USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 857 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 1 GLY N :NH3+ -175:sc= 0 (180deg=-0.0209) USER MOD Single : A 2 SER OG : rot 180:sc= -0.116 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -40:sc= -1.52 USER MOD Single : A 31 TYR OH : rot -32:sc= -0.925 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot -140:sc= -2.2 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0225 X(o=-0.022,f=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -4.29! K(o=-4.3!,f=-0.14) USER MOD Single : A 74 GLN : amide:sc= -0.0309 X(o=-0.031,f=0) USER MOD Single : A 78 SER OG : rot 160:sc= -2.12! USER MOD Single : A 79 LYS NZ :NH3+ 165:sc= -0.454 (180deg=-0.493) USER MOD Single : A 82 ASN : amide:sc= -0.308 X(o=-0.31,f=-0.0081) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -148:sc= 0 (180deg=-1.24) USER MOD Single : A 99 SER OG : rot -26:sc= 0.122 USER MOD Single : A 100 ASN : amide:sc= -0.0236 K(o=-0.024,f=-1.1) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0967 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -48:sc= 0.82 USER MOD Single : A 109 ASN : amide:sc=-0.00133 X(o=-0.0013,f=-0.0013) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.574 4.725 9.016 1.00 34.52 N ATOM 2 CA GLY A 1 19.695 3.640 9.414 1.00 24.13 C ATOM 3 C GLY A 1 18.621 3.356 8.384 1.00 54.22 C ATOM 4 O GLY A 1 18.328 2.199 8.085 1.00 61.45 O ATOM 0 H1 GLY A 1 21.340 4.824 9.712 1.00 34.52 H new ATOM 0 H2 GLY A 1 20.980 4.518 8.081 1.00 34.52 H new ATOM 0 H3 GLY A 1 20.032 5.611 8.969 1.00 34.52 H new ATOM 0 HA2 GLY A 1 20.286 2.739 9.576 1.00 24.13 H new ATOM 0 HA3 GLY A 1 19.225 3.888 10.366 1.00 24.13 H new ATOM 8 N SER A 2 18.029 4.416 7.840 1.00 24.45 N ATOM 9 CA SER A 2 16.977 4.275 6.841 1.00 34.24 C ATOM 10 C SER A 2 17.566 4.225 5.435 1.00 75.21 C ATOM 11 O SER A 2 18.772 4.384 5.249 1.00 33.24 O ATOM 12 CB SER A 2 15.983 5.433 6.950 1.00 43.32 C ATOM 13 OG SER A 2 14.842 5.204 6.142 1.00 61.04 O ATOM 0 H SER A 2 18.261 5.381 8.075 1.00 24.45 H new ATOM 0 HA SER A 2 16.454 3.338 7.030 1.00 34.24 H new ATOM 0 HB2 SER A 2 15.678 5.557 7.989 1.00 43.32 H new ATOM 0 HB3 SER A 2 16.467 6.361 6.647 1.00 43.32 H new ATOM 0 HG SER A 2 14.222 5.957 6.231 1.00 61.04 H new ATOM 19 N MET A 3 16.704 4.003 4.447 1.00 25.43 N ATOM 20 CA MET A 3 17.138 3.933 3.057 1.00 65.42 C ATOM 21 C MET A 3 17.075 5.307 2.398 1.00 61.23 C ATOM 22 O MET A 3 16.035 5.965 2.413 1.00 43.52 O ATOM 23 CB MET A 3 16.272 2.941 2.279 1.00 73.51 C ATOM 24 CG MET A 3 16.459 1.497 2.716 1.00 21.23 C ATOM 25 SD MET A 3 15.384 1.042 4.090 1.00 15.11 S ATOM 26 CE MET A 3 15.363 -0.742 3.928 1.00 3.43 C ATOM 0 H MET A 3 15.702 3.869 4.584 1.00 25.43 H new ATOM 0 HA MET A 3 18.172 3.590 3.042 1.00 65.42 H new ATOM 0 HB2 MET A 3 15.224 3.215 2.398 1.00 73.51 H new ATOM 0 HB3 MET A 3 16.504 3.024 1.217 1.00 73.51 H new ATOM 0 HG2 MET A 3 16.261 0.837 1.871 1.00 21.23 H new ATOM 0 HG3 MET A 3 17.498 1.341 3.006 1.00 21.23 H new ATOM 0 HE1 MET A 3 14.737 -1.171 4.710 1.00 3.43 H new ATOM 0 HE2 MET A 3 14.961 -1.014 2.952 1.00 3.43 H new ATOM 0 HE3 MET A 3 16.378 -1.128 4.023 1.00 3.43 H new ATOM 36 N SER A 4 18.194 5.733 1.820 1.00 13.41 N ATOM 37 CA SER A 4 18.266 7.031 1.159 1.00 12.33 C ATOM 38 C SER A 4 17.755 6.939 -0.276 1.00 3.45 C ATOM 39 O SER A 4 17.061 7.833 -0.758 1.00 1.42 O ATOM 40 CB SER A 4 19.704 7.553 1.168 1.00 20.35 C ATOM 41 OG SER A 4 19.985 8.254 2.367 1.00 34.05 O ATOM 0 H SER A 4 19.062 5.199 1.796 1.00 13.41 H new ATOM 0 HA SER A 4 17.631 7.726 1.708 1.00 12.33 H new ATOM 0 HB2 SER A 4 20.397 6.719 1.060 1.00 20.35 H new ATOM 0 HB3 SER A 4 19.861 8.211 0.313 1.00 20.35 H new ATOM 0 HG SER A 4 20.910 8.576 2.349 1.00 34.05 H new ATOM 47 N GLY A 5 18.105 5.850 -0.953 1.00 42.21 N ATOM 48 CA GLY A 5 17.675 5.660 -2.326 1.00 13.31 C ATOM 49 C GLY A 5 18.803 5.203 -3.229 1.00 53.03 C ATOM 50 O GLY A 5 18.625 4.298 -4.044 1.00 24.12 O ATOM 0 H GLY A 5 18.679 5.096 -0.575 1.00 42.21 H new ATOM 0 HA2 GLY A 5 16.871 4.924 -2.353 1.00 13.31 H new ATOM 0 HA3 GLY A 5 17.264 6.595 -2.708 1.00 13.31 H new ATOM 54 N GLU A 6 19.965 5.832 -3.086 1.00 64.42 N ATOM 55 CA GLU A 6 21.126 5.485 -3.899 1.00 35.33 C ATOM 56 C GLU A 6 20.792 5.564 -5.386 1.00 34.54 C ATOM 57 O GLU A 6 20.696 4.552 -6.081 1.00 32.24 O ATOM 58 CB GLU A 6 21.619 4.079 -3.549 1.00 53.13 C ATOM 59 CG GLU A 6 22.632 4.053 -2.417 1.00 51.43 C ATOM 60 CD GLU A 6 23.467 2.788 -2.411 1.00 22.24 C ATOM 61 OE1 GLU A 6 22.879 1.690 -2.315 1.00 41.12 O ATOM 62 OE2 GLU A 6 24.708 2.895 -2.500 1.00 60.33 O ATOM 0 H GLU A 6 20.128 6.584 -2.416 1.00 64.42 H new ATOM 0 HA GLU A 6 21.917 6.204 -3.684 1.00 35.33 H new ATOM 0 HB2 GLU A 6 20.764 3.461 -3.274 1.00 53.13 H new ATOM 0 HB3 GLU A 6 22.066 3.629 -4.435 1.00 53.13 H new ATOM 0 HG2 GLU A 6 23.290 4.918 -2.503 1.00 51.43 H new ATOM 0 HG3 GLU A 6 22.110 4.144 -1.465 1.00 51.43 H new ATOM 69 N PRO A 7 20.609 6.794 -5.886 1.00 43.52 N ATOM 70 CA PRO A 7 20.283 7.036 -7.295 1.00 23.11 C ATOM 71 C PRO A 7 21.453 6.726 -8.222 1.00 64.31 C ATOM 72 O PRO A 7 22.553 6.415 -7.767 1.00 4.51 O ATOM 73 CB PRO A 7 19.953 8.530 -7.332 1.00 5.25 C ATOM 74 CG PRO A 7 20.695 9.110 -6.177 1.00 45.33 C ATOM 75 CD PRO A 7 20.708 8.045 -5.116 1.00 1.53 C ATOM 0 HA PRO A 7 19.470 6.398 -7.640 1.00 23.11 H new ATOM 0 HB2 PRO A 7 20.268 8.982 -8.272 1.00 5.25 H new ATOM 0 HB3 PRO A 7 18.880 8.701 -7.240 1.00 5.25 H new ATOM 0 HG2 PRO A 7 21.709 9.387 -6.464 1.00 45.33 H new ATOM 0 HG3 PRO A 7 20.208 10.015 -5.815 1.00 45.33 H new ATOM 0 HD2 PRO A 7 21.622 8.080 -4.523 1.00 1.53 H new ATOM 0 HD3 PRO A 7 19.874 8.158 -4.424 1.00 1.53 H new ATOM 83 N GLY A 8 21.209 6.812 -9.526 1.00 55.22 N ATOM 84 CA GLY A 8 22.252 6.538 -10.497 1.00 0.13 C ATOM 85 C GLY A 8 23.325 7.608 -10.512 1.00 4.31 C ATOM 86 O GLY A 8 23.208 8.623 -9.826 1.00 12.13 O ATOM 0 H GLY A 8 20.307 7.067 -9.928 1.00 55.22 H new ATOM 0 HA2 GLY A 8 22.708 5.574 -10.273 1.00 0.13 H new ATOM 0 HA3 GLY A 8 21.808 6.459 -11.490 1.00 0.13 H new ATOM 90 N GLN A 9 24.375 7.381 -11.295 1.00 31.50 N ATOM 91 CA GLN A 9 25.474 8.333 -11.394 1.00 25.00 C ATOM 92 C GLN A 9 25.769 8.675 -12.851 1.00 13.22 C ATOM 93 O GLN A 9 26.329 7.865 -13.590 1.00 25.04 O ATOM 94 CB GLN A 9 26.729 7.767 -10.727 1.00 63.43 C ATOM 95 CG GLN A 9 27.010 6.318 -11.092 1.00 25.34 C ATOM 96 CD GLN A 9 28.268 5.784 -10.434 1.00 12.01 C ATOM 97 OE1 GLN A 9 29.189 6.540 -10.123 1.00 54.22 O ATOM 98 NE2 GLN A 9 28.313 4.475 -10.218 1.00 31.34 N ATOM 0 H GLN A 9 24.487 6.546 -11.870 1.00 31.50 H new ATOM 0 HA GLN A 9 25.177 9.246 -10.878 1.00 25.00 H new ATOM 0 HB2 GLN A 9 27.587 8.377 -11.009 1.00 63.43 H new ATOM 0 HB3 GLN A 9 26.623 7.847 -9.645 1.00 63.43 H new ATOM 0 HG2 GLN A 9 26.161 5.702 -10.797 1.00 25.34 H new ATOM 0 HG3 GLN A 9 27.106 6.232 -12.174 1.00 25.34 H new ATOM 0 HE21 GLN A 9 27.527 3.886 -10.492 1.00 31.34 H new ATOM 0 HE22 GLN A 9 29.134 4.059 -9.778 1.00 31.34 H new ATOM 107 N THR A 10 25.386 9.881 -13.259 1.00 43.32 N ATOM 108 CA THR A 10 25.608 10.330 -14.628 1.00 14.41 C ATOM 109 C THR A 10 26.965 11.010 -14.771 1.00 74.21 C ATOM 110 O THR A 10 27.536 11.489 -13.792 1.00 13.52 O ATOM 111 CB THR A 10 24.507 11.307 -15.084 1.00 33.33 C ATOM 112 OG1 THR A 10 24.450 12.430 -14.197 1.00 62.31 O ATOM 113 CG2 THR A 10 23.152 10.615 -15.122 1.00 2.44 C ATOM 0 H THR A 10 24.921 10.564 -12.661 1.00 43.32 H new ATOM 0 HA THR A 10 25.581 9.442 -15.260 1.00 14.41 H new ATOM 0 HB THR A 10 24.750 11.651 -16.089 1.00 33.33 H new ATOM 0 HG1 THR A 10 23.749 13.047 -14.495 1.00 62.31 H new ATOM 0 HG21 THR A 10 22.390 11.324 -15.447 1.00 2.44 H new ATOM 0 HG22 THR A 10 23.190 9.779 -15.820 1.00 2.44 H new ATOM 0 HG23 THR A 10 22.904 10.246 -14.127 1.00 2.44 H new ATOM 121 N SER A 11 27.476 11.048 -15.998 1.00 13.05 N ATOM 122 CA SER A 11 28.768 11.667 -16.268 1.00 62.31 C ATOM 123 C SER A 11 28.722 13.166 -15.988 1.00 23.32 C ATOM 124 O SER A 11 27.685 13.705 -15.601 1.00 44.34 O ATOM 125 CB SER A 11 29.181 11.420 -17.720 1.00 42.35 C ATOM 126 OG SER A 11 29.368 10.038 -17.970 1.00 23.00 O ATOM 0 H SER A 11 27.015 10.658 -16.820 1.00 13.05 H new ATOM 0 HA SER A 11 29.506 11.214 -15.605 1.00 62.31 H new ATOM 0 HB2 SER A 11 28.417 11.814 -18.390 1.00 42.35 H new ATOM 0 HB3 SER A 11 30.103 11.960 -17.936 1.00 42.35 H new ATOM 0 HG SER A 11 29.630 9.907 -18.905 1.00 23.00 H new ATOM 132 N VAL A 12 29.855 13.833 -16.185 1.00 53.25 N ATOM 133 CA VAL A 12 29.945 15.270 -15.956 1.00 2.15 C ATOM 134 C VAL A 12 30.164 16.023 -17.263 1.00 1.21 C ATOM 135 O VAL A 12 30.592 15.444 -18.261 1.00 33.43 O ATOM 136 CB VAL A 12 31.088 15.612 -14.981 1.00 63.24 C ATOM 137 CG1 VAL A 12 30.883 14.907 -13.649 1.00 11.51 C ATOM 138 CG2 VAL A 12 32.433 15.241 -15.588 1.00 2.20 C ATOM 0 H VAL A 12 30.723 13.401 -16.503 1.00 53.25 H new ATOM 0 HA VAL A 12 28.997 15.580 -15.517 1.00 2.15 H new ATOM 0 HB VAL A 12 31.079 16.687 -14.801 1.00 63.24 H new ATOM 0 HG11 VAL A 12 31.700 15.161 -12.974 1.00 11.51 H new ATOM 0 HG12 VAL A 12 29.937 15.226 -13.210 1.00 11.51 H new ATOM 0 HG13 VAL A 12 30.864 13.829 -13.807 1.00 11.51 H new ATOM 0 HG21 VAL A 12 33.230 15.489 -14.887 1.00 2.20 H new ATOM 0 HG22 VAL A 12 32.455 14.172 -15.798 1.00 2.20 H new ATOM 0 HG23 VAL A 12 32.580 15.796 -16.515 1.00 2.20 H new ATOM 148 N ALA A 13 29.868 17.319 -17.250 1.00 24.23 N ATOM 149 CA ALA A 13 30.035 18.152 -18.434 1.00 3.53 C ATOM 150 C ALA A 13 30.551 19.538 -18.061 1.00 10.30 C ATOM 151 O ALA A 13 30.446 19.979 -16.916 1.00 65.21 O ATOM 152 CB ALA A 13 28.720 18.263 -19.191 1.00 65.43 C ATOM 0 H ALA A 13 29.511 17.814 -16.433 1.00 24.23 H new ATOM 0 HA ALA A 13 30.775 17.679 -19.080 1.00 3.53 H new ATOM 0 HB1 ALA A 13 28.860 18.888 -20.073 1.00 65.43 H new ATOM 0 HB2 ALA A 13 28.392 17.270 -19.498 1.00 65.43 H new ATOM 0 HB3 ALA A 13 27.965 18.711 -18.545 1.00 65.43 H new ATOM 158 N PRO A 14 31.122 20.243 -19.049 1.00 1.52 N ATOM 159 CA PRO A 14 31.666 21.590 -18.848 1.00 54.02 C ATOM 160 C PRO A 14 30.573 22.626 -18.607 1.00 42.35 C ATOM 161 O PRO A 14 29.386 22.371 -18.810 1.00 60.42 O ATOM 162 CB PRO A 14 32.395 21.878 -20.163 1.00 21.42 C ATOM 163 CG PRO A 14 31.710 21.021 -21.171 1.00 42.12 C ATOM 164 CD PRO A 14 31.281 19.781 -20.438 1.00 34.23 C ATOM 0 HA PRO A 14 32.308 21.644 -17.969 1.00 54.02 H new ATOM 0 HB2 PRO A 14 32.329 22.933 -20.430 1.00 21.42 H new ATOM 0 HB3 PRO A 14 33.455 21.634 -20.090 1.00 21.42 H new ATOM 0 HG2 PRO A 14 30.851 21.536 -21.602 1.00 42.12 H new ATOM 0 HG3 PRO A 14 32.381 20.775 -21.994 1.00 42.12 H new ATOM 0 HD2 PRO A 14 30.349 19.380 -20.837 1.00 34.23 H new ATOM 0 HD3 PRO A 14 32.027 18.990 -20.515 1.00 34.23 H new ATOM 172 N PRO A 15 30.981 23.825 -18.165 1.00 53.11 N ATOM 173 CA PRO A 15 30.051 24.925 -17.888 1.00 64.53 C ATOM 174 C PRO A 15 29.433 25.495 -19.160 1.00 71.11 C ATOM 175 O PRO A 15 30.108 26.110 -19.986 1.00 1.25 O ATOM 176 CB PRO A 15 30.935 25.973 -17.207 1.00 33.53 C ATOM 177 CG PRO A 15 32.311 25.689 -17.703 1.00 35.23 C ATOM 178 CD PRO A 15 32.380 24.200 -17.902 1.00 21.15 C ATOM 0 HA PRO A 15 29.205 24.601 -17.281 1.00 64.53 H new ATOM 0 HB2 PRO A 15 30.622 26.984 -17.467 1.00 33.53 H new ATOM 0 HB3 PRO A 15 30.881 25.891 -16.121 1.00 33.53 H new ATOM 0 HG2 PRO A 15 32.506 26.217 -18.636 1.00 35.23 H new ATOM 0 HG3 PRO A 15 33.061 26.022 -16.986 1.00 35.23 H new ATOM 0 HD2 PRO A 15 33.030 23.936 -18.736 1.00 21.15 H new ATOM 0 HD3 PRO A 15 32.772 23.695 -17.020 1.00 21.15 H new ATOM 186 N PRO A 16 28.118 25.288 -19.324 1.00 71.40 N ATOM 187 CA PRO A 16 27.379 25.774 -20.493 1.00 45.50 C ATOM 188 C PRO A 16 27.241 27.293 -20.500 1.00 34.02 C ATOM 189 O PRO A 16 27.874 27.986 -19.705 