.14 C ATOM 2086 CG ASP A 135 -0.332 12.710 0.585 1.00 40.01 C ATOM 2087 OD1 ASP A 135 -0.086 11.928 1.532 1.00 71.11 O ATOM 2088 OD2 ASP A 135 0.491 13.564 0.192 1.00 4.44 O ATOM 0 H ASP A 135 -2.089 11.271 1.911 1.00 65.54 H new ATOM 0 HA ASP A 135 -3.235 11.238 -0.658 1.00 33.02 H new ATOM 0 HB2 ASP A 135 -1.594 13.021 -1.118 1.00 44.14 H new ATOM 0 HB3 ASP A 135 -2.394 13.267 0.422 1.00 44.14 H new ATOM 2093 N ASP A 136 -0.314 9.785 -0.369 1.00 61.22 N ATOM 2094 CA ASP A 136 0.611 8.861 -1.017 1.00 20.21 C ATOM 2095 C ASP A 136 -0.107 7.594 -1.480 1.00 74.31 C ATOM 2096 O ASP A 136 0.203 7.043 -2.538 1.00 52.22 O ATOM 2097 CB ASP A 136 1.743 8.500 -0.052 1.00 14.40 C ATOM 2098 CG ASP A 136 2.671 7.440 -0.608 1.00 52.41 C ATOM 2099 OD1 ASP A 136 3.506 7.771 -1.475 1.00 2.02 O ATOM 2100 OD2 ASP A 136 2.579 6.276 -0.163 1.00 15.11 O ATOM 0 H ASP A 136 -0.087 9.990 0.604 1.00 61.22 H new ATOM 0 HA ASP A 136 1.026 9.353 -1.896 1.00 20.21 H new ATOM 0 HB2 ASP A 136 2.319 9.397 0.177 1.00 14.40 H new ATOM 0 HB3 ASP A 136 1.316 8.147 0.886 1.00 14.40 H new ATOM 2105 N LEU A 137 -1.097 7.159 -0.706 1.00 3.21 N ATOM 2106 CA LEU A 137 -1.791 5.914 -0.996 1.00 74.15 C ATOM 2107 C LEU A 137 -2.804 6.135 -2.103 1.00 53.23 C ATOM 2108 O LEU A 137 -3.025 5.275 -2.952 1.00 42.13 O ATOM 2109 CB LEU A 137 -2.482 5.377 0.265 1.00 44.14 C ATOM 2110 CG LEU A 137 -2.770 3.873 0.272 1.00 23.20 C ATOM 2111 CD1 LEU A 137 -1.479 3.090 0.423 1.00 50.32 C ATOM 2112 CD2 LEU A 137 -3.731 3.519 1.392 1.00 75.34 C ATOM 0 H LEU A 137 -1.434 7.649 0.123 1.00 3.21 H new ATOM 0 HA LEU A 137 -1.063 5.173 -1.327 1.00 74.15 H new ATOM 0 HB2 LEU A 137 -1.859 5.613 1.128 1.00 44.14 H new ATOM 0 HB3 LEU A 137 -3.424 5.910 0.396 1.00 44.14 H new ATOM 0 HG LEU A 137 -3.233 3.607 -0.678 1.00 23.20 H new ATOM 0 HD11 LEU A 137 -1.699 2.022 0.426 1.00 50.32 H new ATOM 0 HD12 LEU A 137 -0.814 3.321 -0.409 1.00 50.32 H new ATOM 0 HD13 LEU A 137 -0.995 3.364 1.361 1.00 50.32 H new ATOM 0 HD21 LEU A 137 -3.924 2.446 1.381 1.00 75.34 H new ATOM 0 HD22 LEU A 137 -3.292 3.799 2.350 1.00 75.34 H new ATOM 0 HD23 LEU A 137 -4.668 4.057 1.251 1.00 75.34 H new ATOM 2124 N MET A 138 -3.409 7.303 -2.093 1.00 71.22 N ATOM 2125 CA MET A 138 -4.316 7.703 -3.150 1.00 70.21 C ATOM 2126 C MET A 138 -3.556 7.872 -4.469 1.00 54.44 C ATOM 2127 O MET A 138 -4.061 7.532 -5.540 1.00 31.13 O ATOM 2128 CB MET A 138 -4.996 9.011 -2.753 1.00 63.43 C ATOM 2129 CG MET A 138 -5.704 9.717 -3.893 1.00 13.10 C ATOM 