1.00 3.31 O ATOM 190 CB PRO A 16 26.007 25.113 -20.347 1.00 21.44 C ATOM 191 CG PRO A 16 25.865 24.855 -18.886 1.00 71.53 C ATOM 192 CD PRO A 16 27.251 24.563 -18.380 1.00 75.55 C ATOM 0 HA PRO A 16 27.887 25.530 -21.426 1.00 45.50 H new ATOM 0 HB2 PRO A 16 25.213 25.764 -20.713 1.00 21.44 H new ATOM 0 HB3 PRO A 16 25.950 24.187 -20.920 1.00 21.44 H new ATOM 0 HG2 PRO A 16 25.438 25.719 -18.377 1.00 71.53 H new ATOM 0 HG3 PRO A 16 25.197 24.014 -18.701 1.00 71.53 H new ATOM 0 HD2 PRO A 16 27.388 24.915 -17.357 1.00 75.55 H new ATOM 0 HD3 PRO A 16 27.462 23.494 -18.380 1.00 75.55 H new ATOM 200 N GLU A 17 26.407 27.803 -21.402 1.00 23.53 N ATOM 201 CA GLU A 17 26.187 29.240 -21.511 1.00 34.23 C ATOM 202 C GLU A 17 25.837 29.841 -20.152 1.00 43.14 C ATOM 203 O GLU A 17 25.564 29.119 -19.195 1.00 35.43 O ATOM 204 CB GLU A 17 25.068 29.532 -22.513 1.00 32.21 C ATOM 205 CG GLU A 17 25.455 30.542 -23.580 1.00 13.23 C ATOM 206 CD GLU A 17 26.743 30.176 -24.290 1.00 64.11 C ATOM 207 OE1 GLU A 17 26.838 29.040 -24.800 1.00 25.14 O ATOM 208 OE2 GLU A 17 27.657 31.026 -24.337 1.00 12.44 O ATOM 0 H GLU A 17 25.874 27.243 -22.067 1.00 23.53 H new ATOM 0 HA GLU A 17 27.111 29.698 -21.865 1.00 34.23 H new ATOM 0 HB2 GLU A 17 24.772 28.601 -22.996 1.00 32.21 H new ATOM 0 HB3 GLU A 17 24.196 29.902 -21.974 1.00 32.21 H new ATOM 0 HG2 GLU A 17 24.650 30.618 -24.311 1.00 13.23 H new ATOM 0 HG3 GLU A 17 25.564 31.525 -23.122 1.00 13.23 H new ATOM 215 N GLU A 18 25.850 31.168 -20.078 1.00 40.44 N ATOM 216 CA GLU A 18 25.536 31.867 -18.837 1.00 61.34 C ATOM 217 C GLU A 18 24.184 32.568 -18.934 1.00 61.55 C ATOM 218 O GLU A 18 24.108 33.752 -19.262 1.00 60.35 O ATOM 219 CB GLU A 18 26.629 32.886 -18.509 1.00 50.24 C ATOM 220 CG GLU A 18 27.055 33.726 -19.701 1.00 42.45 C ATOM 221 CD GLU A 18 28.155 34.712 -19.357 1.00 52.22 C ATOM 222 OE1 GLU A 18 29.156 34.291 -18.741 1.00 45.33 O ATOM 223 OE2 GLU A 18 28.014 35.904 -19.703 1.00 32.31 O ATOM 0 H GLU A 18 26.074 31.780 -20.862 1.00 40.44 H new ATOM 0 HA GLU A 18 25.486 31.128 -18.037 1.00 61.34 H new ATOM 0 HB2 GLU A 18 26.273 33.546 -17.718 1.00 50.24 H new ATOM 0 HB3 GLU A 18 27.499 32.359 -18.117 1.00 50.24 H new ATOM 0 HG2 GLU A 18 27.398 33.069 -20.500 1.00 42.45 H new ATOM 0 HG3 GLU A 18 26.192 34.270 -20.085 1.00 42.45 H new ATOM 230 N VAL A 19 23.118 31.827 -18.647 1.00 62.12 N ATOM 231 CA VAL A 19 21.769 32.376 -18.701 1.00 74.03 C ATOM 232 C VAL A 19 20.996 32.062 -17.425 1.00 60.21 C ATOM 233 O VAL A 19 21.197 31.016 -16.808 1.00 43.40 O ATOM 234 CB VAL A 19 20.987 31.827 -19.910 1.00 23.13 C ATOM 235 CG1 VAL A 19 19.766 32.688 -20.192 1.00 50.43 C ATOM 236 CG2 VAL A 19 21.887 31.746 -21.133 1.00 64.33 C ATOM 0 H VAL A 19 23.163 30.845 -18.375 1.00 62.12 H new ATOM 0 HA VAL A 19 21.871 33.456 -18.804 1.00 74.03 H new ATOM 0 HB VAL A 19 20.644 30.820 -19.672 1.00 23.13 H new ATOM 0 HG11 VAL A 19 19.227 32.285 -21.049 1.00 50.43 H new ATOM 0 HG12 VAL A 19 19.112 32.689 -19.320 1.00 50.43 H new ATOM 0 HG13 VAL A 19 20.083 33.708 -20.410 1.00 50.43 H new ATOM 0 HG21 VAL A 19 21.319 31.356 -21.978 1.00 64.33 H new ATOM 0 HG22 VAL A 19 22.262 32.740 -21.376 1.00 64.33 H new ATOM 0 HG23 VAL A 19 22.727 31.083 -20.924 1.00 64.33 H new ATOM 246 N GLU A 20 20.111 32.974 -17.036 1.00 0.22 N ATOM 247 CA GLU A 20 19.308 32.794 -15.832 1.00 61.30 C ATOM 248 C GLU A 20 17.818 32.837 -16.160 1.00 44.31 C ATOM 249 O GLU A 20 17.084 33.717 -15.711 1.00 14.11 O ATOM 250 CB GLU A 20 19.646 33.872 -14.800 1.00 61.03 C ATOM 251 CG GLU A 20 20.133 35.173 -15.417 1.00 21.35 C ATOM 252 CD GLU A 20 19.139 35.761 -16.399 1.00 63.44 C ATOM 253 OE1 GLU A 20 18.047 36.177 -15.962 1.00 13.44 O ATOM 254 OE2 GLU A 20 19.455 35.804 -17.607 1.00 60.10 O ATOM 0 H GLU A 20 19.932 33.844 -17.537 1.00 0.22 H new ATOM 0 HA GLU A 20 19.542 31.815 -15.413 1.00 61.30 H new ATOM 0 HB2 GLU A 20 18.762 34.075 -14.196 1.00 61.03 H new ATOM 0 HB3 GLU A 20 20.412 33.490 -14.126 1.00 61.03 H new ATOM 0 HG2 GLU A 20 20.327 35.896 -14.625 1.00 21.35 H new ATOM 0 HG3 GLU A 20 21.080 34.997 -15.926 1.00 21.35 H new ATOM 261 N PRO A 21 17.361 31.865 -16.963 1.00 42.11 N ATOM 262 CA PRO A 21 15.956 31.770 -17.370 1.00 21.22 C ATOM 263 C PRO A 21 15.043 31.378 -16.213 1.00 50.30 C ATOM 264 O PRO A 21 14.012 32.009 -15.982 1.00 60.44 O ATOM 265 CB PRO A 21 15.969 30.672 -18.436 1.00 62.50 C ATOM 266 CG PRO A 21 17.160 29.839 -18.108 1.00 3.12 C ATOM 267 CD PRO A 21 18.181 30.784 -17.535 1.00 74.34 C ATOM 0 HA PRO A 21 15.569 32.725 -17.727 1.00 21.22 H new ATOM 0 HB2 PRO A 21 15.053 30.082 -18.407 1.00 62.50 H new ATOM 0 HB3 PRO A 21 16.045 31.094 -19.438 1.00 62.50 H new ATOM 0 HG2 PRO A 21 16.905 29.058 -17.391 1.00 3.12 H new ATOM 0 HG3 PRO A 21 17.545 29.341 -18.998 1.00 3.12 H new ATOM 0 HD2 PRO A 21 18.795 30.300 -16.775 1.00 74.34 H new ATOM 0 HD3 PRO A 21 18.859 31.157 -18.303 1.00 74.34 H new ATOM 275 N GLY A 22 15.429 30.333 -15.487 1.00 44.14 N ATOM 276 CA GLY A 22 14.634 29.876 -14.363 1.00 1.12 C ATOM 277 C GLY A 22 14.684 30.835 -13.190 1.00 32.01 C ATOM 278 O GLY A 22 13.888 30.727 -12.257 1.00 52.21 O ATOM 0 H GLY A 22 16.279 29.795 -15.658 1.00 44.14 H new ATOM 0 HA2 GLY A 22 13.599 29.750 -14.681 1.00 1.12 H new ATOM 0 HA3 GLY A 22 14.991 28.897 -14.043 1.00 1.12 H new ATOM 282 N SER A 23 15.623 31.775 -13.235 1.00 75.12 N ATOM 283 CA SER A 23 15.777 32.753 -12.165 1.00 53.52 C ATOM 284 C SER A 23 14.555 33.664 -12.082 1.00 5.04 C ATOM 285 O SER A 23 13.935 33.984 -13.095 1.00 31.43 O ATOM 286 CB SER A 23 17.037 33.591 -12.389 1.00 42.11 C ATOM 287 OG SER A 23 18.190 32.770 -12.455 1.00 62.15 O ATOM 0 H SER A 23 16.288 31.880 -14.001 1.00 75.12 H new ATOM 0 HA SER A 23 15.871 32.213 -11.223 1.00 53.52 H new ATOM 0 HB2 SER A 23 16.939 34.161 -13.313 1.00 42.11 H new ATOM 0 HB3 SER A 23 17.146 34.313 -11.579 1.00 42.11 H new ATOM 0 HG SER A 23 18.124 32.059 -11.783 1.00 62.15 H new ATOM 293 N GLY A 24 14.216 34.079 -10.865 1.00 22.34 N ATOM 294 CA GLY A 24 13.071 34.948 -10.670 1.00 12.23 C ATOM 295 C GLY A 24 12.042 34.350 -9.731 1.00 72.00 C ATOM 296 O GLY A 24 10.865 34.706 -9.780 1.00 55.50 O ATOM 0 H GLY A 24 14.714 33.829 -10.011 1.00 22.34 H new ATOM 0 HA2 GLY A 24 13.409 35.905 -10.272 1.00 12.23 H new ATOM 0 HA3 GLY A 24 12.604 35.151 -11.634 1.00 12.23 H new ATOM 300 N VAL A 25 12.486 33.436 -8.874 1.00 35.10 N ATOM 301 CA VAL A 25 11.595 32.786 -7.920 1.00 74.02 C ATOM 302 C VAL A 25 12.302 32.529 -6.594 1.00 40.14 C ATOM 303 O VAL A 25 13.531 32.484 -6.533 1.00 72.44 O ATOM 304 CB VAL A 25 11.060 31.451 -8.471 1.00 60.33 C ATOM 305 CG1 VAL A 25 9.886 30.961 -7.638 1.00 30.53 C ATOM 306 CG2 VAL A 25 10.662 31.599 -9.932 1.00 63.11 C ATOM 0 H VAL A 25 13.457 33.129 -8.821 1.00 35.10 H new ATOM 0 HA VAL A 25 10.758 33.465 -7.756 1.00 74.02 H new ATOM 0 HB VAL A 25 11.855 30.708 -8.408 1.00 60.33 H new ATOM 0 HG11 VAL A 25 9.522 30.017 -8.043 1.00 30.53 H new ATOM 0 HG12 VAL A 25 10.208 30.814 -6.607 1.00 30.53 H new ATOM 0 HG13 VAL A 25 9.086 31.701 -7.666 1.00 30.53 H new ATOM 0 HG21 VAL A 25 10.286 30.646 -10.305 1.00 63.11 H new ATOM 0 HG22 VAL A 25 9.883 32.356 -10.022 1.00 63.11 H new ATOM 0 HG23 VAL A 25 11.531 31.900 -10.517 1.00 63.11 H new ATOM 316 N ARG A 26 11.518 32.361 -5.534 1.00 40.44 N ATOM 317 CA ARG A 26 12.069 32.110 -4.209 1.00 24.45 C ATOM 318 C ARG A 26 11.510 30.816 -3.624 1.00 13.13 C ATOM 319 O ARG A 26 10.441 30.811 -3.013 1.00 15.21 O ATOM 320 CB ARG A 26 11.760 33.280 -3.274 1.00 2.35 C ATOM 321 CG ARG A 26 12.163 33.029 -1.830 1.00 12.24 C ATOM 322 CD ARG A 26 13.675 32.977 -1.674 1.00 34.21 C ATOM 323 NE ARG A 26 14.216 34.233 -1.161 1.00 71.51 N ATOM 324 CZ ARG A 26 14.056 34.644 0.092 1.00 45.44 C ATOM 325 NH1 ARG A 26 13.375 33.904 0.955 1.00 64.31 N ATOM 326 NH2 ARG A 26 14.579 35.799 0.483 1.00 3.42 N ATOM 0 H ARG A 26 10.499 32.394 -5.568 1.00 40.44 H new ATOM 0 HA ARG A 26 13.150 32.008 -4.306 1.00 24.45 H new ATOM 0 HB2 ARG A 26 12.275 34.170 -3.637 1.00 2.35 H new ATOM 0 HB3 ARG A 26 10.692 33.492 -3.312 1.00 2.35 H new ATOM 0 HG2 ARG A 26 11.758 33.817 -1.196 1.00 12.24 H new ATOM 0 HG3 ARG A 26 11.728 32.090 -1.488 1.00 12.24 H new ATOM 0 HD2 ARG A 26 13.942 32.165 -0.998 1.00 34.21 H new ATOM 0 HD3 ARG A 26 14.131 32.753 -2.638 1.00 34.21 H new ATOM 0 HE ARG A 26 14.745 34.827 -1.800 1.00 71.51 H new ATOM 0 HH11 ARG A 26 12.972 33.016 0.658 1.00 64.31 H new ATOM 0 HH12 ARG A 26 13.254 34.223 1.916 1.00 64.31 H new ATOM 0 HH21 ARG A 26 15.104 36.371 -0.179 1.00 3.42 H new ATOM 0 HH22 ARG A 26 14.456 36.115 1.445 1.00 3.42 H new ATOM 340 N ILE A 27 12.239 29.722 -3.815 1.00 50.15 N ATOM 341 CA ILE A 27 11.816 28.423 -3.307 1.00 15.43 C ATOM 342 C ILE A 27 12.094 28.301 -1.812 1.00 52.24 C ATOM 343 O ILE A 27 13.106 28.796 -1.316 1.00 32.03 O ATOM 344 CB ILE A 27 12.523 27.272 -4.045 1.00 73.41 C ATOM 345 CG1 ILE A 27 12.465 27.495 -5.558 1.00 31.14 C ATOM 346 CG2 ILE A 27 11.889 25.938 -3.676 1.00 45.34 C ATOM 347 CD1 ILE A 27 13.243 26.468 -6.350 1.00 41.01 C ATOM 0 H ILE A 27 13.126 29.709 -4.318 1.00 50.15 H new ATOM 0 HA ILE A 27 10.743 28.350 -3.482 1.00 15.43 H new ATOM 0 HB ILE A 27 13.569 27.252 -3.740 1.00 73.41 H new ATOM 0 HG12 ILE A 27 11.424 27.478 -5.880 1.00 31.14 H new ATOM 0 HG13 ILE A 27 12.853 28.488 -5.786 1.00 31.14 H new ATOM 0 HG21 ILE A 27 12.400 25.134 -4.206 1.00 45.34 H new ATOM 0 HG22 ILE A 27 11.977 25.778 -2.601 1.00 45.34 H new ATOM 0 HG23 ILE A 27 10.836 25.946 -3.956 1.00 45.34 H new ATOM 0 HD11 ILE A 27 13.157 26.688 -7.414 1.00 41.01 H new ATOM 0 HD12 ILE A 27 14.292 26.500 -6.056 1.00 41.01 H new ATOM 0 HD13 ILE A 27 12.841 25.475 -6.152 1.00 41.01 H new ATOM 359 N VAL A 28 11.189 27.637 -1.100 1.00 23.21 N ATOM 360 CA VAL A 28 11.338 27.446 0.338 1.00 43.21 C ATOM 361 C VAL A 28 10.666 26.156 0.794 1.00 62.02 C ATOM 362 O VAL A 28 9.467 26.133 1.073 1.00 63.35 O ATOM 363 CB VAL A 28 10.743 28.628 1.125 1.00 10.35 C ATOM 364 CG1 VAL A 28 10.856 28.384 2.623 1.00 73.35 C ATOM 365 CG2 VAL A 28 11.431 29.928 0.736 1.00 21.10 C ATOM 0 H VAL A 28 10.345 27.222 -1.495 1.00 23.21 H new ATOM 0 HA VAL A 28 12.407 27.386 0.540 1.00 43.21 H new ATOM 0 HB VAL A 28 9.686 28.713 0.873 1.00 10.35 H new ATOM 0 HG11 VAL A 28 10.430 29.230 3.163 1.00 73.35 H new ATOM 0 HG12 VAL A 28 10.313 27.476 2.886 1.00 73.35 H new ATOM 0 HG13 VAL A 28 11.905 28.271 2.895 1.00 73.35 H new ATOM 0 HG21 VAL A 28 10.998 30.753 1.302 1.00 21.10 H new ATOM 0 HG22 VAL A 28 12.496 29.856 0.957 1.00 21.10 H new ATOM 0 HG23 VAL A 28 11.293 30.108 -0.330 1.00 21.10 H new ATOM 375 N VAL A 29 11.447 25.083 0.868 1.00 32.41 N ATOM 376 CA VAL A 29 10.928 23.788 1.292 1.00 71.30 C ATOM 377 C VAL A 29 10.705 23.752 2.800 1.00 62.23 C ATOM 378 O VAL A 29 11.659 23.716 3.577 1.00 53.43 O ATOM 379 CB VAL A 29 11.882 22.644 0.898 1.00 54.45 C ATOM 380 CG1 VAL A 29 11.241 21.294 1.177 1.00 33.35 C ATOM 381 CG2 VAL A 29 12.278 22.763 -0.566 1.00 74.35 C ATOM 0 H VAL A 29 12.441 25.085 0.640 1.00 32.41 H new ATOM 0 HA VAL A 29 9.974 23.648 0.783 1.00 71.30 H new ATOM 0 HB VAL A 29 12.785 22.722 1.503 1.00 54.45 H new ATOM 0 HG11 VAL A 29 11.930 20.498 0.892 1.00 33.35 H new ATOM 0 HG12 VAL A 29 11.012 21.213 2.240 1.00 33.35 H new ATOM 0 HG13 VAL A 29 10.321 21.202 0.599 1.00 33.35 H new ATOM 0 HG21 VAL A 29 12.952 21.947 -0.828 1.00 74.35 H new ATOM 0 HG22 VAL A 29 11.386 22.711 -1.190 1.00 74.35 H new ATOM 0 HG23 VAL A 29 12.781 23.716 -0.731 1.00 74.35 H new ATOM 391 N GLU A 30 9.439 23.761 3.206 1.00 65.40 N ATOM 392 CA GLU A 30 9.092 23.729 4.622 1.00 41.32 C ATOM 393 C GLU A 30 8.925 22.293 5.109 1.00 22.14 C ATOM 394 O GLU A 30 7.955 21.617 4.764 1.00 4.43 O ATOM 395 CB GLU A 30 7.804 24.517 4.871 1.00 22.03 C ATOM 396 CG GLU A 30 7.676 25.039 6.292 1.00 13.05 C ATOM 397 CD GLU A 30 6.392 25.815 6.515 1.00 32.52 C ATOM 398 OE1 GLU A 30 5.320 25.178 6.587 1.00 73.15 O ATOM 399 OE2 GLU A 30 6.459 27.057 6.618 1.00 52.11 O ATOM 0 H GLU A 30 8.638 23.790 2.575 1.00 65.40 H new ATOM 0 HA GLU A 30 9.906 24.191 5.180 1.00 41.32 H new ATOM 0 HB2 GLU A 30 7.763 25.358 4.179 1.00 22.03 H new ATOM 0 HB3 GLU A 30 6.949 23.879 4.649 1.00 22.03 H new ATOM 0 HG2 GLU A 30 7.715 24.201 6.988 1.00 13.05 H new ATOM 0 HG3 GLU A 30 8.528 25.681 6.518 1.00 13.05 H new ATOM 406 N TYR A 31 9.878 21.833 5.913 1.00 53.00 N ATOM 407 CA TYR A 31 9.839 20.476 6.446 1.00 12.50 C ATOM 408 C TYR A 31 10.378 20.436 7.873 1.00 53.12 C ATOM 409 O TYR A 31 11.060 21.359 8.318 1.00 41.41 O ATOM 410 CB TYR A 31 10.649 19.533 5.556 1.00 65.10 C ATOM 411 CG TYR A 31 12.137 19.803 5.583 1.00 12.33 C ATOM 412 CD1 TYR A 31 12.707 20.746 4.738 1.00 43.44 C ATOM 413 CD2 TYR A 31 12.972 19.116 6.456 1.00 34.00 C ATOM 414 CE1 TYR A 31 14.066 20.996 4.759 1.00 72.12 C ATOM 415 CE2 TYR A 31 14.331 19.360 6.485 1.00 1.02 C ATOM 416 CZ TYR A 31 14.873 20.300 5.634 1.00 4.54 C ATOM 417 OH TYR A 31 16.227 20.547 5.660 1.00 50.24 O ATOM 0 H TYR A 31 10.686 22.380 6.210 1.00 53.00 H new ATOM 0 HA TYR A 31 8.800 20.148 6.460 1.00 12.50 H new ATOM 0 HB2 TYR A 31 10.469 18.505 5.871 1.00 65.10 H new ATOM 0 HB3 TYR A 31 10.291 19.619 4.530 1.00 65.10 H new ATOM 0 HD1 TYR A 31 12.077 21.294 4.052 1.00 43.44 H new ATOM 0 HD2 TYR A 31 12.551 18.379 7.123 1.00 34.00 H new ATOM 0 HE1 TYR A 31 14.493 21.732 4.094 1.00 72.12 H new ATOM 0 HE2 TYR A 31 14.966 18.818 7.170 1.00 1.02 H new ATOM 0 HH TYR A 31 16.532 20.795 4.762 1.00 50.24 H new ATOM 427 N CYS A 32 10.067 19.359 8.585 1.00 34.54 N ATOM 428 CA CYS A 32 10.518 19.195 9.962 1.00 63.22 C ATOM 429 C CYS A 32 12.011 18.880 10.011 1.00 74.22 C ATOM 430 O CYS A 32 12.422 17.742 9.787 1.00 60.10 O ATOM 431 CB CYS A 32 9.728 18.081 10.651 1.00 72.31 C ATOM 432 SG CYS A 32 10.358 17.633 12.301 1.00 54.24 S ATOM 0 H CYS A 32 9.504 18.586 8.231 1.00 34.54 H new ATOM 0 HA CYS A 32 10.344 20.133 10.489 1.00 63.22 H new ATOM 0 HB2 CYS A 32 8.687 18.392 10.743 1.00 72.31 H new ATOM 0 HB3 CYS A 32 9.741 17.195 10.016 1.00 72.31 H new ATOM 437 N GLU A 33 12.815 19.896 10.305 1.00 1.33 N ATOM 438 CA GLU A 33 14.261 19.727 10.383 1.00 43.40 C ATOM 439 C GLU A 33 14.626 18.586 11.329 1.00 52.54 C ATOM 440 O GLU A 33 15.218 17.583 10.932 1.00 63.23 O ATOM 441 CB GLU A 33 14.924 21.024 10.852 1.00 42.44 C ATOM 442 CG GLU A 33 15.734 21.719 9.770 1.00 2.31 C ATOM 443 CD GLU A 33 15.455 23.208 9.698 1.00 74.13 C ATOM 444 OE1 GLU A 33 16.090 23.968 10.459 1.00 73.23 O ATOM 445 OE2 GLU A 33 14.601 23.613 8.881 1.00 64.00 O ATOM 0 H GLU A 33 12.490 20.844 10.493 1.00 1.33 H new ATOM 0 HA GLU A 33 14.626 19.480 9.386 1.00 43.40 H new ATOM 0 HB2 GLU A 33 14.154 21.706 11.212 1.00 42.44 H new ATOM 0 HB3 GLU A 33 15.576 20.804 11.697 1.00 42.44 H new ATOM 0 HG2 GLU A 33 16.796 21.561 9.958 1.00 2.31 H new ATOM 0 HG3 GLU A 33 15.510 21.264 8.805 1.00 2.31 H new ATOM 452 N PRO A 34 14.264 18.743 12.611 1.00 63.13 N ATOM 453 CA PRO A 34 14.543 17.737 13.640 1.00 34.01 C ATOM 454 C PRO A 34 13.708 16.474 13.457 1.00 62.12 C ATOM 455 O PRO A 34 12.940 16.091 14.340 1.00 51.42 O ATOM 456 CB PRO A 34 14.160 18.446 14.942 1.00 44.14 C ATOM 457 CG PRO A 34 13.158 19.470 14.535 1.00 74.02 C ATOM 458 CD PRO A 34 13.555 19.914 13.154 1.00 25.42 C ATOM 0 HA PRO A 34 15.579 17.400 13.610 1.00 34.01 H new ATOM 0 HB2 PRO A 34 13.740 17.747 15.665 1.00 44.14 H new ATOM 0 HB3 PRO A 34 15.029 18.907 15.412 1.00 44.14 H new ATOM 0 HG2 PRO A 34 12.151 19.052 14.536 1.00 74.02 H new ATOM 0 HG3 PRO A 34 13.155 20.310 15.229 1.00 74.02 H new ATOM 0 HD2 PRO A 34 12.686 20.173 12.550 1.00 25.42 H new ATOM 0 HD3 PRO A 34 14.197 20.794 13.184 1.00 25.42 H new ATOM 466 N CYS A 35 13.864 15.829 12.305 1.00 2.24 N ATOM 467 CA CYS A 35 13.125 14.609 12.006 1.00 65.44 C ATOM 468 C CYS A 35 13.934 13.694 11.090 1.00 43.31 C ATOM 469 O CYS A 35 14.002 12.485 11.305 1.00 73.11 O ATOM 470 CB CYS A 35 11.784 14.947 11.351 1.00 24.15 C ATOM 471 SG CYS A 35 10.518 15.544 12.517 1.00 3.31 S ATOM 0 H CYS A 35 14.496 16.132 11.564 1.00 2.24 H new ATOM 0 HA CYS A 35 12.942 14.086 12.945 1.00 65.44 H new ATOM 0 HB2 CYS A 35 11.946 15.707 10.587 1.00 24.15 H new ATOM 0 HB3 CYS A 35 11.406 14.060 10.843 1.00 24.15 H new ATOM 476 N GLY A 36 14.547 14.282 10.067 1.00 43.31 N ATOM 477 CA GLY A 36 15.343 13.507 9.134 1.00 64.41 C ATOM 478 C GLY A 36 14.861 13.647 7.704 1.00 72.22 C ATOM 479 O GLY A 36 15.189 12.826 6.847 1.00 70.11 O ATOM 0 H GLY A 36 14.506 15.282 9.868 1.00 43.31 H new ATOM 0 HA2 GLY A 36 16.383 13.826 9.196 1.00 64.41 H new ATOM 0 HA3 GLY A 36 15.314 12.456 9.422 1.00 64.41 H new ATOM 483 N PHE A 37 14.078 14.689 7.445 1.00 73.33 N ATOM 484 CA PHE A 37 13.546 14.932 6.109 1.00 44.14 C ATOM 485 C PHE A 37 14.430 15.913 5.342 1.00 33.54 C ATOM 486 O PHE A 37 14.017 16.472 4.327 1.00 21.20 O ATOM 487 CB PHE A 37 12.119 15.475 6.196 1.00 54.33 C ATOM 488 CG PHE A 37 11.121 14.463 6.680 1.00 75.42 C ATOM 489 CD1 PHE A 37 11.018 13.224 6.067 1.00 30.13 C ATOM 490 CD2 PHE A 37 10.285 14.749 7.747 1.00 3.15 C ATOM 491 CE1 PHE A 37 10.100 12.291 6.510 1.00 32.34 C ATOM 492 CE2 PHE A 37 9.365 13.820 8.195 1.00 25.43 C ATOM 493 CZ PHE A 37 9.273 12.588 7.576 1.00 5.44 C ATOM 0 H PHE A 37 13.798 15.379 8.142 1.00 73.33 H new ATOM 0 HA PHE A 37 13.534 13.984 5.572 1.00 44.14 H new ATOM 0 HB2 PHE A 37 12.106 16.335 6.866 1.00 54.33 H new ATOM 0 HB3 PHE A 37 11.814 15.832 5.212 1.00 54.33 H new ATOM 0 HD1 PHE A 37 11.662 12.985 5.234 1.00 30.13 H new ATOM 0 HD2 PHE A 37 10.353 15.710 8.235 1.00 3.15 H new ATOM 0 HE1 PHE A 37 10.029 11.330 6.023 1.00 32.34 H new ATOM 0 HE2 PHE A 37 8.719 14.057 9.028 1.00 25.43 H new ATOM 0 HZ PHE A 37 8.556 11.859 7.925 1.00 5.44 H new ATOM 503 N GLU A 38 15.647 16.115 5.838 1.00 54.22 N ATOM 504 CA GLU A 38 16.587 17.029 5.201 1.00 65.04 C ATOM 505 C GLU A 38 17.449 16.296 4.176 1.00 31.02 C ATOM 506 O GLU A 38 18.169 16.918 3.396 1.00 53.30 O ATOM 507 CB GLU A 38 17.480 17.693 6.252 1.00 75.41 C ATOM 508 CG GLU A 38 18.453 18.706 5.673 1.00 74.34 C ATOM 509 CD GLU A 38 18.918 19.720 6.699 1.00 40.42 C ATOM 510 OE1 GLU A 38 18.553 19.577 7.884 1.00 35.11 O ATOM 511 OE2 GLU A 38 19.648 20.658 6.316 1.00 45.33 O ATOM 0 H GLU A 38 16.004 15.659 6.677 1.00 54.22 H new ATOM 0 HA GLU A 38 16.012 17.798 4.685 1.00 65.04 H new ATOM 0 HB2 GLU A 38 16.850 18.188 6.991 1.00 75.41 H new ATOM 0 HB3 GLU A 38 18.042 16.922 6.778 1.00 75.41 H new ATOM 0 HG2 GLU A 38 19.318 18.182 5.267 1.00 74.34 H new ATOM 0 HG3 GLU A 38 17.978 19.227 4.842 1.00 74.34 H new ATOM 518 N ALA A 39 17.369 14.969 4.186 1.00 4.40 N ATOM 519 CA ALA A 39 18.140 14.151 3.258 1.00 52.12 C ATOM 520 C ALA A 39 17.572 14.240 1.845 1.00 14.45 C ATOM 521 O ALA A 39 18.266 13.964 0.867 1.00 51.14 O ATOM 522 CB ALA A 39 18.167 12.704 3.727 1.00 0.13 C ATOM 0 H ALA A 39 16.778 14.438 4.826 1.00 4.40 H new ATOM 0 HA ALA A 39 19.160 14.534 3.236 1.00 52.12 H new ATOM 0 HB1 ALA A 39 18.746 12.105 3.025 1.00 0.13 H new ATOM 0 HB2 ALA A 39 18.626 12.650 4.714 1.00 0.13 H new ATOM 0 HB3 ALA A 39 17.148 12.319 3.779 1.00 0.13 H new ATOM 528 N THR A 40 16.304 14.628 1.746 1.00 73.41 N ATOM 529 CA THR A 40 15.642 14.751 0.453 1.00 14.45 C ATOM 530 C THR A 40 15.766 16.168 -0.094 1.00 51.55 C ATOM 531 O THR A 40 15.637 16.392 -1.298 1.00 51.53 O ATOM 532 CB THR A 40 14.150 14.379 0.548 1.00 20.14 C ATOM 533 OG1 THR A 40 14.011 13.025 0.994 1.00 55.12 O ATOM 534 CG2 THR A 40 13.463 14.548 -0.798 1.00 41.43 C ATOM 0 H THR A 40 15.715 14.862 2.545 1.00 73.41 H new ATOM 0 HA THR A 40 16.139 14.057 -0.225 1.00 14.45 H new ATOM 0 HB THR A 40 13.676 15.049 1.266 1.00 20.14 H new ATOM 0 HG1 THR A 40 13.060 12.796 1.054 1.00 55.12 H new ATOM 0 HG21 THR A 40 12.411 14.279 -0.706 1.00 41.43 H new ATOM 0 HG22 THR A 40 13.546 15.586 -1.121 1.00 41.43 H new ATOM 0 HG23 THR A 40 13.940 13.900 -1.534 1.00 41.43 H new ATOM 542 N TYR A 41 16.018 17.122 0.796 1.00 73.24 N ATOM 543 CA TYR A 41 16.158 18.518 0.401 1.00 52.43 C ATOM 544 C TYR A 41 17.619 18.865 0.134 1.00 44.02 C ATOM 545 O TYR A 41 17.932 19.627 -0.782 1.00 70.02 O ATOM 546 CB TYR A 41 15.595 19.436 1.487 1.00 55.31 C ATOM 547 CG TYR A 41 15.988 20.886 1.318 1.00 11.42 C ATOM 548 CD1 TYR A 41 15.401 21.676 0.337 1.00 2.44 C ATOM 549 CD2 TYR A 41 16.946 21.467 2.141 1.00 71.25 C ATOM 550 CE1 TYR A 41 15.758 23.001 0.179 1.00 3.53 C ATOM 551 CE2 TYR A 41 17.308 22.792 1.991 1.00 61.54 C ATOM 552 CZ TYR A 41 16.712 23.554 1.008 1.00 11.54 C ATOM 553 OH TYR A 41 17.069 24.874 0.855 1.00 3.50 O ATOM 0 H TYR A 41 16.129 16.953 1.796 1.00 73.24 H new ATOM 0 HA TYR A 41 15.594 18.667 -0.520 1.00 52.43 H new ATOM 0 HB2 TYR A 41 14.508 19.361 1.487 1.00 55.31 H new ATOM 0 HB3 TYR A 41 15.939 19.086 2.461 1.00 55.31 H new ATOM 0 HD1 TYR A 41 14.653 21.247 -0.313 1.00 2.44 H new ATOM 0 HD2 TYR A 41 17.415 20.872 2.911 1.00 71.25 H new ATOM 0 HE1 TYR A 41 15.293 23.601 -0.589 1.00 3.53 H new ATOM 0 HE2 TYR A 41 18.053 23.228 2.640 1.00 61.54 H new ATOM 0 HH TYR A 41 18.038 24.967 0.972 1.00 3.50 H new ATOM 563 N LEU A 42 18.511 18.300 0.940 1.00 61.31 N ATOM 564 CA LEU A 42 19.941 18.547 0.792 1.00 2.00 C ATOM 565 C LEU A 42 20.519 17.731 -0.360 1.00 54.54 C ATOM 566 O LEU A 42 21.675 17.910 -0.741 1.00 1.12 O ATOM 567 CB LEU A 42 20.675 18.207 2.091 1.00 74.55 C ATOM 568 CG LEU A 42 21.867 19.097 2.442 1.00 52.45 C ATOM 569 CD1 LEU A 42 21.410 20.525 2.696 1.00 55.31 C ATOM 570 CD2 LEU A 42 22.605 18.548 3.654 1.00 73.24 C ATOM 0 H LEU A 42 18.269 17.668 1.703 1.00 61.31 H new ATOM 0 HA LEU A 42 20.080 19.605 0.569 1.00 2.00 H new ATOM 0 HB2 LEU A 42 19.959 18.253 2.912 1.00 74.55 H new ATOM 0 HB3 LEU A 42 21.023 17.176 2.029 1.00 74.55 H new ATOM 0 HG LEU A 42 22.554 19.102 1.595 1.00 52.45 H new ATOM 0 HD11 LEU A 42 22.272 21.144 2.944 1.00 55.31 H new ATOM 0 HD12 LEU A 42 20.927 20.917 1.801 1.00 55.31 H new ATOM 0 HD13 LEU A 42 20.703 20.539 3.525 1.00 55.31 H new ATOM 0 HD21 LEU A 42 23.450 19.195 3.889 1.00 73.24 H new ATOM 0 HD22 LEU A 42 21.927 18.512 4.507 1.00 73.24 H new ATOM 0 HD23 LEU A 42 22.967 17.543 3.435 1.00 73.24 H new ATOM 582 N GLU A 43 19.704 16.838 -0.913 1.00 20.34 N ATOM 583 CA GLU A 43 20.135 15.996 -2.023 1.00 15.12 C ATOM 584 C GLU A 43 19.781 16.638 -3.361 1.00 51.23 C ATOM 585 O GLU A 43 20.372 16.316 -4.393 1.00 32.31 O ATOM 586 CB GLU A 43 19.490 14.612 -1.923 1.00 12.15 C ATOM 587 CG GLU A 43 20.325 13.606 -1.148 1.00 40.23 C ATOM 588 CD GLU A 43 21.627 13.267 -1.848 1.00 11.41 C ATOM 589 OE1 GLU A 43 21.843 13.767 -2.972 1.00 70.11 O ATOM 590 OE2 GLU A 43 22.429 12.503 -1.272 1.00 42.32 O ATOM 0 H GLU A 43 18.743 16.679 -0.611 1.00 20.34 H new ATOM 0 HA GLU A 43 21.218 15.889 -1.965 1.00 15.12 H new ATOM 0 HB2 GLU A 43 18.516 14.708 -1.444 1.00 12.15 H new ATOM 0 HB3 GLU A 43 19.315 14.229 -2.928 1.00 12.15 H new ATOM 0 HG2 GLU A 43 20.543 14.006 -0.158 1.00 40.23 H new ATOM 0 HG3 GLU A 43 19.746 12.694 -1.003 1.00 40.23 H new ATOM 597 N LEU A 44 18.813 17.548 -3.337 1.00 22.22 N ATOM 598 CA LEU A 44 18.379 18.236 -4.548 1.00 22.13 C ATOM 599 C LEU A 44 18.781 19.707 -4.512 1.00 20.11 C ATOM 600 O LEU A 44 18.913 20.350 -5.553 1.00 13.13 O ATOM 601 CB LEU A 44 16.863 18.113 -4.712 1.00 43.41 C ATOM 602 CG LEU A 44 16.014 18.824 -3.657 1.00 42.05 C ATOM 603 CD1 LEU A 44 15.775 20.273 -4.052 1.00 50.05 C ATOM 604 CD2 LEU A 44 14.692 18.098 -3.460 1.00 34.13 C ATOM 0 H LEU A 44 18.314 17.826 -2.492 1.00 22.22 H new ATOM 0 HA LEU A 44 18.870 17.765 -5.400 1.00 