2130 SD MET A 138 -5.601 11.504 -3.726 1.00 42.02 S ATOM 2131 CE MET A 138 -3.820 11.671 -3.582 1.00 0.40 C ATOM 0 H MET A 138 -3.288 7.999 -1.357 1.00 71.22 H new ATOM 0 HA MET A 138 -5.072 6.931 -3.293 1.00 70.21 H new ATOM 0 HB2 MET A 138 -5.719 8.806 -1.963 1.00 63.43 H new ATOM 0 HB3 MET A 138 -4.248 9.683 -2.334 1.00 63.43 H new ATOM 0 HG2 MET A 138 -5.261 9.413 -4.842 1.00 13.10 H new ATOM 0 HG3 MET A 138 -6.750 9.412 -3.917 1.00 13.10 H new ATOM 0 HE1 MET A 138 -3.481 12.501 -4.202 1.00 0.40 H new ATOM 0 HE2 MET A 138 -3.555 11.863 -2.542 1.00 0.40 H new ATOM 0 HE3 MET A 138 -3.340 10.751 -3.915 1.00 0.40 H new ATOM 2141 N ARG A 139 -2.330 8.384 -4.378 1.00 62.01 N ATOM 2142 CA ARG A 139 -1.516 8.655 -5.559 1.00 45.11 C ATOM 2143 C ARG A 139 -1.048 7.373 -6.243 1.00 75.54 C ATOM 2144 O ARG A 139 -1.216 7.224 -7.452 1.00 11.30 O ATOM 2145 CB ARG A 139 -0.301 9.520 -5.207 1.00 30.30 C ATOM 2146 CG ARG A 139 0.726 9.592 -6.329 1.00 53.52 C ATOM 2147 CD ARG A 139 1.899 10.485 -5.975 1.00 74.43 C ATOM 2148 NE ARG A 139 1.588 11.904 -6.145 1.00 0.05 N ATOM 2149 CZ ARG A 139 2.022 12.859 -5.327 1.00 43.43 C ATOM 2150 NH1 ARG A 139 2.655 12.530 -4.208 1.00 43.53 N ATOM 2151 NH2 ARG A 139 1.808 14.137 -5.619 1.00 2.14 N ATOM 0 H ARG A 139 -1.878 8.620 -3.495 1.00 62.01 H new ATOM 0 HA ARG A 139 -2.155 9.198 -6.255 1.00 45.11 H new ATOM 0 HB2 ARG A 139 -0.638 10.528 -4.966 1.00 30.30 H new ATOM 0 HB3 ARG A 139 0.175 9.120 -4.312 1.00 30.30 H new ATOM 0 HG2 ARG A 139 1.089 8.589 -6.552 1.00 53.52 H new ATOM 0 HG3 ARG A 139 0.247 9.966 -7.234 1.00 53.52 H new ATOM 0 HD2 ARG A 139 2.194 10.301 -4.942 1.00 74.43 H new ATOM 0 HD3 ARG A 139 2.753 10.225 -6.601 1.00 74.43 H new ATOM 0 HE ARG A 139 1.005 12.177 -6.936 1.00 0.05 H new ATOM 0 HH11 ARG A 139 2.807 11.548 -3.978 1.00 43.53 H new ATOM 0 HH12 ARG A 139 2.989 13.259 -3.578 1.00 43.53 H new ATOM 0 HH21 ARG A 139 1.310 14.389 -6.473 1.00 2.14 H new ATOM 0 HH22 ARG A 139 2.142 14.867 -4.990 1.00 2.14 H new ATOM 2165 N PHE A 140 -0.458 6.452 -5.487 1.00 4.44 N ATOM 2166 CA PHE A 140 0.103 5.249 -6.096 1.00 60.23 C ATOM 2167 C PHE A 140 -1.022 4.395 -6.680 1.00 44.22 C ATOM 2168 O PHE A 140 -0.827 3.692 -7.673 1.00 41.12 O ATOM 2169 CB PHE A 140 0.980 4.465 -5.097 1.00 70.22 C ATOM 2170 CG PHE A 140 0.308 3.326 -4.380 1.00 12.45 C ATOM 2171 CD1 PHE A 140 -0.698 3.545 -3.458 1.00 54.22 C ATOM 2172 CD2 PHE A 140 0.705 2.022 -4.631 1.00 3.14 C ATOM 2173 CE1 PHE A 140 -1.297 2.486 -2.804 1.00 33.35 