22.13 H new ATOM 0 HB2 LEU A 44 16.591 18.504 -5.692 1.00 43.41 H new ATOM 0 HB3 LEU A 44 16.602 17.055 -4.707 1.00 43.41 H new ATOM 0 HG LEU A 44 16.557 18.812 -2.712 1.00 42.05 H new ATOM 0 HD11 LEU A 44 15.169 20.763 -3.290 1.00 50.05 H new ATOM 0 HD12 LEU A 44 16.731 20.788 -4.142 1.00 50.05 H new ATOM 0 HD13 LEU A 44 15.253 20.308 -5.008 1.00 50.05 H new ATOM 0 HD21 LEU A 44 14.101 18.617 -2.706 1.00 34.13 H new ATOM 0 HD22 LEU A 44 14.144 18.079 -4.402 1.00 34.13 H new ATOM 0 HD23 LEU A 44 14.883 17.077 -3.131 1.00 34.13 H new ATOM 616 N ALA A 45 18.976 20.232 -3.307 1.00 5.40 N ATOM 617 CA ALA A 45 19.368 21.626 -3.136 1.00 13.04 C ATOM 618 C ALA A 45 20.755 21.882 -3.714 1.00 24.33 C ATOM 619 O ALA A 45 21.120 23.023 -3.997 1.00 75.24 O ATOM 620 CB ALA A 45 19.329 22.008 -1.663 1.00 55.04 C ATOM 0 H ALA A 45 18.869 19.714 -2.435 1.00 5.40 H new ATOM 0 HA ALA A 45 18.657 22.247 -3.681 1.00 13.04 H new ATOM 0 HB1 ALA A 45 19.624 23.051 -1.550 1.00 55.04 H new ATOM 0 HB2 ALA A 45 18.318 21.873 -1.279 1.00 55.04 H new ATOM 0 HB3 ALA A 45 20.017 21.374 -1.104 1.00 55.04 H new ATOM 626 N SER A 46 21.526 20.812 -3.885 1.00 43.51 N ATOM 627 CA SER A 46 22.876 20.922 -4.425 1.00 43.13 C ATOM 628 C SER A 46 22.864 20.800 -5.946 1.00 65.01 C ATOM 629 O SER A 46 23.804 21.220 -6.621 1.00 12.53 O ATOM 630 CB SER A 46 23.779 19.843 -3.823 1.00 14.53 C ATOM 631 OG SER A 46 25.147 20.151 -4.026 1.00 12.33 O ATOM 0 H SER A 46 21.239 19.860 -3.657 1.00 43.51 H new ATOM 0 HA SER A 46 23.268 21.904 -4.159 1.00 43.13 H new ATOM 0 HB2 SER A 46 23.578 19.751 -2.756 1.00 14.53 H new ATOM 0 HB3 SER A 46 23.549 18.878 -4.275 1.00 14.53 H new ATOM 0 HG SER A 46 25.703 19.447 -3.631 1.00 12.33 H new ATOM 637 N ALA A 47 21.793 20.221 -6.479 1.00 23.15 N ATOM 638 CA ALA A 47 21.657 20.045 -7.919 1.00 31.50 C ATOM 639 C ALA A 47 20.791 21.142 -8.527 1.00 13.51 C ATOM 640 O ALA A 47 20.914 21.461 -9.710 1.00 11.14 O ATOM 641 CB ALA A 47 21.072 18.675 -8.230 1.00 32.10 C ATOM 0 H ALA A 47 21.007 19.866 -5.935 1.00 23.15 H new ATOM 0 HA ALA A 47 22.650 20.114 -8.364 1.00 31.50 H new ATOM 0 HB1 ALA A 47 20.976 18.557 -9.309 1.00 32.10 H new ATOM 0 HB2 ALA A 47 21.731 17.900 -7.838 1.00 32.10 H new ATOM 0 HB3 ALA A 47 20.090 18.585 -7.766 1.00 32.10 H new ATOM 647 N VAL A 48 19.913 21.718 -7.711 1.00 23.34 N ATOM 648 CA VAL A 48 19.026 22.781 -8.168 1.00 63.41 C ATOM 649 C VAL A 48 19.793 24.080 -8.387 1.00 11.24 C ATOM 650 O VAL A 48 19.388 24.927 -9.184 1.00 22.51 O ATOM 651 CB VAL A 48 17.887 23.032 -7.163 1.00 12.42 C ATOM 652 CG1 VAL A 48 18.435 23.619 -5.871 1.00 35.45 C ATOM 653 CG2 VAL A 48 16.834 23.948 -7.769 1.00 44.14 C ATOM 0 H VAL A 48 19.797 21.466 -6.729 1.00 23.34 H new ATOM 0 HA VAL A 48 18.598 22.452 -9.115 1.00 63.41 H new ATOM 0 HB VAL A 48 17.415 22.078 -6.930 1.00 12.42 H new ATOM 0 HG11 VAL A 48 17.616 23.790 -5.173 1.00 35.45 H new ATOM 0 HG12 VAL A 48 19.149 22.924 -5.430 1.00 35.45 H new ATOM 0 HG13 VAL A 48 18.933 24.565 -6.084 1.00 35.45 H new ATOM 0 HG21 VAL A 48 16.036 24.115 -7.045 1.00 44.14 H new ATOM 0 HG22 VAL A 48 17.290 24.902 -8.033 1.00 44.14 H new ATOM 0 HG23 VAL A 48 16.420 23.484 -8.664 1.00 44.14 H new ATOM 663 N LYS A 49 20.904 24.232 -7.673 1.00 55.53 N ATOM 664 CA LYS A 49 21.730 25.428 -7.789 1.00 51.12 C ATOM 665 C LYS A 49 22.524 25.416 -9.091 1.00 45.22 C ATOM 666 O LYS A 49 22.879 26.468 -9.621 1.00 43.43 O ATOM 667 CB LYS A 49 22.685 25.531 -6.598 1.00 33.44 C ATOM 668 CG LYS A 49 23.076 26.957 -6.253 1.00 2.11 C ATOM 669 CD LYS A 49 22.087 27.589 -5.288 1.00 50.21 C ATOM 670 CE LYS A 49 20.896 28.187 -6.022 1.00 64.44 C ATOM 671 NZ LYS A 49 20.234 29.257 -5.227 1.00 5.41 N ATOM 0 H LYS A 49 21.253 23.542 -7.008 1.00 55.53 H new ATOM 0 HA LYS A 49 21.070 26.296 -7.794 1.00 51.12 H new ATOM 0 HB2 LYS A 49 22.218 25.071 -5.728 1.00 33.44 H new ATOM 0 HB3 LYS A 49 23.587 24.959 -6.816 1.00 33.44 H new ATOM 0 HG2 LYS A 49 24.072 26.965 -5.811 1.00 2.11 H new ATOM 0 HG3 LYS A 49 23.127 27.552 -7.165 1.00 2.11 H new ATOM 0 HD2 LYS A 49 21.739 26.838 -4.579 1.00 50.21 H new ATOM 0 HD3 LYS A 49 22.587 28.366 -4.710 1.00 50.21 H new ATOM 0 HE2 LYS A 49 21.226 28.596 -6.977 1.00 64.44 H new ATOM 0 HE3 LYS A 49 20.174 27.401 -6.244 1.00 64.44 H new ATOM 0 HZ1 LYS A 49 19.428 29.638 -5.762 1.00 5.41 H new ATOM 0 HZ2 LYS A 49 19.896 28.862 -4.326 1.00 5.41 H new ATOM 0 HZ3 LYS A 49 20.915 30.020 -5.036 1.00 5.41 H new ATOM 685 N GLU A 50 22.799 24.219 -9.601 1.00 54.51 N ATOM 686 CA GLU A 50 23.551 24.073 -10.842 1.00 33.43 C ATOM 687 C GLU A 50 22.682 24.414 -12.049 1.00 14.35 C ATOM 688 O GLU A 50 23.191 24.703 -13.131 1.00 24.41 O ATOM 689 CB GLU A 50 24.087 22.645 -10.973 1.00 52.52 C ATOM 690 CG GLU A 50 25.002 22.447 -12.170 1.00 34.20 C ATOM 691 CD GLU A 50 26.080 23.509 -12.262 1.00 63.53 C ATOM 692 OE1 GLU A 50 26.954 23.546 -11.371 1.00 41.42 O ATOM 693 OE2 GLU A 50 26.050 24.302 -13.227 1.00 22.52 O ATOM 0 H GLU A 50 22.513 23.338 -9.175 1.00 54.51 H new ATOM 0 HA GLU A 50 24.390 24.768 -10.813 1.00 33.43 H new ATOM 0 HB2 GLU A 50 24.630 22.385 -10.064 1.00 52.52 H new ATOM 0 HB3 GLU A 50 23.246 21.956 -11.051 1.00 52.52 H new ATOM 0 HG2 GLU A 50 25.470 21.464 -12.107 1.00 34.20 H new ATOM 0 HG3 GLU A 50 24.407 22.458 -13.083 1.00 34.20 H new ATOM 700 N GLN A 51 21.367 24.379 -11.853 1.00 24.20 N ATOM 701 CA GLN A 51 20.428 24.683 -12.925 1.00 55.43 C ATOM 702 C GLN A 51 19.969 26.136 -12.851 1.00 34.12 C ATOM 703 O GLN A 51 19.968 26.849 -13.854 1.00 40.52 O ATOM 704 CB GLN A 51 19.218 23.750 -12.853 1.00 21.45 C ATOM 705 CG GLN A 51 18.273 23.884 -14.036 1.00 3.52 C ATOM 706 CD GLN A 51 18.530 22.845 -15.109 1.00 43.21 C ATOM 707 OE1 GLN A 51 18.929 23.175 -16.226 1.00 41.44 O ATOM 708 NE2 GLN A 51 18.303 21.580 -14.775 1.00 52.33 N ATOM 0 H GLN A 51 20.929 24.143 -10.962 1.00 24.20 H new ATOM 0 HA GLN A 51 20.940 24.530 -13.875 1.00 55.43 H new ATOM 0 HB2 GLN A 51 19.568 22.719 -12.793 1.00 21.45 H new ATOM 0 HB3 GLN A 51 18.667 23.953 -11.934 1.00 21.45 H new ATOM 0 HG2 GLN A 51 17.245 23.793 -13.687 1.00 3.52 H new ATOM 0 HG3 GLN A 51 18.376 24.880 -14.468 1.00 3.52 H new ATOM 0 HE21 GLN A 51 17.973 21.351 -13.837 1.00 52.33 H new ATOM 0 HE22 GLN A 51 18.459 20.837 -15.456 1.00 52.33 H new ATOM 717 N TYR A 52 19.579 26.567 -11.656 1.00 54.25 N ATOM 718 CA TYR A 52 19.114 27.934 -11.452 1.00 4.14 C ATOM 719 C TYR A 52 19.885 28.607 -10.320 1.00 13.13 C ATOM 720 O TYR A 52 19.387 28.768 -9.205 1.00 52.43 O ATOM 721 CB TYR A 52 17.617 27.945 -11.141 1.00 53.44 C ATOM 722 CG TYR A 52 16.778 27.238 -12.181 1.00 75.04 C ATOM 723 CD1 TYR A 52 17.078 27.343 -13.534 1.00 13.02 C ATOM 724 CD2 TYR A 52 15.685 26.464 -11.811 1.00 72.42 C ATOM 725 CE1 TYR A 52 16.313 26.699 -14.487 1.00 42.13 C ATOM 726 CE2 TYR A 52 14.916 25.815 -12.758 1.00 35.23 C ATOM 727 CZ TYR A 52 15.233 25.936 -14.094 1.00 44.14 C ATOM 728 OH TYR A 52 14.470 25.292 -15.041 1.00 63.11 O ATOM 0 H TYR A 52 19.576 25.990 -10.815 1.00 54.25 H new ATOM 0 HA TYR A 52 19.291 28.492 -12.371 1.00 4.14 H new ATOM 0 HB2 TYR A 52 17.452 27.474 -10.172 1.00 53.44 H new ATOM 0 HB3 TYR A 52 17.280 28.978 -11.055 1.00 53.44 H new ATOM 0 HD1 TYR A 52 17.924 27.938 -13.846 1.00 13.02 H new ATOM 0 HD2 TYR A 52 15.432 26.368 -10.765 1.00 72.42 H new ATOM 0 HE1 TYR A 52 16.559 26.792 -15.534 1.00 42.13 H new ATOM 0 HE2 TYR A 52 14.071 25.216 -12.453 1.00 35.23 H new ATOM 0 HH TYR A 52 13.749 24.797 -14.599 1.00 63.11 H new ATOM 738 N PRO A 53 21.130 29.011 -10.611 1.00 62.42 N ATOM 739 CA PRO A 53 21.997 29.674 -9.633 1.00 11.04 C ATOM 740 C PRO A 53 21.516 31.080 -9.292 1.00 10.33 C ATOM 741 O PRO A 53 22.038 31.722 -8.381 1.00 31.42 O ATOM 742 CB PRO A 53 23.353 29.729 -10.340 1.00 42.50 C ATOM 743 CG PRO A 53 23.024 29.698 -11.793 1.00 24.53 C ATOM 744 CD PRO A 53 21.788 28.851 -11.919 1.00 22.21 C ATOM 0 HA PRO A 53 22.019 29.143 -8.682 1.00 11.04 H new ATOM 0 HB2 PRO A 53 23.900 30.634 -10.077 1.00 42.50 H new ATOM 0 HB3 PRO A 53 23.981 28.884 -10.058 1.00 42.50 H new ATOM 0 HG2 PRO A 53 22.849 30.704 -12.175 1.00 24.53 H new ATOM 0 HG3 PRO A 53 23.847 29.276 -12.371 1.00 24.53 H new ATOM 0 HD2 PRO A 53 21.149 29.191 -12.734 1.00 22.21 H new ATOM 0 HD3 PRO A 53 22.034 27.808 -12.120 1.00 22.21 H new ATOM 752 N GLY A 54 20.517 31.554 -10.030 1.00 15.44 N ATOM 753 CA GLY A 54 19.982 32.882 -9.789 1.00 70.04 C ATOM 754 C GLY A 54 18.885 32.885 -8.743 1.00 23.21 C ATOM 755 O GLY A 54 18.785 33.815 -7.942 1.00 22.41 O ATOM 0 H GLY A 54 20.069 31.043 -10.790 1.00 15.44 H new ATOM 0 HA2 GLY A 54 20.788 33.542 -9.468 1.00 70.04 H new ATOM 0 HA3 GLY A 54 19.591 33.287 -10.722 1.00 70.04 H new ATOM 759 N ILE A 55 18.060 31.843 -8.750 1.00 41.42 N ATOM 760 CA ILE A 55 16.965 31.730 -7.795 1.00 2.33 C ATOM 761 C ILE A 55 17.482 31.756 -6.360 1.00 44.25 C ATOM 762 O ILE A 55 18.674 31.949 -6.124 1.00 65.30 O ATOM 763 CB ILE A 55 16.158 30.437 -8.014 1.00 51.21 C ATOM 764 CG1 ILE A 55 17.007 29.214 -7.662 1.00 12.04 C ATOM 765 CG2 ILE A 55 15.672 30.354 -9.453 1.00 54.23 C ATOM 766 CD1 ILE A 55 16.483 28.437 -6.474 1.00 3.10 C ATOM 0 H ILE A 55 18.129 31.065 -9.406 1.00 41.42 H new ATOM 0 HA ILE A 55 16.313 32.588 -7.960 1.00 2.33 H new ATOM 0 HB ILE A 55 15.288 30.453 -7.357 1.00 51.21 H new ATOM 0 HG12 ILE A 55 17.053 28.552 -8.527 1.00 12.04 H new ATOM 0 HG13 ILE A 55 18.027 29.537 -7.453 1.00 12.04 H new ATOM 0 HG21 ILE A 55 15.103 29.435 -9.592 1.00 54.23 H new ATOM 0 HG22 ILE A 55 15.036 31.211 -9.672 1.00 54.23 H new ATOM 0 HG23 ILE A 55 16.529 30.356 -10.127 1.00 54.23 H new ATOM 0 HD11 ILE A 55 17.134 27.584 -6.282 1.00 3.10 H new ATOM 0 HD12 ILE A 55 16.463 29.083 -5.597 1.00 3.10 H new ATOM 0 HD13 ILE A 55 15.474 28.083 -6.687 1.00 3.10 H new ATOM 778 N GLU A 56 16.577 31.559 -5.407 1.00 41.20 N ATOM 779 CA GLU A 56 16.943 31.559 -3.995 1.00 40.25 C ATOM 780 C GLU A 56 16.175 30.482 -3.235 1.00 25.15 C ATOM 781 O GLU A 56 14.999 30.653 -2.914 1.00 30.13 O ATOM 782 CB GLU A 56 16.669 32.931 -3.375 1.00 22.43 C ATOM 783 CG GLU A 56 17.925 33.752 -3.135 1.00 31.22 C ATOM 784 CD GLU A 56 17.631 35.229 -2.962 1.00 5.43 C ATOM 785 OE1 GLU A 56 16.740 35.745 -3.668 1.00 32.51 O ATOM 786 OE2 GLU A 56 18.294 35.870 -2.119 1.00 41.42 O ATOM 0 H GLU A 56 15.586 31.397 -5.586 1.00 41.20 H new ATOM 0 HA GLU A 56 18.009 31.341 -3.921 1.00 40.25 H new ATOM 0 HB2 GLU A 56 16.000 33.489 -4.030 1.00 22.43 H new ATOM 0 HB3 GLU A 56 16.148 32.795 -2.428 1.00 22.43 H new ATOM 0 HG2 GLU A 56 18.434 33.380 -2.246 1.00 31.22 H new ATOM 0 HG3 GLU A 56 18.609 33.617 -3.973 1.00 31.22 H new ATOM 793 N ILE A 57 16.850 29.373 -2.950 1.00 33.10 N ATOM 794 CA ILE A 57 16.232 28.268 -2.227 1.00 1.32 C ATOM 795 C ILE A 57 16.828 28.124 -0.831 1.00 21.43 C ATOM 796 O ILE A 57 18.029 28.310 -0.636 1.00 33.21 O ATOM 797 CB ILE A 57 16.398 26.937 -2.984 1.00 15.32 C ATOM 798 CG1 ILE A 57 15.955 25.766 -2.104 1.00 5.54 C ATOM 799 CG2 ILE A 57 17.841 26.757 -3.429 1.00 21.02 C ATOM 800 CD1 ILE A 57 14.495 25.822 -1.712 1.00 43.23 C ATOM 0 H ILE A 57 17.824 29.216 -3.209 1.00 33.10 H new ATOM 0 HA ILE A 57 15.170 28.499 -2.144 1.00 1.32 H new ATOM 0 HB ILE A 57 15.765 26.959 -3.871 1.00 15.32 H new ATOM 0 HG12 ILE A 57 16.145 24.832 -2.633 1.00 5.54 H new ATOM 0 HG13 ILE A 57 16.565 25.750 -1.201 1.00 5.54 H new ATOM 0 HG21 ILE A 57 17.942 25.812 -3.962 1.00 21.02 H new ATOM 0 HG22 ILE A 57 18.124 27.578 -4.088 1.00 21.02 H new ATOM 0 HG23 ILE A 57 18.493 26.752 -2.556 1.00 21.02 H new ATOM 0 HD11 ILE A 57 14.252 24.961 -1.089 1.00 43.23 H new ATOM 0 HD12 ILE A 57 14.303 26.739 -1.155 1.00 43.23 H new ATOM 0 HD13 ILE A 57 13.876 25.807 -2.609 1.00 43.23 H new ATOM 812 N GLU A 58 15.980 27.789 0.137 1.00 23.20 N ATOM 813 CA GLU A 58 16.424 27.618 1.515 1.00 4.04 C ATOM 814 C GLU A 58 15.479 26.698 2.282 1.00 73.44 C ATOM 815 O GLU A 58 14.404 26.348 1.793 1.00 1.42 O ATOM 816 CB GLU A 58 16.514 28.975 2.218 1.00 74.54 C ATOM 817 CG GLU A 58 17.815 29.713 1.953 1.00 61.41 C ATOM 818 CD GLU A 58 18.067 30.827 2.949 1.00 13.54 C ATOM 819 OE1 GLU A 58 17.382 31.868 2.862 1.00 71.10 O ATOM 820 OE2 GLU A 58 18.949 30.659 3.817 1.00 31.33 O ATOM 0 H GLU A 58 14.983 27.631 -0.008 1.00 23.20 H new ATOM 0 HA GLU A 58 17.413 27.160 1.496 1.00 4.04 H new ATOM 0 HB2 GLU A 58 15.680 29.598 1.894 1.00 74.54 H new ATOM 0 HB3 GLU A 58 16.403 28.826 3.292 1.00 74.54 H new ATOM 0 HG2 GLU A 58 18.643 29.005 1.988 1.00 61.41 H new ATOM 0 HG3 GLU A 58 17.794 30.129 0.946 1.00 61.41 H new ATOM 827 N SER A 59 15.887 26.308 3.485 1.00 64.11 N ATOM 828 CA SER A 59 15.080 25.425 4.318 1.00 74.44 C ATOM 829 C SER A 59 14.348 26.215 5.398 1.00 51.30 C ATOM 830 O SER A 59 14.911 27.126 6.005 1.00 45.21 O ATOM 831 CB SER A 59 15.959 24.352 4.962 1.00 30.54 C ATOM 832 OG SER A 59 15.661 24.208 6.340 1.00 32.03 O ATOM 0 H SER A 59 16.773 26.590 3.905 1.00 64.11 H new ATOM 0 HA SER A 59 14.339 24.943 3.681 1.00 74.44 H new ATOM 0 HB2 SER A 59 15.808 23.400 4.453 1.00 30.54 H new ATOM 0 HB3 SER A 59 17.009 24.616 4.840 1.00 30.54 H new ATOM 0 HG SER A 59 16.235 23.515 6.728 1.00 32.03 H new ATOM 838 N ARG A 60 13.089 25.860 5.632 1.00 31.12 N ATOM 839 CA ARG A 60 12.279 26.536 6.638 1.00 54.21 C ATOM 840 C ARG A 60 11.639 25.528 7.589 1.00 45.42 C ATOM 841 O ARG A 60 11.682 24.321 7.351 1.00 73.45 O ATOM 842 CB ARG A 60 11.193 27.379 5.966 1.00 1.44 C ATOM 843 CG ARG A 60 10.732 28.559 6.806 1.00 11.42 C ATOM 844 CD ARG A 60 9.997 29.590 5.963 1.00 21.20 C ATOM 845 NE ARG A 60 10.891 30.637 5.476 1.00 23.13 N ATOM 846 CZ ARG A 60 11.452 31.549 6.263 1.00 71.22 C ATOM 847 NH1 ARG A 60 11.212 31.542 7.567 1.00 63.22 N ATOM 848 NH2 ARG A 60 12.255 32.470 5.745 1.00 33.23 N ATOM 0 H ARG A 60 12.608 25.108 5.139 1.00 31.12 H new ATOM 0 HA ARG A 60 12.933 27.190 7.215 1.00 54.21 H new ATOM 0 HB2 ARG A 60 11.569 27.748 5.012 1.00 1.44 H new ATOM 0 HB3 ARG A 60 10.335 26.743 5.746 1.00 1.44 H new ATOM 0 HG2 ARG A 60 10.078 28.206 7.603 1.00 11.42 H new ATOM 0 HG3 ARG A 60 11.593 29.025 7.284 1.00 11.42 H new ATOM 0 HD2 ARG A 60 9.524 29.094 5.115 1.00 21.20 H new ATOM 0 HD3 ARG A 60 9.200 30.040 6.555 1.00 21.20 H new ATOM 0 HE ARG A 60 11.096 30.670 4.477 1.00 23.13 H new ATOM 0 HH11 ARG A 60 10.595 30.835 7.968 1.00 63.22 H new ATOM 0 HH12 ARG A 60 11.644 32.243 8.169 1.00 63.22 H new ATOM 0 HH21 ARG A 60 12.442 32.478 4.742 1.00 33.23 H new ATOM 0 HH22 ARG A 60 12.685 33.170 6.350 1.00 33.23 H new ATOM 862 N LEU A 61 11.049 26.032 8.667 1.00 55.35 N ATOM 863 CA LEU A 61 10.401 25.176 9.654 1.00 15.44 C ATOM 864 C LEU A 61 8.886 25.183 9.471 1.00 3.10 C ATOM 865 O LEU A 61 8.289 26.222 9.191 1.00 22.34 O ATOM 866 CB LEU A 61 10.756 25.637 11.069 1.00 44.00 C ATOM 867 CG LEU A 61 11.987 24.983 11.698 1.00 30.22 C ATOM 868 CD1 LEU A 61 11.809 23.474 11.775 1.00 43.44 C ATOM 869 CD2 LEU A 61 13.240 25.335 10.910 1.00 70.23 C ATOM 0 H LEU A 61 11.006 27.029 8.880 1.00 55.35 H new ATOM 0 HA LEU A 61 10.762 24.158 9.508 1.00 15.44 H new ATOM 0 HB2 LEU A 61 10.912 26.716 11.050 1.00 44.00 H new ATOM 0 HB3 LEU A 61 9.899 25.450 11.716 1.00 44.00 H new ATOM 0 HG LEU A 61 12.101 25.367 12.712 1.00 30.22 H new ATOM 0 HD11 LEU A 61 12.695 23.026 12.225 1.00 43.44 H new ATOM 0 HD12 LEU A 61 10.935 23.241 12.384 1.00 43.44 H new ATOM 0 HD13 LEU A 61 11.669 23.072 10.771 1.00 43.44 H new ATOM 0 HD21 LEU A 61 14.106 24.861 11.372 1.00 70.23 H new ATOM 0 HD22 LEU A 61 13.137 24.980 9.885 1.00 70.23 H new ATOM 0 HD23 LEU A 61 13.377 26.416 10.908 1.00 70.23 H new ATOM 881 N GLY A 62 8.270 24.016 9.633 1.00 64.23 N ATOM 882 CA GLY A 62 6.831 23.910 9.483 1.00 32.33 C ATOM 883 C GLY A 62 6.140 23.530 10.778 1.00 51.00 C ATOM 884 O GLY A 62 5.058 24.031 11.083 1.00 62.35 O ATOM 0 H GLY A 62 8.742 23.142 9.865 1.00 64.23 H new ATOM 0 HA2 GLY A 62 6.435 24.862 9.129 1.00 32.33 H new ATOM 0 HA3 GLY A 62 6.602 23.166 8.720 1.00 32.33 H new ATOM 888 N GLY A 63 6.766 22.640 11.542 1.00 11.13 N ATOM 889 CA GLY A 63 6.189 22.207 12.802 1.00 53.35 C ATOM 890 C GLY A 63 6.674 20.833 13.220 1.00 53.42 C ATOM 891 O GLY A 63 7.432 20.700 14.181 1.00 32.32 O ATOM 0 H GLY A 63 7.662 22.211 11.311 1.00 11.13 H new ATOM 0 HA2 GLY A 63 6.439 22.929 13.579 1.00 53.35 H new ATOM 0 HA3 GLY A 63 5.103 22.195 12.715 1.00 53.35 H new ATOM 895 N THR A 64 6.235 19.807 12.497 1.00 11.25 N ATOM 896 CA THR A 64 6.627 18.436 12.800 1.00 15.44 C ATOM 897 C THR A 64 6.045 17.461 11.784 1.00 72.04 C ATOM 898 O THR A 64 4.901 17.605 11.355 1.00 53.02 O ATOM 899 CB THR A 64 6.171 18.021 14.212 1.00 3.01 C ATOM 900 OG1 THR A 64 6.725 16.744 14.550 1.00 42.44 O ATOM 901 CG2 THR A 64 4.654 17.959 14.295 1.00 74.12 C ATOM 0 H THR A 64 5.608 19.900 11.698 1.00 11.25 H new ATOM 0 HA THR A 64 7.715 18.400 12.752 1.00 15.44 H new ATOM 0 HB THR A 64 6.527 18.770 14.919 1.00 3.01 H new ATOM 0 HG1 THR A 64 6.432 16.488 15.449 1.00 42.44 H new ATOM 0 HG21 THR A 64 4.356 17.664 15.301 1.00 74.12 H new ATOM 0 HG22 THR A 64 4.237 18.940 14.066 1.00 74.12 H new ATOM 0 HG23 THR A 64 4.280 17.229 13.577 1.00 74.12 H new ATOM 909 N GLY A 65 6.841 16.466 11.402 1.00 55.53 N ATOM 910 CA GLY A 65 6.386 15.481 10.438 1.00 1.12 C ATOM 911 C GLY A 65 5.605 16.103 9.298 1.00 72.33 C ATOM 912 O GLY A 65 4.556 15.593 8.904 1.00 24.51 O ATOM 0 H GLY A 65 7.792 16.325 11.743 1.00 55.53 H new ATOM 0 HA2 GLY A 65 7.247 14.947 10.036 1.00 1.12 H new ATOM 0 HA3 GLY A 65 5.761 14.745 10.943 1.00 1.12 H new ATOM 916 N ALA A 66 6.115 17.209 8.767 1.00 62.15 N ATOM 917 CA ALA A 66 5.458 17.901 7.664 1.00 23.45 C ATOM 918 C ALA A 66 6.396 18.046 6.471 1.00 72.34 C ATOM 919 O ALA A 66 7.576 17.704 6.550 1.00 72.50 O ATOM 920 CB ALA A 66 4.963 19.266 8.118 1.00 25.04 C ATOM 0 H ALA A 66 6.981 17.646 9.082 1.00 62.15 H new ATOM 0 HA ALA A 66 4.603 17.303 7.350 1.00 23.45 H new ATOM 0 HB1 ALA A 66 4.475 19.772 7.285 1.00 25.04 H new ATOM 0 HB2 ALA A 66 4.252 19.142 8.934 1.00 25.04 H new ATOM 0 HB3 ALA A 66 5.808 19.864 8.460 1.00 25.04 H new ATOM 926 N PHE A 67 5.863 18.554 5.364 1.00 2.34 N ATOM 927 CA PHE A 67 6.653 18.743 4.153 1.00 75.13 C ATOM 928 C PHE A 67 5.970 19.727 3.207 1.00 61.32 C ATOM 929 O PHE A 67 5.867 19.478 2.006 1.00 1.40 O ATOM 930 CB PHE A 67 6.868 17.403 3.445 1.00 12.42 C ATOM 931 CG PHE A 67 7.981 17.430 2.438 1.00 63.15 C ATOM 932 CD1 PHE A 67 9.303 17.487 2.848 1.00 64.43 C ATOM 933 CD2 PHE A 67 7.706 17.399 1.080 1.00 74.40 C ATOM 934 CE1 PHE A 67 10.331 17.511 1.923 1.00 34.31 C ATOM 935 CE2 PHE A 67 8.728 17.422 0.151 1.00 45.02 C ATOM 936 CZ PHE A 67 10.042 17.479 0.573 1.00 44.42 C ATOM 0 H PHE A 67 4.888 18.842 5.281 1.00 2.34 H new ATOM 0 HA PHE A 67 7.621 19.154 4.440 1.00 75.13 H new ATOM 0 HB2 PHE A 67 7.082 16.637 4.191 1.00 12.42 H new ATOM 0 HB3 PHE A 67 5.944 17.112 2.946 1.00 12.42 H new ATOM 0 HD1 PHE A 67 9.534 17.513 3.903 1.00 64.43 H new ATOM 0 HD2 PHE A 67 6.680 17.356 0.744 1.00 74.40 H new ATOM 0 HE1 PHE A 67 11.358 17.555 2.256 1.00 34.31 H new ATOM 0 HE2 PHE A 67 8.500 17.395 -0.904 1.00 45.02 H new ATOM 0 HZ PHE A 67 10.842 17.499 -0.152 1.00 44.42 H new ATOM 946 N GLU A 68 5.505 20.843 3.758 1.00 5.53 N ATOM 947 CA GLU A 68 4.832 21.864 2.964 1.00 34.10 C ATOM 948 C GLU A 68 5.816 22.568 2.034 1.00 31.42 C ATOM 949 O GLU A 68 6.797 23.159 2.485 1.00 24.11 O ATOM 950 CB GLU A 68 4.155 22.888 3.877 1.00 15.02 C ATOM 951 CG GLU A 68 2.911 22.357 4.571 1.00 63.02 C ATOM 952 CD GLU A 68 2.353 23.329 5.593 1.00 65.52 C ATOM 953 OE1 GLU A 68 2.341 24.545 5.309 1.00 24.22 O ATOM 954 OE2 GLU A 68 1.930 22.873 6.675 1.00 14.24 O ATOM 0 H GLU A 68 5.582 21.063 4.751 1.00 5.53 H new ATOM 0 HA GLU A 68 4.073 21.372 2.356 1.00 34.10 H new ATOM 0 HB2 GLU A 68 4.869 23.217 4.632 1.00 15.02 H new ATOM 0 HB3 GLU A 68 3.886 23.765 3.288 1.00 15.02 H new ATOM 0 HG2 GLU A 68 2.147 22.142 3.824 1.00 63.02 H new ATOM 0 HG3 GLU A 68 3.149 21.414 5.064 1.00 63.02 H new ATOM 961 N ILE A 69 5.546 22.498 0.735 1.00 41.40 N ATOM 962 CA ILE A 69 6.407 23.129 -0.258 1.00 71.31 C ATOM 963 C ILE A 69 5.963 24.560 -0.542 1.00 33.32 C ATOM 964 O ILE A 69 4.773 24.830 -0.704 1.00 22.41 O ATOM 965 CB ILE A 69 6.418 22.335 -1.578 1.00 41.42 C ATOM 966 CG1 ILE A 69 6.888 20.900 -1.332 1.00 12.20 C ATOM 967 CG2 ILE A 69 7.310 23.022 -2.601 1.00 42.33 C ATOM 968 CD1 ILE A 69 6.630 19.972 -2.498 1.00 33.41 C ATOM 0 H ILE A 69 4.739 22.011 0.346 1.00 41.40 H new ATOM 0 HA ILE A 69 7.414 23.140 0.159 1.00 71.31 H new ATOM 0 HB ILE A 69 5.403 22.302 -1.973 1.00 41.42 H new ATOM 0 HG12 ILE A 69 7.956 20.908 -1.114 1.00 12.20 H new ATOM 0 HG13 ILE A 69 6.385 20.508 -0.448 1.00 12.20 H new ATOM 0 HG21 ILE A 69 7.308 22.449 -3.528 1.00 42.33 H new ATOM 0 HG22 ILE A 69 6.935 24.027 -2.794 1.00 42.33 H new ATOM 0 HG23 ILE A 69 8.327 23.082 -2.214 1.00 42.33 H new ATOM 0 HD11 ILE A 69 6.989 18.972 -2.253 1.00 33.41 H new ATOM 0 HD12 ILE A 69 5.560 19.934 -2.703 1.00 33.41 H new ATOM 0 HD13 ILE A 69 7.155 20.340 -3.379 1.00 33.41 H new ATOM 980 N GLU A 70 6.928 25.472 -0.602 1.00 15.21 N ATOM 981 CA GLU A 70 6.635 26.876 -0.867 1.00 60.13 C ATOM 982 C GLU A 70 7.486 27.400 -2.020 1.00 40.43 C ATOM 983 O GLU A 70 8.627 27.820 -1.823 1.00 14.24 O ATOM 984 CB GLU A 70 6.881 27.717 0.387 1.00 45.22 C ATOM 985 CG GLU A 70 6.218 27.159 1.634 1.00 34.14 C ATOM 986 CD GLU A 70 5.929 28.228 2.670 1.00 40.41 C ATOM 987 OE1 GLU A 70 6.869 28.626 3.389 1.00 25.23 O ATOM 988 OE2 GLU A 70 4.764 28.668 2.761 1.00 32.42 O ATOM 0 H GLU A 70 7.918 25.265 -0.471 1.00 15.21 H new ATOM 0 HA GLU A 70 5.585 26.955 -1.148 1.00 60.13 H new ATOM 0 HB2 GLU A 70 7.955 27.792 0.559 1.00 45.22 H new ATOM 0 HB3 GLU A 70 6.515 28.729 0.213 1.00 45.22 H new ATOM 0 HG2 GLU A 70 5.286 26.667 1.356 1.00 34.14 H new ATOM 0 HG3 GLU A 70 6.862 26.397 2.073 1.00 34.14 H new ATOM 995 N ILE A 71 6.923 27.372 -3.224 1.00 3.24 N ATOM 996 CA ILE A 71 7.629 27.845 -4.408 1.00 25.12 C ATOM 997 C ILE A 71 7.819 29.357 -4.368 1.00 14.51 C ATOM 998 O ILE A 71 8.698 29.901 -5.034 1.00 63.14 O ATOM 999 CB ILE A 71 6.880 27.466 -5.699 1.00 12.41 C ATOM 1000 CG1 ILE A 71 7.636 27.985 -6.924 1.00 55.00 C ATOM 1001 CG2 ILE A 71 5.463 28.020 -5.670 1.00 70.12 C ATOM 1002 CD1 ILE A 71 9.072 27.516 -6.991 1.00 2.31 C ATOM 0 H ILE A 71 5.980 27.027 -3.405 1.00 3.24 H new ATOM 0 HA ILE A 71 8.605 27.359 -4.408 1.00 25.12 H new ATOM 0 HB ILE A 71 6.824 26.379 -5.764 1.00 12.41 H new ATOM 0 HG12 ILE A 71 7.115 27.663 -7.826 1.00 55.00 H new ATOM 0 HG13 ILE A 71 7.618 29.075 -6.917 1.00 55.00 H new ATOM 0 HG21 ILE A 71 4.946 27.744 -6.589 1.00 70.12 H new ATOM 0 HG22 ILE A 71 4.928 27.607 -4.815 1.00 70.12 H new ATOM 0 HG23 ILE A 71 5.499 29.106 -5.586 1.00 70.12 H new ATOM 0 HD11 ILE A 71 9.546 27.922 -7.885 1.00 2.31 H new ATOM 0 HD12 ILE A 71 9.609 27.860 -6.107 1.00 2.31 H new ATOM 0 HD13 ILE A 71 9.098 26.427 -7.030 1.00 2.31 H new ATOM 1014 N ASN A 72 6.987 30.032 -3.580 1.00 62.30 N ATOM 1015 CA ASN A 72 7.064 31.482 -3.452 1.00 15.44 C ATOM 1016 C ASN A 72 6.884 31.910 -1.998 1.00 52.12 C ATOM 1017 O ASN A 72 6.334 32.974 -1.717 1.00 4.24 O ATOM 1018 CB ASN A 72 6.000 32.149 -4.326 1.00 40.34 C ATOM 1019 CG ASN A 72 6.473 32.361 -5.751 1.00 44.25 C ATOM 1020 OD1 ASN A 72 6.702 33.493 -6.180 1.00 23.44 O ATOM 1021 ND2 ASN A 72 6.622 31.270 -6.494 1.00 1.22 N ATOM 0 H ASN A 72 6.253 29.598 -3.021 1.00 62.30 H new ATOM 0 HA ASN A 72 8.052 31.799 -3.787 1.00 15.44 H new ATOM 0 HB2 ASN A 72 5.101 31.533 -4.332 1.00 40.34 