C ATOM 2174 CE2 PHE A 140 0.109 0.961 -3.979 1.00 30.44 C ATOM 2175 CZ PHE A 140 -0.892 1.193 -3.064 1.00 71.20 C ATOM 0 H PHE A 140 -0.356 6.511 -4.474 1.00 4.44 H new ATOM 0 HA PHE A 140 0.764 5.540 -6.913 1.00 60.23 H new ATOM 0 HB2 PHE A 140 1.843 4.071 -5.634 1.00 70.22 H new ATOM 0 HB3 PHE A 140 1.360 5.164 -4.351 1.00 70.22 H new ATOM 0 HD1 PHE A 140 -1.019 4.554 -3.247 1.00 54.22 H new ATOM 0 HD2 PHE A 140 1.492 1.833 -5.347 1.00 3.14 H new ATOM 0 HE1 PHE A 140 -2.084 2.671 -2.088 1.00 33.35 H new ATOM 0 HE2 PHE A 140 0.428 -0.050 -4.187 1.00 30.44 H new ATOM 0 HZ PHE A 140 -1.359 0.365 -2.551 1.00 71.20 H new ATOM 2185 N LYS A 141 -2.205 4.491 -6.064 1.00 54.14 N ATOM 2186 CA LYS A 141 -3.412 3.846 -6.571 1.00 54.32 C ATOM 2187 C LYS A 141 -3.704 4.306 -7.998 1.00 53.22 C ATOM 2188 O LYS A 141 -4.058 3.501 -8.856 1.00 62.12 O ATOM 2189 CB LYS A 141 -4.597 4.162 -5.644 1.00 24.41 C ATOM 2190 CG LYS A 141 -5.910 3.497 -6.039 1.00 3.10 C ATOM 2191 CD LYS A 141 -6.735 4.361 -6.982 1.00 42.42 C ATOM 2192 CE LYS A 141 -8.093 3.737 -7.239 1.00 23.34 C ATOM 2193 NZ LYS A 141 -8.913 4.519 -8.201 1.00 52.51 N ATOM 0 H LYS A 141 -2.348 5.018 -5.202 1.00 54.14 H new ATOM 0 HA LYS A 141 -3.259 2.767 -6.589 1.00 54.32 H new ATOM 0 HB2 LYS A 141 -4.340 3.854 -4.631 1.00 24.41 H new ATOM 0 HB3 LYS A 141 -4.745 5.242 -5.621 1.00 24.41 H new ATOM 0 HG2 LYS A 141 -5.701 2.540 -6.517 1.00 3.10 H new ATOM 0 HG3 LYS A 141 -6.492 3.285 -5.142 1.00 3.10 H new ATOM 0 HD2 LYS A 141 -6.862 5.355 -6.553 1.00 42.42 H new ATOM 0 HD3 LYS A 141 -6.204 4.486 -7.925 1.00 42.42 H new ATOM 0 HE2 LYS A 141 -7.957 2.726 -7.623 1.00 23.34 H new ATOM 0 HE3 LYS A 141 -8.632 3.650 -6.296 1.00 23.34 H new ATOM 0 HZ1 LYS A 141 -9.836 4.057 -8.326 1.00 52.51 H new ATOM 0 HZ2 LYS A 141 -9.055 5.482 -7.834 1.00 52.51 H new ATOM 0 HZ3 LYS A 141 -8.422 4.567 -9.117 1.00 52.51 H new ATOM 2207 N ARG A 142 -3.544 5.606 -8.238 1.00 72.45 N ATOM 2208 CA ARG A 142 -3.723 6.178 -9.572 1.00 32.33 C ATOM 2209 C ARG A 142 -2.833 5.462 -10.576 1.00 72.11 C ATOM 2210 O ARG A 142 -3.295 4.976 -11.605 1.00 15.33 O ATOM 2211 CB ARG A 142 -3.352 7.665 -9.584 1.00 30.30 C ATOM 2212 CG ARG A 142 -4.189 8.546 -8.677 1.00 2.11 C ATOM 2213 CD ARG A 142 -5.592 8.747 -9.217 1.00 33.15 C ATOM 2214 NE ARG A 142 -6.196 9.970 -8.689 1.00 73.42 N ATOM 2215 CZ ARG A 142 -7.506 10.187 -8.613 1.00 34.24 C ATOM 2216 NH1 ARG A 142 -8.363 9.240 -8.974 1.00 14.43 N ATOM 2217 NH2 ARG A 142 -7.955 11.349 -8.162 