H new ATOM 0 HB3 ASN A 72 5.726 33.110 -3.890 1.00 40.34 H new ATOM 0 HD21 ASN A 72 6.938 31.350 -7.461 1.00 1.22 H new ATOM 0 HD22 ASN A 72 6.421 30.352 -6.098 1.00 1.22 H new ATOM 1028 N GLY A 73 7.352 31.072 -1.078 1.00 0.20 N ATOM 1029 CA GLY A 73 7.234 31.381 0.335 1.00 21.11 C ATOM 1030 C GLY A 73 5.880 31.000 0.901 1.00 42.24 C ATOM 1031 O GLY A 73 5.664 31.071 2.110 1.00 23.11 O ATOM 0 H GLY A 73 7.811 30.185 -1.286 1.00 0.20 H new ATOM 0 HA2 GLY A 73 8.015 30.856 0.885 1.00 21.11 H new ATOM 0 HA3 GLY A 73 7.400 32.448 0.486 1.00 21.11 H new ATOM 1035 N GLN A 74 4.966 30.597 0.024 1.00 44.33 N ATOM 1036 CA GLN A 74 3.626 30.207 0.443 1.00 33.43 C ATOM 1037 C GLN A 74 3.318 28.775 0.018 1.00 74.12 C ATOM 1038 O GLN A 74 3.819 28.297 -1.001 1.00 10.21 O ATOM 1039 CB GLN A 74 2.586 31.161 -0.146 1.00 13.34 C ATOM 1040 CG GLN A 74 2.684 32.578 0.397 1.00 35.24 C ATOM 1041 CD GLN A 74 2.063 33.603 -0.531 1.00 32.11 C ATOM 1042 OE1 GLN A 74 1.076 34.254 -0.185 1.00 63.21 O ATOM 1043 NE2 GLN A 74 2.639 33.752 -1.718 1.00 53.41 N ATOM 0 H GLN A 74 5.130 30.532 -0.981 1.00 44.33 H new ATOM 0 HA GLN A 74 3.583 30.261 1.531 1.00 33.43 H new ATOM 0 HB2 GLN A 74 2.701 31.187 -1.230 1.00 13.34 H new ATOM 0 HB3 GLN A 74 1.589 30.770 0.059 1.00 13.34 H new ATOM 0 HG2 GLN A 74 2.190 32.626 1.368 1.00 35.24 H new ATOM 0 HG3 GLN A 74 3.732 32.829 0.560 1.00 35.24 H new ATOM 0 HE21 GLN A 74 3.455 33.191 -1.963 1.00 53.41 H new ATOM 0 HE22 GLN A 74 2.265 34.427 -2.385 1.00 53.41 H new ATOM 1052 N LEU A 75 2.491 28.094 0.804 1.00 53.42 N ATOM 1053 CA LEU A 75 2.115 26.716 0.509 1.00 65.13 C ATOM 1054 C LEU A 75 1.347 26.630 -0.806 1.00 51.21 C ATOM 1055 O LEU A 75 0.283 27.232 -0.956 1.00 22.51 O ATOM 1056 CB LEU A 75 1.268 26.142 1.646 1.00 4.51 C ATOM 1057 CG LEU A 75 0.914 24.659 1.537 1.00 24.12 C ATOM 1058 CD1 LEU A 75 2.170 23.824 1.341 1.00 31.50 C ATOM 1059 CD2 LEU A 75 0.154 24.200 2.773 1.00 51.12 C ATOM 0 H LEU A 75 2.068 28.474 1.651 1.00 53.42 H new ATOM 0 HA LEU A 75 3.029 26.129 0.414 1.00 65.13 H new ATOM 0 HB2 LEU A 75 1.800 26.300 2.584 1.00 4.51 H new ATOM 0 HB3 LEU A 75 0.341 26.713 1.706 1.00 4.51 H new ATOM 0 HG LEU A 75 0.271 24.521 0.668 1.00 24.12 H new ATOM 0 HD11 LEU A 75 1.899 22.771 1.265 1.00 31.50 H new ATOM 0 HD12 LEU A 75 2.675 24.135 0.426 1.00 31.50 H new ATOM 0 HD13 LEU A 75 2.838 23.967 2.191 1.00 31.50 H new ATOM 0 HD21 LEU A 75 -0.090 23.142 2.678 1.00 51.12 H new ATOM 0 HD22 LEU A 75 0.772 24.352 3.658 1.00 51.12 H new ATOM 0 HD23 LEU A 75 -0.766 24.777 2.870 1.00 51.12 H new ATOM 1071 N VAL A 76 1.892 25.877 -1.756 1.00 72.02 N ATOM 1072 CA VAL A 76 1.256 25.709 -3.058 1.00 1.45 C ATOM 1073 C VAL A 76 0.899 24.249 -3.311 1.00 11.13 C ATOM 1074 O VAL A 76 -0.022 23.947 -4.070 1.00 20.41 O ATOM 1075 CB VAL A 76 2.166 26.209 -4.195 1.00 64.43 C ATOM 1076 CG1 VAL A 76 2.234 27.728 -4.198 1.00 12.12 C ATOM 1077 CG2 VAL A 76 3.557 25.605 -4.068 1.00 50.21 C ATOM 0 H VAL A 76 2.773 25.373 -1.649 1.00 72.02 H new ATOM 0 HA VAL A 76 0.344 26.305 -3.044 1.00 1.45 H new ATOM 0 HB VAL A 76 1.740 25.888 -5.145 1.00 64.43 H new ATOM 0 HG11 VAL A 76 2.882 28.062 -5.009 1.00 12.12 H new ATOM 0 HG12 VAL A 76 1.234 28.137 -4.341 1.00 12.12 H new ATOM 0 HG13 VAL A 76 2.635 28.076 -3.246 1.00 12.12 H new ATOM 0 HG21 VAL A 76 4.187 25.969 -4.880 1.00 50.21 H new ATOM 0 HG22 VAL A 76 3.993 25.894 -3.112 1.00 50.21 H new ATOM 0 HG23 VAL A 76 3.488 24.518 -4.121 1.00 50.21 H new ATOM 1087 N PHE A 77 1.634 23.346 -2.669 1.00 55.34 N ATOM 1088 CA PHE A 77 1.395 21.916 -2.825 1.00 52.11 C ATOM 1089 C PHE A 77 1.923 21.142 -1.621 1.00 1.32 C ATOM 1090 O PHE A 77 3.113 20.837 -1.539 1.00 33.12 O ATOM 1091 CB PHE A 77 2.057 21.403 -4.106 1.00 3.45 C ATOM 1092 CG PHE A 77 1.260 21.684 -5.347 1.00 12.31 C ATOM 1093 CD1 PHE A 77 0.058 21.034 -5.576 1.00 40.12 C ATOM 1094 CD2 PHE A 77 1.712 22.598 -6.285 1.00 4.21 C ATOM 1095 CE1 PHE A 77 -0.679 21.291 -6.717 1.00 65.54 C ATOM 1096 CE2 PHE A 77 0.980 22.859 -7.428 1.00 0.04 C ATOM 1097 CZ PHE A 77 -0.216 22.204 -7.645 1.00 32.52 C ATOM 0 H PHE A 77 2.399 23.579 -2.036 1.00 55.34 H new ATOM 0 HA PHE A 77 0.319 21.758 -2.893 1.00 52.11 H new ATOM 0 HB2 PHE A 77 3.041 21.860 -4.205 1.00 3.45 H new ATOM 0 HB3 PHE A 77 2.212 20.328 -4.019 1.00 3.45 H new ATOM 0 HD1 PHE A 77 -0.307 20.318 -4.855 1.00 40.12 H new ATOM 0 HD2 PHE A 77 2.647 23.113 -6.121 1.00 4.21 H new ATOM 0 HE1 PHE A 77 -1.615 20.779 -6.883 1.00 65.54 H new ATOM 0 HE2 PHE A 77 1.343 23.575 -8.151 1.00 0.04 H new ATOM 0 HZ PHE A 77 -0.789 22.405 -8.538 1.00 32.52 H new ATOM 1107 N SER A 78 1.030 20.829 -0.688 1.00 35.00 N ATOM 1108 CA SER A 78 1.405 20.095 0.515 1.00 62.24 C ATOM 1109 C SER A 78 1.589 18.611 0.210 1.00 13.12 C ATOM 1110 O SER A 78 0.989 18.078 -0.723 1.00 73.52 O ATOM 1111 CB SER A 78 0.344 20.277 1.601 1.00 32.42 C ATOM 1112 OG SER A 78 -0.352 21.500 1.435 1.00 3.12 O ATOM 0 H SER A 78 0.041 21.072 -0.742 1.00 35.00 H new ATOM 0 HA SER A 78 2.353 20.495 0.874 1.00 62.24 H new ATOM 0 HB2 SER A 78 -0.361 19.446 1.568 1.00 32.42 H new ATOM 0 HB3 SER A 78 0.817 20.255 2.583 1.00 32.42 H new ATOM 0 HG SER A 78 -1.207 21.457 1.912 1.00 3.12 H new ATOM 1118 N LYS A 79 2.423 17.949 1.005 1.00 50.40 N ATOM 1119 CA LYS A 79 2.687 16.527 0.824 1.00 73.23 C ATOM 1120 C LYS A 79 1.988 15.702 1.900 1.00 54.41 C ATOM 1121 O LYS A 79 1.943 14.474 1.824 1.00 75.21 O ATOM 1122 CB LYS A 79 4.193 16.258 0.858 1.00 32.12 C ATOM 1123 CG LYS A 79 4.809 16.070 -0.517 1.00 52.14 C ATOM 1124 CD LYS A 79 4.725 17.342 -1.344 1.00 74.15 C ATOM 1125 CE LYS A 79 4.693 17.037 -2.834 1.00 71.12 C ATOM 1126 NZ LYS A 79 5.987 16.478 -3.314 1.00 4.23 N ATOM 0 H LYS A 79 2.928 18.376 1.782 1.00 50.40 H new ATOM 0 HA LYS A 79 2.293 16.231 -0.148 1.00 73.23 H new ATOM 0 HB2 LYS A 79 4.691 17.088 1.359 1.00 32.12 H new ATOM 0 HB3 LYS A 79 4.381 15.366 1.456 1.00 32.12 H new ATOM 0 HG2 LYS A 79 5.852 15.772 -0.412 1.00 52.14 H new ATOM 0 HG3 LYS A 79 4.297 15.261 -1.039 1.00 52.14 H new ATOM 0 HD2 LYS A 79 3.830 17.899 -1.066 1.00 74.15 H new ATOM 0 HD3 LYS A 79 5.580 17.980 -1.120 1.00 74.15 H new ATOM 0 HE2 LYS A 79 3.892 16.328 -3.042 1.00 71.12 H new ATOM 0 HE3 LYS A 79 4.464 17.948 -3.386 1.00 71.12 H new ATOM 0 HZ1 LYS A 79 5.854 16.051 -4.253 1.00 4.23 H new ATOM 0 HZ2 LYS A 79 6.692 17.240 -3.377 1.00 4.23 H new ATOM 0 HZ3 LYS A 79 6.320 15.752 -2.648 1.00 4.23 H new ATOM 1140 N LEU A 80 1.442 16.385 2.901 1.00 44.14 N ATOM 1141 CA LEU A 80 0.743 15.716 3.992 1.00 24.32 C ATOM 1142 C LEU A 80 -0.679 15.347 3.583 1.00 61.30 C ATOM 1143 O LEU A 80 -1.341 14.554 4.252 1.00 12.51 O ATOM 1144 CB LEU A 80 0.713 16.613 5.231 1.00 65.41 C ATOM 1145 CG LEU A 80 2.053 16.826 5.937 1.00 14.34 C ATOM 1146 CD1 LEU A 80 1.868 17.675 7.186 1.00 20.30 C ATOM 1147 CD2 LEU A 80 2.690 15.490 6.288 1.00 31.40 C ATOM 0 H LEU A 80 1.470 17.402 2.979 1.00 44.14 H new ATOM 0 HA LEU A 80 1.283 14.799 4.228 1.00 24.32 H new ATOM 0 HB2 LEU A 80 0.319 17.587 4.941 1.00 65.41 H new ATOM 0 HB3 LEU A 80 0.011 16.186 5.947 1.00 65.41 H new ATOM 0 HG LEU A 80 2.720 17.356 5.257 1.00 14.34 H new ATOM 0 HD11 LEU A 80 2.831 17.816 7.676 1.00 20.30 H new ATOM 0 HD12 LEU A 80 1.456 18.645 6.909 1.00 20.30 H new ATOM 0 HD13 LEU A 80 1.184 17.172 7.870 1.00 20.30 H new ATOM 0 HD21 LEU A 80 3.642 15.662 6.790 1.00 31.40 H new ATOM 0 HD22 LEU A 80 2.027 14.933 6.950 1.00 31.40 H new ATOM 0 HD23 LEU A 80 2.858 14.916 5.376 1.00 31.40 H new ATOM 1159 N GLU A 81 -1.141 15.925 2.479 1.00 45.43 N ATOM 1160 CA GLU A 81 -2.484 15.656 1.980 1.00 30.41 C ATOM 1161 C GLU A 81 -2.447 14.645 0.837 1.00 15.03 C ATOM 1162 O GLU A 81 -3.201 13.673 0.830 1.00 32.23 O ATOM 1163 CB GLU A 81 -3.147 16.952 1.509 1.00 62.44 C ATOM 1164 CG GLU A 81 -2.317 17.727 0.499 1.00 75.13 C ATOM 1165 CD GLU A 81 -2.892 19.098 0.202 1.00 55.24 C ATOM 1166 OE1 GLU A 81 -4.053 19.351 0.588 1.00 21.34 O ATOM 1167 OE2 GLU A 81 -2.183 19.918 -0.418 1.00 11.25 O ATOM 0 H GLU A 81 -0.605 16.583 1.913 1.00 45.43 H new ATOM 0 HA GLU A 81 -3.070 15.234 2.797 1.00 30.41 H new ATOM 0 HB2 GLU A 81 -4.115 16.715 1.067 1.00 62.44 H new ATOM 0 HB3 GLU A 81 -3.339 17.588 2.374 1.00 62.44 H new ATOM 0 HG2 GLU A 81 -1.301 17.837 0.878 1.00 75.13 H new ATOM 0 HG3 GLU A 81 -2.252 17.156 -0.427 1.00 75.13 H new ATOM 1174 N ASN A 82 -1.565 14.884 -0.128 1.00 33.32 N ATOM 1175 CA ASN A 82 -1.431 13.996 -1.277 1.00 24.32 C ATOM 1176 C ASN A 82 -0.937 12.618 -0.845 1.00 15.03 C ATOM 1177 O ASN A 82 -1.600 11.608 -1.080 1.00 2.24 O ATOM 1178 CB ASN A 82 -0.467 14.596 -2.302 1.00 5.53 C ATOM 1179 CG ASN A 82 -0.529 13.886 -3.640 1.00 51.11 C ATOM 1180 OD1 ASN A 82 -1.156 14.369 -4.583 1.00 50.21 O ATOM 1181 ND2 ASN A 82 0.122 12.732 -3.728 1.00 44.33 N ATOM 0 H ASN A 82 -0.933 15.684 -0.137 1.00 33.32 H new ATOM 0 HA ASN A 82 -2.414 13.884 -1.734 1.00 24.32 H new ATOM 0 HB2 ASN A 82 -0.701 15.651 -2.443 1.00 5.53 H new ATOM 0 HB3 ASN A 82 0.550 14.545 -1.913 1.00 5.53 H new ATOM 0 HD21 ASN A 82 0.115 12.208 -4.603 1.00 44.33 H new ATOM 0 HD22 ASN A 82 0.629 12.369 -2.920 1.00 44.33 H new ATOM 1188 N GLY A 83 0.231 12.586 -0.211 1.00 32.53 N ATOM 1189 CA GLY A 83 0.793 11.327 0.245 1.00 51.52 C ATOM 1190 C GLY A 83 2.304 11.374 0.356 1.00 51.00 C ATOM 1191 O GLY A 83 2.908 10.552 1.044 1.00 44.25 O ATOM 0 H GLY A 83 0.798 13.408 -0.005 1.00 32.53 H new ATOM 0 HA2 GLY A 83 0.368 11.073 1.216 1.00 51.52 H new ATOM 0 HA3 GLY A 83 0.507 10.533 -0.445 1.00 51.52 H new ATOM 1195 N GLY A 84 2.917 12.338 -0.324 1.00 53.24 N ATOM 1196 CA GLY A 84 4.361 12.469 -0.287 1.00 44.50 C ATOM 1197 C GLY A 84 5.021 11.982 -1.562 1.00 21.23 C ATOM 1198 O GLY A 84 4.414 12.006 -2.632 1.00 54.33 O ATOM 0 H GLY A 84 2.439 13.031 -0.900 1.00 53.24 H new ATOM 0 HA2 GLY A 84 4.624 13.514 -0.122 1.00 44.50 H new ATOM 0 HA3 GLY A 84 4.752 11.904 0.559 1.00 44.50 H new ATOM 1202 N PHE A 85 6.269 11.539 -1.448 1.00 72.33 N ATOM 1203 CA PHE A 85 7.013 11.046 -2.601 1.00 73.45 C ATOM 1204 C PHE A 85 7.227 12.156 -3.626 1.00 0.12 C ATOM 1205 O PHE A 85 6.675 12.135 -4.726 1.00 44.13 O ATOM 1206 CB PHE A 85 6.272 9.874 -3.250 1.00 3.11 C ATOM 1207 CG PHE A 85 7.181 8.906 -3.953 1.00 15.21 C ATOM 1208 CD1 PHE A 85 8.221 8.293 -3.273 1.00 52.34 C ATOM 1209 CD2 PHE A 85 6.994 8.610 -5.294 1.00 22.24 C ATOM 1210 CE1 PHE A 85 9.058 7.402 -3.917 1.00 63.12 C ATOM 1211 CE2 PHE A 85 7.828 7.719 -5.942 1.00 61.15 C ATOM 1212 CZ PHE A 85 8.862 7.115 -5.254 1.00 1.11 C ATOM 0 H PHE A 85 6.786 11.511 -0.569 1.00 72.33 H new ATOM 0 HA PHE A 85 7.988 10.704 -2.253 1.00 73.45 H new ATOM 0 HB2 PHE A 85 5.709 9.341 -2.484 1.00 3.11 H new ATOM 0 HB3 PHE A 85 5.547 10.264 -3.964 1.00 3.11 H new ATOM 0 HD1 PHE A 85 8.379 8.514 -2.228 1.00 52.34 H new ATOM 0 HD2 PHE A 85 6.188 9.080 -5.838 1.00 22.24 H new ATOM 0 HE1 PHE A 85 9.865 6.930 -3.376 1.00 63.12 H new ATOM 0 HE2 PHE A 85 7.671 7.495 -6.987 1.00 61.15 H new ATOM 0 HZ PHE A 85 9.516 6.420 -5.760 1.00 1.11 H new ATOM 1222 N PRO A 86 8.047 13.151 -3.256 1.00 64.13 N ATOM 1223 CA PRO A 86 8.354 14.289 -4.128 1.00 10.12 C ATOM 1224 C PRO A 86 9.216 13.890 -5.321 1.00 14.01 C ATOM 1225 O PRO A 86 9.777 12.795 -5.355 1.00 24.13 O ATOM 1226 CB PRO A 86 9.122 15.243 -3.209 1.00 33.31 C ATOM 1227 CG PRO A 86 9.718 14.364 -2.164 1.00 61.11 C ATOM 1228 CD PRO A 86 8.739 13.241 -1.960 1.00 23.25 C ATOM 0 HA PRO A 86 7.454 14.725 -4.561 1.00 10.12 H new ATOM 0 HB2 PRO A 86 9.893 15.786 -3.757 1.00 33.31 H new ATOM 0 HB3 PRO A 86 8.459 15.988 -2.769 1.00 33.31 H new ATOM 0 HG2 PRO A 86 10.688 13.983 -2.482 1.00 61.11 H new ATOM 0 HG3 PRO A 86 9.880 14.914 -1.237 1.00 61.11 H new ATOM 0 HD2 PRO A 86 9.244 12.308 -1.709 1.00 23.25 H new ATOM 0 HD3 PRO A 86 8.045 13.456 -1.148 1.00 23.25 H new ATOM 1236 N TYR A 87 9.316 14.785 -6.298 1.00 30.34 N ATOM 1237 CA TYR A 87 10.108 14.525 -7.494 1.00 20.42 C ATOM 1238 C TYR A 87 11.123 15.640 -7.728 1.00 74.45 C ATOM 1239 O TYR A 87 10.863 16.803 -7.424 1.00 2.13 O ATOM 1240 CB TYR A 87 9.196 14.384 -8.714 1.00 44.41 C ATOM 1241 CG TYR A 87 8.105 13.353 -8.539 1.00 61.42 C ATOM 1242 CD1 TYR A 87 8.368 11.999 -8.706 1.00 25.31 C ATOM 1243 CD2 TYR A 87 6.810 13.732 -8.206 1.00 64.12 C ATOM 1244 CE1 TYR A 87 7.374 11.053 -8.548 1.00 22.21 C ATOM 1245 CE2 TYR A 87 5.810 12.793 -8.045 1.00 22.23 C ATOM 1246 CZ TYR A 87 6.097 11.455 -8.217 1.00 71.31 C ATOM 1247 OH TYR A 87 5.104 10.515 -8.057 1.00 50.44 O ATOM 0 H TYR A 87 8.858 15.697 -6.285 1.00 30.34 H new ATOM 0 HA TYR A 87 10.650 13.591 -7.345 1.00 20.42 H new ATOM 0 HB2 TYR A 87 8.740 15.350 -8.930 1.00 44.41 H new ATOM 0 HB3 TYR A 87 9.801 14.117 -9.580 1.00 44.41 H new ATOM 0 HD1 TYR A 87 9.367 11.681 -8.964 1.00 25.31 H new ATOM 0 HD2 TYR A 87 6.582 14.779 -8.071 1.00 64.12 H new ATOM 0 HE1 TYR A 87 7.596 10.005 -8.683 1.00 22.21 H new ATOM 0 HE2 TYR A 87 4.809 13.105 -7.786 1.00 22.23 H new ATOM 0 HH TYR A 87 4.264 10.963 -7.824 1.00 50.44 H new ATOM 1257 N GLU A 88 12.279 15.274 -8.273 1.00 71.31 N ATOM 1258 CA GLU A 88 13.333 16.243 -8.549 1.00 21.42 C ATOM 1259 C GLU A 88 12.913 17.202 -9.658 1.00 43.53 C ATOM 1260 O GLU A 88 13.458 18.299 -9.786 1.00 1.23 O ATOM 1261 CB GLU A 88 14.626 15.525 -8.942 1.00 71.24 C ATOM 1262 CG GLU A 88 14.460 14.569 -10.112 1.00 35.13 C ATOM 1263 CD GLU A 88 15.787 14.124 -10.695 1.00 13.02 C ATOM 1264 OE1 GLU A 88 16.795 14.828 -10.481 1.00 4.05 O ATOM 1265 OE2 GLU A 88 15.816 13.071 -11.366 1.00 30.14 O ATOM 0 H GLU A 88 12.509 14.315 -8.532 1.00 71.31 H new ATOM 0 HA GLU A 88 13.508 16.820 -7.641 1.00 21.42 H new ATOM 0 HB2 GLU A 88 15.382 16.268 -9.196 1.00 71.24 H new ATOM 0 HB3 GLU A 88 15.000 14.971 -8.081 1.00 71.24 H new ATOM 0 HG2 GLU A 88 13.900 13.693 -9.784 1.00 35.13 H new ATOM 0 HG3 GLU A 88 13.869 15.052 -10.890 1.00 35.13 H new ATOM 1272 N LYS A 89 11.941 16.782 -10.460 1.00 70.51 N ATOM 1273 CA LYS A 89 11.446 17.602 -11.559 1.00 72.11 C ATOM 1274 C LYS A 89 10.225 18.409 -11.129 1.00 2.04 C ATOM 1275 O LYS A 89 9.961 19.486 -11.664 1.00 21.14 O ATOM 1276 CB LYS A 89 11.091 16.722 -12.760 1.00 30.02 C ATOM 1277 CG LYS A 89 9.857 15.863 -12.541 1.00 45.12 C ATOM 1278 CD LYS A 89 9.864 14.639 -13.441 1.00 30.53 C ATOM 1279 CE LYS A 89 10.677 13.505 -12.834 1.00 12.34 C ATOM 1280 NZ LYS A 89 9.869 12.689 -11.886 1.00 73.10 N ATOM 0 H LYS A 89 11.480 15.877 -10.369 1.00 70.51 H new ATOM 0 HA LYS A 89 12.236 18.296 -11.845 1.00 72.11 H new ATOM 0 HB2 LYS A 89 10.931 17.358 -13.631 1.00 30.02 H new ATOM 0 HB3 LYS A 89 11.938 16.075 -12.989 1.00 30.02 H new ATOM 0 HG2 LYS A 89 9.811 15.549 -11.498 1.00 45.12 H new ATOM 0 HG3 LYS A 89 8.962 16.454 -12.735 1.00 45.12 H new ATOM 0 HD2 LYS A 89 8.840 14.304 -13.610 1.00 30.53 H new ATOM 0 HD3 LYS A 89 10.277 14.904 -14.414 1.00 30.53 H new ATOM 0 HE2 LYS A 89 11.059 12.865 -13.630 1.00 12.34 H new ATOM 0 HE3 LYS A 89 11.542 13.916 -12.313 1.00 12.34 H new ATOM 0 HZ1 LYS A 89 10.483 12.326 -11.130 1.00 73.10 H new ATOM 0 HZ2 LYS A 89 9.121 13.279 -11.470 1.00 73.10 H new ATOM 0 HZ3 LYS A 89 9.438 11.891 -12.395 1.00 73.10 H new ATOM 1294 N ASP A 90 9.486 17.883 -10.159 1.00 32.44 N ATOM 1295 CA ASP A 90 8.294 18.556 -9.654 1.00 64.34 C ATOM 1296 C ASP A 90 8.672 19.701 -8.720 1.00 53.01 C ATOM 1297 O ASP A 90 7.858 20.582 -8.440 1.00 35.11 O ATOM 1298 CB ASP A 90 7.391 17.561 -8.923 1.00 65.03 C ATOM 1299 CG ASP A 90 6.205 18.234 -8.261 1.00 43.13 C ATOM 1300 OD1 ASP A 90 5.183 18.442 -8.947 1.00 40.52 O ATOM 1301 OD2 ASP A 90 6.300 18.553 -7.057 1.00 54.23 O ATOM 0 H ASP A 90 9.691 16.992 -9.706 1.00 32.44 H new ATOM 0 HA ASP A 90 7.752 18.969 -10.505 1.00 64.34 H new ATOM 0 HB2 ASP A 90 7.033 16.813 -9.630 1.00 65.03 H new ATOM 0 HB3 ASP A 90 7.973 17.033 -8.168 1.00 65.03 H new ATOM 1306 N LEU A 91 9.910 19.682 -8.240 1.00 2.31 N ATOM 1307 CA LEU A 91 10.396 20.719 -7.336 1.00 31.14 C ATOM 1308 C LEU A 91 11.148 21.802 -8.102 1.00 61.25 C ATOM 1309 O LEU A 91 11.362 22.902 -7.593 1.00 14.22 O ATOM 1310 CB LEU A 91 11.306 20.107 -6.269 1.00 43.32 C ATOM 1311 CG LEU A 91 10.602 19.407 -5.106 1.00 51.45 C ATOM 1312 CD1 LEU A 91 11.430 18.232 -4.611 1.00 34.23 C ATOM 1313 CD2 LEU A 91 10.336 20.390 -3.975 1.00 71.40 C ATOM 0 H LEU A 91 10.596 18.960 -8.461 1.00 2.31 H new ATOM 0 HA LEU A 91 9.534 21.177 -6.851 1.00 31.14 H new ATOM 0 HB2 LEU A 91 11.967 19.388 -6.753 1.00 43.32 H new ATOM 0 HB3 LEU A 91 11.938 20.897 -5.862 1.00 43.32 H new ATOM 0 HG LEU A 91 9.645 19.026 -5.461 1.00 51.45 H new ATOM 0 HD11 LEU A 91 10.913 17.746 -3.783 1.00 34.23 H new ATOM 0 HD12 LEU A 91 11.569 17.517 -5.422 1.00 34.23 H new ATOM 0 HD13 LEU A 91 12.402 18.589 -4.272 1.00 34.23 H new ATOM 0 HD21 LEU A 91 9.834 19.875 -3.156 1.00 71.40 H new ATOM 0 HD22 LEU A 91 11.281 20.801 -3.621 1.00 71.40 H new ATOM 0 HD23 LEU A 91 9.702 21.199 -4.338 1.00 71.40 H new ATOM 1325 N ILE A 92 11.545 21.483 -9.330 1.00 22.13 N ATOM 1326 CA ILE A 92 12.270 22.430 -10.168 1.00 23.14 C ATOM 1327 C ILE A 92 11.361 23.027 -11.236 1.00 13.32 C ATOM 1328 O ILE A 92 11.604 24.129 -11.726 1.00 44.14 O ATOM 1329 CB ILE A 92 13.479 21.765 -10.852 1.00 42.11 C ATOM 1330 CG1 ILE A 92 14.377 22.826 -11.493 1.00 72.51 C ATOM 1331 CG2 ILE A 92 13.011 20.759 -11.893 1.00 44.55 C ATOM 1332 CD1 ILE A 92 15.849 22.479 -11.448 1.00 14.02 C ATOM 0 H ILE A 92 11.377 20.576 -9.766 1.00 22.13 H new ATOM 0 HA ILE A 92 12.625 23.224 -9.512 1.00 23.14 H new ATOM 0 HB ILE A 92 14.059 21.234 -10.097 1.00 42.11 H new ATOM 0 HG12 ILE A 92 14.076 22.966 -12.531 1.00 72.51 H new ATOM 0 HG13 ILE A 92 14.221 23.778 -10.985 1.00 72.51 H new ATOM 0 HG21 ILE A 92 13.877 20.297 -12.368 1.00 44.55 H new ATOM 0 HG22 ILE A 92 12.409 19.990 -11.410 1.00 44.55 H new ATOM 0 HG23 ILE A 92 12.412 21.268 -12.648 1.00 44.55 H new ATOM 0 HD11 ILE A 92 16.425 23.275 -11.920 1.00 14.02 H new ATOM 0 HD12 ILE A 92 16.165 22.368 -10.411 1.00 14.02 H new ATOM 0 HD13 ILE A 92 16.019 21.543 -11.981 1.00 14.02 H new ATOM 1344 N GLU A 93 10.311 22.293 -11.590 1.00 33.23 N ATOM 1345 CA GLU A 93 9.364 22.751 -12.599 1.00 52.43 C ATOM 1346 C GLU A 93 8.435 23.819 -12.029 1.00 35.23 C ATOM 1347 O GLU A 93 7.633 24.410 -12.752 1.00 3.13 O ATOM 1348 CB GLU A 93 8.542 21.575 -13.131 1.00 51.52 C ATOM 1349 CG GLU A 93 7.545 21.025 -12.125 1.00 52.43 C ATOM 1350 CD GLU A 93 6.193 21.707 -12.212 1.00 32.22 C ATOM 1351 OE1 GLU A 93 5.468 21.462 -13.199 1.00 41.21 O ATOM 1352 OE2 GLU A 93 5.860 22.484 -11.293 1.00 53.11 O ATOM 0 H GLU A 93 10.095 21.379 -11.193 1.00 33.23 H new ATOM 0 HA GLU A 93 9.932 23.189 -13.420 1.00 52.43 H new ATOM 0 HB2 GLU A 93 8.006 21.893 -14.025 1.00 51.52 H new ATOM 0 HB3 GLU A 93 9.219 20.776 -13.433 1.00 51.52 H new ATOM 0 HG2 GLU A 93 7.420 19.955 -12.291 1.00 52.43 H new ATOM 0 HG3 GLU A 93 7.945 21.147 -11.118 1.00 52.43 H new ATOM 1359 N ALA A 94 8.548 24.059 -10.727 1.00 1.05 N ATOM 1360 CA ALA A 94 7.720 25.055 -10.058 1.00 40.34 C ATOM 1361 C ALA A 94 8.086 26.465 -10.510 1.00 12.21 C ATOM 1362 O ALA A 94 7.227 27.227 -10.956 1.00 32.45 O ATOM 1363 CB ALA A 94 7.858 24.930 -8.548 1.00 64.04 C ATOM 0 H ALA A 94 9.205 23.577 -10.114 1.00 1.05 H new ATOM 0 HA ALA A 94 6.681 24.871 -10.332 1.00 40.34 H new ATOM 0 HB1 ALA A 94 7.234 25.680 -8.062 1.00 64.04 H new ATOM 0 HB2 ALA A 94 7.540 23.936 -8.235 1.00 64.04 H new ATOM 0 HB3 ALA A 94 8.899 25.085 -8.264 1.00 64.04 H new ATOM 1369 N ILE A 95 9.364 26.806 -10.391 1.00 4.41 N ATOM 1370 CA ILE A 95 9.843 28.125 -10.787 1.00 73.04 C ATOM 1371 C ILE A 95 9.522 28.409 -12.251 1.00 64.21 C ATOM 1372 O ILE A 95 9.298 29.556 -12.637 1.00 14.13 O ATOM 1373 CB ILE A 95 11.361 28.262 -10.570 1.00 62.10 C ATOM 1374 CG1 ILE A 95 12.119 27.310 -11.497 1.00 61.44 C ATOM 1375 CG2 ILE A 95 11.715 27.987 -9.116 1.00 40.31 C ATOM 1376 CD1 ILE A 95 12.531 27.943 -12.808 1.00 72.30 C ATOM 0 H ILE A 95 10.087 26.187 -10.024 1.00 4.41 H new ATOM 0 HA ILE A 95 9.328 28.850 -10.157 1.00 73.04 H new ATOM 0 HB ILE A 95 11.656 29.284 -10.809 1.00 62.10 H new ATOM 0 HG12 ILE A 95 13.009 26.947 -10.983 1.00 61.44 H new ATOM 0 HG13 ILE A 95 11.493 26.442 -11.703 1.00 61.44 H new ATOM 0 HG21 ILE A 95 12.792 28.088 -8.978 1.00 40.31 H new ATOM 0 HG22 ILE A 95 11.199 28.701 -8.474 1.00 40.31 H new ATOM 0 HG23 ILE A 95 11.409 26.975 -8.852 1.00 40.31 H new ATOM 0 HD11 ILE A 95 13.064 27.210 -13.414 1.00 72.30 H new ATOM 0 HD12 ILE A 95 11.644 28.281 -13.343 1.00 72.30 H new ATOM 0 HD13 ILE A 95 13.183 28.794 -12.612 1.00 72.30 H new ATOM 1388 N ARG A 96 9.502 27.356 -13.061 1.00 73.45 N ATOM 1389 CA ARG A 96 9.208 27.491 -14.483 1.00 40.21 C ATOM 1390 C ARG A 96 7.768 27.947 -14.700 1.00 1.43 C ATOM 1391 O ARG A 96 7.437 28.518 -15.739 1.00 41.20 O ATOM 1392 CB ARG A 96 9.448 26.163 -15.204 1.00 54.40 C ATOM 1393 CG ARG A 96 9.066 26.192 -16.675 1.00 64.31 C ATOM 1394 CD ARG A 96 9.305 24.844 -17.338 1.00 52.23 C ATOM 1395 NE ARG A 96 9.493 24.970 -18.781 1.00 70.11 N ATOM 1396 CZ ARG A 96 10.630 25.365 -19.342 1.00 42.22 C ATOM 1397 NH1 ARG A 96 11.675 25.671 -18.586 1.00 3.12 N ATOM 1398 NH2 ARG A 96 10.724 25.455 -20.663 1.00 30.32 N ATOM 0 H ARG A 96 9.686 26.400 -12.757 1.00 73.45 H new ATOM 0 HA ARG A 96 9.876 28.247 -14.896 1.00 40.21 H new ATOM 0 HB2 ARG A 96 10.501 25.896 -15.116 1.00 54.40 H new ATOM 0 HB3 ARG A 96 8.878 25.380 -14.704 1.00 54.40 H new ATOM 0 HG2 ARG A 96 8.016 26.467 -16.774 1.00 64.31 H new ATOM 0 HG3 ARG A 96 9.646 26.959 -17.188 1.00 64.31 H new ATOM 0 HD2 ARG A 96 10.184 24.374 -16.897 1.00 52.23 H new ATOM 0 HD3 ARG A 96 8.459 24.187 -17.139 1.00 52.23 H new ATOM 0 HE ARG A 96 8.708 24.742 -19.391 1.00 70.11 H new ATOM 0 HH11 ARG A 96 11.607 25.603 -17.571 1.00 3.12 H new ATOM 0 HH12 ARG A 96 12.547 25.974 -19.020 1.00 3.12 H new ATOM 0 HH21 ARG A 96 9.922 25.221 -21.248 1.00 30.32 H new ATOM 0 HH22 ARG A 96 11.598 25.759 -21.093 1.00 30.32 H new ATOM 1412 N ARG A 97 6.917 27.691 -13.712 1.00 13.11 N ATOM 1413 CA ARG A 97 5.512 28.074 -13.795 1.00 64.42 C ATOM 1414 C ARG A 97 5.264 29.393 -13.070 1.00 44.23 C ATOM 1415 O ARG A 97 4.392 30.170 -13.456 1.00 15.10 O ATOM 1416 CB ARG A 97 4.627 26.978 -13.199 1.00 20.30 C ATOM 1417 CG ARG A 97 3.358 26.719 -13.995 1.00 2.50 C ATOM 1418 CD ARG A 97 2.783 25.344 -13.696 1.00 64.31 C ATOM 1419 NE ARG A 97 1.977 24.835 -14.803 1.00 2.24 N ATOM 1420 CZ ARG A 97 0.724 25.210 -15.032 1.00 13.33 C ATOM 1421 NH1 ARG A 97 0.136 26.093 -14.236 1.00 23.15 N ATOM 1422 NH2 ARG A 97 0.055 24.703 -16.059 1.00 62.44 N ATOM 0 H ARG A 97 7.175 27.220 -12.845 1.00 13.11 H new ATOM 0 HA ARG A 97 5.259 28.205 -14.847 1.00 64.42 H new ATOM 0 HB2 ARG A 97 5.201 26.054 -13.136 1.00 20.30 H new ATOM 0 HB3 ARG A 97 4.356 27.255 -12.180 1.00 20.30 H new ATOM 0 HG2 ARG A 97 2.617 27.483 -13.759 1.00 2.50 H new ATOM 0 HG3 ARG A 97 3.573 26.801 -15.061 1.00 2.50 H new ATOM 0 HD2 ARG A 97 3.596 24.648 -13.490 1.00 64.31 H new ATOM 0 HD3 ARG A 97 2.171 25.395 -12.795 1.00 64.31 H new ATOM 0 HE ARG A 97 2.400 24.155 -15.434 1.00 2.24 H new ATOM 0 HH11 ARG A 97 0.646 26.486 -13.445 1.00 23.15 H new ATOM 0 HH12 ARG A 97 -0.827 26.379 -14.415 1.00 23.15 H new ATOM 0 HH21 ARG A 97 0.503 24.024 -16.674 1.00 62.44 H new ATOM 0 HH22 ARG A 97 -0.907 24.992 -16.233 1.00 62.44 H new ATOM 1436 N ALA A 98 6.038 29.639 -12.018 1.00 21.20 N ATOM 1437 CA ALA A 98 5.904 30.864 -11.240 1.00 54.23 C ATOM 1438 C ALA A 98 6.467 32.061 -11.999 1.00 74.24 C ATOM 1439 O ALA A 98 5.825 33.107 -12.092 1.00 0.33 O ATOM 1440 