1.00 25.44 N ATOM 0 H ARG A 142 -3.289 6.287 -7.522 1.00 72.45 H new ATOM 0 HA ARG A 142 -4.772 6.058 -9.842 1.00 32.33 H new ATOM 0 HB2 ARG A 142 -2.306 7.764 -9.296 1.00 30.30 H new ATOM 0 HB3 ARG A 142 -3.438 8.036 -10.605 1.00 30.30 H new ATOM 0 HG2 ARG A 142 -4.243 8.097 -7.685 1.00 2.11 H new ATOM 0 HG3 ARG A 142 -3.702 9.515 -8.563 1.00 2.11 H new ATOM 0 HD2 ARG A 142 -5.561 8.795 -10.306 1.00 33.15 H new ATOM 0 HD3 ARG A 142 -6.212 7.890 -8.953 1.00 33.15 H new ATOM 0 HE ARG A 142 -5.571 10.705 -8.357 1.00 73.42 H new ATOM 0 HH11 ARG A 142 -8.018 8.341 -9.311 1.00 14.43 H new ATOM 0 HH12 ARG A 142 -9.367 9.411 -8.914 1.00 14.43 H new ATOM 0 HH21 ARG A 142 -7.297 12.073 -7.875 1.00 25.44 H new ATOM 0 HH22 ARG A 142 -8.959 11.519 -8.102 1.00 25.44 H new ATOM 2231 N GLU A 143 -1.556 5.385 -10.237 1.00 53.02 N ATOM 2232 CA GLU A 143 -0.534 4.885 -11.144 1.00 35.24 C ATOM 2233 C GLU A 143 -0.717 3.401 -11.446 1.00 10.54 C ATOM 2234 O GLU A 143 -0.560 2.972 -12.589 1.00 43.02 O ATOM 2235 CB GLU A 143 0.848 5.122 -10.534 1.00 61.43 C ATOM 2236 CG GLU A 143 1.069 6.552 -10.066 1.00 21.24 C ATOM 2237 CD GLU A 143 1.081 7.551 -11.204 1.00 30.54 C ATOM 2238 OE1 GLU A 143 0.053 7.697 -11.893 1.00 52.30 O ATOM 2239 OE2 GLU A 143 2.122 8.214 -11.402 1.00 32.41 O ATOM 0 H GLU A 143 -1.198 5.668 -9.325 1.00 53.02 H new ATOM 0 HA GLU A 143 -0.627 5.427 -12.085 1.00 35.24 H new ATOM 0 HB2 GLU A 143 0.984 4.447 -9.689 1.00 61.43 H new ATOM 0 HB3 GLU A 143 1.610 4.868 -11.271 1.00 61.43 H new ATOM 0 HG2 GLU A 143 0.284 6.823 -9.360 1.00 21.24 H new ATOM 0 HG3 GLU A 143 2.015 6.610 -9.528 1.00 21.24 H new ATOM 2246 N GLN A 144 -1.061 2.622 -10.431 1.00 44.22 N ATOM 2247 CA GLN A 144 -1.115 1.173 -10.580 1.00 61.11 C ATOM 2248 C GLN A 144 -2.330 0.711 -11.382 1.00 44.31 C ATOM 2249 O GLN A 144 -2.360 -0.421 -11.865 1.00 24.33 O ATOM 2250 CB GLN A 144 -1.080 0.489 -9.216 1.00 62.20 C ATOM 2251 CG GLN A 144 -2.167 0.940 -8.263 1.00 74.45 C ATOM 2252 CD GLN A 144 -1.978 0.393 -6.862 1.00 13.13 C ATOM 2253 OE1 GLN A 144 -2.367 1.022 -5.885 1.00 32.20 O ATOM 2254 NE2 GLN A 144 -1.385 -0.784 -6.751 1.00 33.14 N ATOM 0 H GLN A 144 -1.305 2.964 -9.502 1.00 44.22 H new ATOM 0 HA GLN A 144 -0.231 0.880 -11.146 1.00 61.11 H new ATOM 0 HB2 GLN A 144 -1.164 -0.588 -9.361 1.00 62.20 H new ATOM 0 HB3 GLN A 144 -0.110 0.674 -8.755 1.00 62.20 H new ATOM 0 HG2 GLN A 144 -2.182 2.029 -8.225 1.00 74.45 H new ATOM 0 HG3 GLN A 144 -3.136 0.621 -8.646 1.00 74.45 H new ATOM 0 HE21 GLN A 144 -1.074 -1.279 -7.587 1.00 33.14 H new ATOM 0 HE22 GLN A 144 -1.239 -1.196 -5.830 1.00 33.14 H new ATOM 2263 N GLU A 145 -3.330 1.566 -11.531 1.00 24.41 N ATOM 2264 CA GLU A 145 -4.476 1.231 -12.372 1.00 54.45 C ATOM 2265 C GLU A 145 -4.500 2.086 -13.632 1.00 13.15 C ATOM 2266 O GLU A 145 -5.350 1.892 -14.501 1.00 43.31 O ATOM 2267 CB GLU A 145 -5.802 1.373 -11.616 1.00 0.12 C ATOM 2268 CG GLU A 145 -6.130 2.791 -11.174 1.00 30.32 C ATOM 2269 CD GLU A 145 -7.568 2.930 -10.714 1.00 42.23 C ATOM 2270 OE1 GLU A 145 -8.179 1.912 -10.323 1.00 75.10 O ATOM 2271 OE2 GLU A 145 -8.099 4.063 -10.739 1.00 23.33 O ATOM 0 H GLU A 145 -3.375 2.484 -11.089 1.00 24.41 H new ATOM 0 HA GLU A 145 -4.362 0.185 -12.658 1.00 54.45 H new ATOM 0 HB2 GLU A 145 -6.609 1.009 -12.252 1.00 0.12 H new ATOM 0 HB3 GLU A 145 -5.775 0.729 -10.737 1.00 0.12 H new ATOM 0 HG2 GLU A 145 -5.462 3.081 -10.363 1.00 30.32 H new ATOM 0 HG3 GLU A 145 -5.946 3.479 -12.000 1.00 30.32 H new ATOM 2278 N LEU A 146 -3.570 3.030 -13.724 1.00 72.41 N ATOM 2279 CA LEU A 146 -3.499 3.930 -14.870 1.00 44.02 C ATOM 2280 C LEU A 146 -3.245 3.142 -16.152 1.00 71.52 C ATOM 2281 O LEU A 146 -3.972 3.279 -17.137 1.00 42.01 O ATOM 2282 CB LEU A 146 -2.391 4.969 -14.660 1.00 42.42 C ATOM 2283 CG LEU A 146 -2.398 6.139 -15.646 1.00 31.43 C ATOM 2284 CD1 LEU A 146 -3.697 6.923 -15.526 1.00 41.44 C ATOM 2285 CD2 LEU A 146 -1.197 7.043 -15.402 1.00 4.33 C ATOM 0 H LEU A 146 -2.853 3.192 -13.017 1.00 72.41 H new ATOM 0 HA LEU A 146 -4.454 4.448 -14.964 1.00 44.02 H new ATOM 0 HB2 LEU A 146 -2.475 5.367 -13.649 1.00 42.42 H new ATOM 0 HB3 LEU A 146 -1.426 4.466 -14.725 1.00 42.42 H new ATOM 0 HG LEU A 146 -2.329 5.744 -16.660 1.00 31.43 H new ATOM 0 HD11 LEU A 146 -3.688 7.752 -16.233 1.00 41.44 H new ATOM 0 HD12 LEU A 146 -4.539 6.267 -15.746 1.00 41.44 H new ATOM 0 HD13 LEU A 146 -3.795 7.312 -14.512 1.00 41.44 H new ATOM 0 HD21 LEU A 146 -1.215 7.871 -16.111 1.00 4.33 H new ATOM 0 HD22 LEU A 146 -1.237 7.434 -14.385 1.00 4.33 H new ATOM 0 HD23 LEU A 146 -0.278 6.471 -15.535 1.00 4.33 H new ATOM 2297 N GLY A 147 -2.208 2.324 -16.130 1.00 62.43 N ATOM 2298 CA GLY A 147 -1.921 1.457 -17.247 1.00 73.11 C ATOM 2299 C GLY A 147 -2.196 0.008 -16.917 1.00 35.05 C ATOM 2300 O GLY A 147 -1.610 -0.547 -15.989 1.00 14.41 O ATOM 0 H GLY A 147 -1.555 2.245 -15.351 1.00 62.43 H new ATOM 0 HA2 GLY A 147 -2.525 1.756 -18.104 1.00 73.11 H new ATOM 0 HA3 GLY A 147 -0.877 1.572 -17.538 1.00 73.11 H new