CB ALA A 98 6.599 30.715 -9.895 1.00 64.15 C ATOM 0 H ALA A 98 6.765 29.006 -11.685 1.00 21.20 H new ATOM 0 HA ALA A 98 4.842 31.042 -11.070 1.00 54.23 H new ATOM 0 HB1 ALA A 98 6.490 31.638 -9.325 1.00 64.15 H new ATOM 0 HB2 ALA A 98 6.148 29.892 -9.342 1.00 64.15 H new ATOM 0 HB3 ALA A 98 7.658 30.509 -10.053 1.00 64.15 H new ATOM 1446 N SER A 99 7.670 31.899 -12.541 1.00 13.41 N ATOM 1447 CA SER A 99 8.321 32.969 -13.288 1.00 62.45 C ATOM 1448 C SER A 99 7.642 33.180 -14.638 1.00 72.11 C ATOM 1449 O SER A 99 7.870 34.185 -15.309 1.00 42.15 O ATOM 1450 CB SER A 99 9.802 32.646 -13.495 1.00 63.13 C ATOM 1451 OG SER A 99 10.430 33.627 -14.302 1.00 43.12 O ATOM 0 H SER A 99 8.213 31.038 -12.477 1.00 13.41 H new ATOM 0 HA SER A 99 8.234 33.888 -12.709 1.00 62.45 H new ATOM 0 HB2 SER A 99 10.304 32.590 -12.529 1.00 63.13 H new ATOM 0 HB3 SER A 99 9.902 31.667 -13.963 1.00 63.13 H new ATOM 0 HG SER A 99 9.761 34.054 -14.877 1.00 43.12 H new ATOM 1457 N ASN A 100 6.805 32.224 -15.028 1.00 63.45 N ATOM 1458 CA ASN A 100 6.092 32.303 -16.298 1.00 43.52 C ATOM 1459 C ASN A 100 5.139 33.494 -16.313 1.00 12.44 C ATOM 1460 O ASN A 100 4.862 34.069 -17.365 1.00 23.02 O ATOM 1461 CB ASN A 100 5.315 31.010 -16.553 1.00 11.45 C ATOM 1462 CG ASN A 100 5.028 30.789 -18.025 1.00 31.50 C ATOM 1463 OD1 ASN A 100 5.277 31.662 -18.856 1.00 1.11 O ATOM 1464 ND2 ASN A 100 4.501 29.615 -18.355 1.00 13.15 N ATOM 0 H ASN A 100 6.604 31.386 -14.483 1.00 63.45 H new ATOM 0 HA ASN A 100 6.827 32.438 -17.091 1.00 43.52 H new ATOM 0 HB2 ASN A 100 5.884 30.165 -16.166 1.00 11.45 H new ATOM 0 HB3 ASN A 100 4.375 31.040 -16.003 1.00 11.45 H new ATOM 0 HD21 ASN A 100 4.286 29.408 -19.331 1.00 13.15 H new ATOM 0 HD22 ASN A 100 4.311 28.920 -17.633 1.00 13.15 H new ATOM 1471 N GLY A 101 4.639 33.860 -15.136 1.00 3.21 N ATOM 1472 CA GLY A 101 3.723 34.981 -15.035 1.00 72.11 C ATOM 1473 C GLY A 101 2.280 34.539 -14.888 1.00 24.32 C ATOM 1474 O GLY A 101 1.384 35.367 -14.735 1.00 14.31 O ATOM 0 H GLY A 101 4.852 33.400 -14.251 1.00 3.21 H new ATOM 0 HA2 GLY A 101 4.000 35.597 -14.179 1.00 72.11 H new ATOM 0 HA3 GLY A 101 3.820 35.606 -15.922 1.00 72.11 H new ATOM 1478 N GLU A 102 2.057 33.229 -14.936 1.00 15.23 N ATOM 1479 CA GLU A 102 0.712 32.680 -14.809 1.00 32.31 C ATOM 1480 C GLU A 102 0.406 32.320 -13.358 1.00 33.31 C ATOM 1481 O GLU A 102 1.120 31.532 -12.737 1.00 5.32 O ATOM 1482 CB GLU A 102 0.557 31.443 -15.696 1.00 75.23 C ATOM 1483 CG GLU A 102 0.807 31.716 -17.170 1.00 32.31 C ATOM 1484 CD GLU A 102 -0.352 32.432 -17.836 1.00 10.35 C ATOM 1485 OE1 GLU A 102 -1.505 31.985 -17.660 1.00 62.12 O ATOM 1486 OE2 GLU A 102 -0.107 33.440 -18.531 1.00 64.55 O ATOM 0 H GLU A 102 2.789 32.530 -15.062 1.00 15.23 H new ATOM 0 HA GLU A 102 0.004 33.442 -15.133 1.00 32.31 H new ATOM 0 HB2 GLU A 102 1.249 30.673 -15.355 1.00 75.23 H new ATOM 0 HB3 GLU A 102 -0.450 31.043 -15.575 1.00 75.23 H new ATOM 0 HG2 GLU A 102 1.710 32.317 -17.276 1.00 32.31 H new ATOM 0 HG3 GLU A 102 0.990 30.773 -17.684 1.00 32.31 H new ATOM 1493 N THR A 103 -0.662 32.903 -12.822 1.00 73.12 N ATOM 1494 CA THR A 103 -1.063 32.646 -11.445 1.00 0.13 C ATOM 1495 C THR A 103 -1.207 31.151 -11.183 1.00 43.24 C ATOM 1496 O THR A 103 -1.560 30.385 -12.081 1.00 23.33 O ATOM 1497 CB THR A 103 -2.394 33.345 -11.107 1.00 64.12 C ATOM 1498 OG1 THR A 103 -2.560 34.505 -11.930 1.00 1.34 O ATOM 1499 CG2 THR A 103 -2.437 33.746 -9.640 1.00 52.25 C ATOM 0 H THR A 103 -1.265 33.557 -13.322 1.00 73.12 H new ATOM 0 HA THR A 103 -0.277 33.050 -10.807 1.00 0.13 H new ATOM 0 HB THR A 103 -3.207 32.645 -11.299 1.00 64.12 H new ATOM 0 HG1 THR A 103 -3.409 34.943 -11.711 1.00 1.34 H new ATOM 0 HG21 THR A 103 -3.386 34.238 -9.425 1.00 52.25 H new ATOM 0 HG22 THR A 103 -2.339 32.857 -9.017 1.00 52.25 H new ATOM 0 HG23 THR A 103 -1.617 34.431 -9.426 1.00 52.25 H new ATOM 1507 N LEU A 104 -0.932 30.742 -9.950 1.00 1.02 N ATOM 1508 CA LEU A 104 -1.032 29.337 -9.570 1.00 5.12 C ATOM 1509 C LEU A 104 -2.243 29.100 -8.674 1.00 21.03 C ATOM 1510 O LEU A 104 -2.875 30.046 -8.206 1.00 52.42 O ATOM 1511 CB LEU A 104 0.243 28.891 -8.852 1.00 4.03 C ATOM 1512 CG LEU A 104 1.553 29.470 -9.388 1.00 22.11 C ATOM 1513 CD1 LEU A 104 2.721 29.056 -8.506 1.00 34.53 C ATOM 1514 CD2 LEU A 104 1.784 29.025 -10.825 1.00 1.22 C ATOM 0 H LEU A 104 -0.638 31.363 -9.196 1.00 1.02 H new ATOM 0 HA LEU A 104 -1.155 28.748 -10.479 1.00 5.12 H new ATOM 0 HB2 LEU A 104 0.155 29.158 -7.799 1.00 4.03 H new ATOM 0 HB3 LEU A 104 0.302 27.804 -8.901 1.00 4.03 H new ATOM 0 HG LEU A 104 1.480 30.557 -9.372 1.00 22.11 H new ATOM 0 HD11 LEU A 104 3.644 29.477 -8.903 1.00 34.53 H new ATOM 0 HD12 LEU A 104 2.560 29.425 -7.493 1.00 34.53 H new ATOM 0 HD13 LEU A 104 2.796 27.969 -8.489 1.00 34.53 H new ATOM 0 HD21 LEU A 104 2.721 29.446 -11.190 1.00 1.22 H new ATOM 0 HD22 LEU A 104 1.835 27.937 -10.865 1.00 1.22 H new ATOM 0 HD23 LEU A 104 0.962 29.373 -11.450 1.00 1.22 H new ATOM 1526 N GLU A 105 -2.558 27.830 -8.437 1.00 54.34 N ATOM 1527 CA GLU A 105 -3.693 27.470 -7.596 1.00 33.22 C ATOM 1528 C GLU A 105 -3.624 28.189 -6.252 1.00 20.14 C ATOM 1529 O GLU A 105 -2.541 28.503 -5.758 1.00 0.44 O ATOM 1530 CB GLU A 105 -3.733 25.956 -7.375 1.00 42.24 C ATOM 1531 CG GLU A 105 -2.640 25.447 -6.450 1.00 52.13 C ATOM 1532 CD GLU A 105 -2.769 23.965 -6.156 1.00 45.11 C ATOM 1533 OE1 GLU A 105 -2.961 23.185 -7.113 1.00 3.53 O ATOM 1534 OE2 GLU A 105 -2.677 23.585 -4.970 1.00 72.03 O ATOM 0 H GLU A 105 -2.044 27.035 -8.815 1.00 54.34 H new ATOM 0 HA GLU A 105 -4.604 27.780 -8.108 1.00 33.22 H new ATOM 0 HB2 GLU A 105 -4.704 25.683 -6.961 1.00 42.24 H new ATOM 0 HB3 GLU A 105 -3.645 25.454 -8.339 1.00 42.24 H new ATOM 0 HG2 GLU A 105 -1.667 25.641 -6.902 1.00 52.13 H new ATOM 0 HG3 GLU A 105 -2.673 26.004 -5.514 1.00 52.13 H new ATOM 1541 N LYS A 106 -4.788 28.447 -5.665 1.00 22.13 N ATOM 1542 CA LYS A 106 -4.862 29.128 -4.378 1.00 2.03 C ATOM 1543 C LYS A 106 -4.028 28.400 -3.328 1.00 41.21 C ATOM 1544 O LYS A 106 -3.483 27.328 -3.590 1.00 25.30 O ATOM 1545 CB LYS A 106 -6.316 29.225 -3.912 1.00 32.25 C ATOM 1546 CG LYS A 106 -6.919 27.887 -3.519 1.00 13.23 C ATOM 1547 CD LYS A 106 -8.419 27.859 -3.762 1.00 20.24 C ATOM 1548 CE LYS A 106 -9.162 28.730 -2.761 1.00 13.31 C ATOM 1549 NZ LYS A 106 -10.627 28.464 -2.774 1.00 74.11 N ATOM 0 H LYS A 106 -5.694 28.194 -6.061 1.00 22.13 H new ATOM 0 HA LYS A 106 -4.459 30.133 -4.504 1.00 2.03 H new ATOM 0 HB2 LYS A 106 -6.371 29.903 -3.061 1.00 32.25 H new ATOM 0 HB3 LYS A 106 -6.916 29.664 -4.709 1.00 32.25 H new ATOM 0 HG2 LYS A 106 -6.442 27.090 -4.090 1.00 13.23 H new ATOM 0 HG3 LYS A 106 -6.716 27.691 -2.466 1.00 13.23 H new ATOM 0 HD2 LYS A 106 -8.631 28.204 -4.774 1.00 20.24 H new ATOM 0 HD3 LYS A 106 -8.781 26.833 -3.692 1.00 20.24 H new ATOM 0 HE2 LYS A 106 -8.769 28.549 -1.760 1.00 13.31 H new ATOM 0 HE3 LYS A 106 -8.982 29.780 -2.989 1.00 13.31 H new ATOM 0 HZ1 LYS A 106 -11.097 29.077 -2.078 1.00 74.11 H new ATOM 0 HZ2 LYS A 106 -11.007 28.661 -3.722 1.00 74.11 H new ATOM 0 HZ3 LYS A 106 -10.801 27.468 -2.531 1.00 74.11 H new ATOM 1563 N ILE A 107 -3.935 28.989 -2.141 1.00 4.13 N ATOM 1564 CA ILE A 107 -3.169 28.395 -1.052 1.00 33.42 C ATOM 1565 C ILE A 107 -3.982 27.325 -0.329 1.00 5.41 C ATOM 1566 O ILE A 107 -5.104 27.575 0.113 1.00 62.50 O ATOM 1567 CB ILE A 107 -2.720 29.459 -0.033 1.00 32.41 C ATOM 1568 CG1 ILE A 107 -1.943 30.573 -0.736 1.00 1.31 C ATOM 1569 CG2 ILE A 107 -1.873 28.822 1.059 1.00 53.10 C ATOM 1570 CD1 ILE A 107 -0.710 30.084 -1.463 1.00 51.24 C ATOM 0 H ILE A 107 -4.380 29.877 -1.909 1.00 4.13 H new ATOM 0 HA ILE A 107 -2.286 27.938 -1.499 1.00 33.42 H new ATOM 0 HB ILE A 107 -3.605 29.895 0.429 1.00 32.41 H new ATOM 0 HG12 ILE A 107 -2.601 31.070 -1.448 1.00 1.31 H new ATOM 0 HG13 ILE A 107 -1.648 31.320 0.001 1.00 1.31 H new ATOM 0 HG21 ILE A 107 -1.563 29.586 1.772 1.00 53.10 H new ATOM 0 HG22 ILE A 107 -2.457 28.060 1.575 1.00 53.10 H new ATOM 0 HG23 ILE A 107 -0.991 28.362 0.614 1.00 53.10 H new ATOM 0 HD11 ILE A 107 -0.209 30.928 -1.938 1.00 51.24 H new ATOM 0 HD12 ILE A 107 -0.032 29.612 -0.752 1.00 51.24 H new ATOM 0 HD13 ILE A 107 -1.000 29.359 -2.224 1.00 51.24 H new ATOM 1582 N THR A 108 -3.406 26.133 -0.210 1.00 34.34 N ATOM 1583 CA THR A 108 -4.076 25.025 0.460 1.00 22.03 C ATOM 1584 C THR A 108 -3.646 24.925 1.920 1.00 74.35 C ATOM 1585 O THR A 108 -3.618 23.837 2.494 1.00 3.54 O ATOM 1586 CB THR A 108 -3.785 23.685 -0.242 1.00 3.31 C ATOM 1587 OG1 THR A 108 -4.586 22.647 0.332 1.00 34.12 O ATOM 1588 CG2 THR A 108 -2.313 23.321 -0.123 1.00 64.31 C ATOM 0 H THR A 108 -2.478 25.910 -0.569 1.00 34.34 H new ATOM 0 HA THR A 108 -5.146 25.227 0.412 1.00 22.03 H new ATOM 0 HB THR A 108 -4.033 23.792 -1.298 1.00 3.31 H new ATOM 0 HG1 THR A 108 -4.518 22.684 1.309 1.00 34.12 H new ATOM 0 HG21 THR A 108 -2.131 22.371 -0.626 1.00 64.31 H new ATOM 0 HG22 THR A 108 -1.707 24.099 -0.587 1.00 64.31 H new ATOM 0 HG23 THR A 108 -2.044 23.231 0.930 1.00 64.31 H new ATOM 1596 N ASN A 109 -3.314 26.066 2.513 1.00 3.25 N ATOM 1597 CA ASN A 109 -2.886 26.106 3.907 1.00 4.21 C ATOM 1598 C ASN A 109 -4.055 25.820 4.844 1.00 73.01 C ATOM 1599 O ASN A 109 -4.691 26.740 5.358 1.00 33.34 O ATOM 1600 CB ASN A 109 -2.276 27.471 4.236 1.00 32.51 C ATOM 1601 CG ASN A 109 -1.775 27.550 5.665 1.00 1.41 C ATOM 1602 OD1 ASN A 109 -0.833 26.854 6.044 1.00 0.11 O ATOM 1603 ND2 ASN A 109 -2.404 28.402 6.466 1.00 15.21 N ATOM 0 H ASN A 109 -3.333 26.975 2.051 1.00 3.25 H new ATOM 0 HA ASN A 109 -2.131 25.333 4.051 1.00 4.21 H new ATOM 0 HB2 ASN A 109 -1.451 27.671 3.553 1.00 32.51 H new ATOM 0 HB3 ASN A 109 -3.022 28.249 4.072 1.00 32.51 H new ATOM 0 HD21 ASN A 109 -2.111 28.499 7.438 1.00 15.21 H new ATOM 0 HD22 ASN A 109 -3.180 28.959 6.109 1.00 15.21 H new ATOM 1610 N SER A 110 -4.333 24.538 5.061 1.00 44.31 N ATOM 1611 CA SER A 110 -5.428 24.130 5.933 1.00 4.11 C ATOM 1612 C SER A 110 -5.031 22.919 6.773 1.00 50.44 C ATOM 1613 O SER A 110 -4.074 22.215 6.452 1.00 23.21 O ATOM 1614 CB SER A 110 -6.673 23.806 5.106 1.00 61.52 C ATOM 1615 OG SER A 110 -6.447 22.691 4.261 1.00 73.43 O ATOM 0 H SER A 110 -3.815 23.764 4.645 1.00 44.31 H new ATOM 0 HA SER A 110 -5.653 24.958 6.605 1.00 4.11 H new ATOM 0 HB2 SER A 110 -7.511 23.599 5.771 1.00 61.52 H new ATOM 0 HB3 SER A 110 -6.950 24.672 4.505 1.00 61.52 H new ATOM 0 HG SER A 110 -7.258 22.503 3.744 1.00 73.43 H new ATOM 1621 N ARG A 111 -5.774 22.685 7.849 1.00 73.40 N ATOM 1622 CA ARG A 111 -5.501 21.561 8.736 1.00 24.51 C ATOM 1623 C ARG A 111 -6.784 20.806 9.069 1.00 72.40 C ATOM 1624 O ARG A 111 -7.890 21.337 8.968 1.00 11.20 O ATOM 1625 CB ARG A 111 -4.835 22.050 10.024 1.00 74.21 C ATOM 1626 CG ARG A 111 -5.418 23.350 10.554 1.00 22.33 C ATOM 1627 CD ARG A 111 -4.648 24.556 10.040 1.00 22.10 C ATOM 1628 NE ARG A 111 -3.390 24.749 10.757 1.00 15.14 N ATOM 1629 CZ ARG A 111 -3.319 25.170 12.015 1.00 32.54 C ATOM 1630 NH1 ARG A 111 -4.427 25.439 12.692 1.00 74.23 N ATOM 1631 NH2 ARG A 111 -2.138 25.321 12.600 1.00 64.22 N ATOM 0 H ARG A 111 -6.570 23.259 8.128 1.00 73.40 H new ATOM 0 HA ARG A 111 -4.823 20.880 8.220 1.00 24.51 H new ATOM 0 HB2 ARG A 111 -4.932 21.279 10.789 1.00 74.21 H new ATOM 0 HB3 ARG A 111 -3.769 22.187 9.843 1.00 74.21 H new ATOM 0 HG2 ARG A 111 -6.463 23.430 10.255 1.00 22.33 H new ATOM 0 HG3 ARG A 111 -5.398 23.342 11.644 1.00 22.33 H new ATOM 0 HD2 ARG A 111 -4.443 24.429 8.977 1.00 22.10 H new ATOM 0 HD3 ARG A 111 -5.264 25.450 10.142 1.00 22.10 H new ATOM 0 HE ARG A 111 -2.519 24.550 10.265 1.00 15.14 H new ATOM 0 HH11 ARG A 111 -5.337 25.323 12.247 1.00 74.23 H new ATOM 0 HH12 ARG A 111 -4.369 25.762 13.658 1.00 74.23 H new ATOM 0 HH21 ARG A 111 -1.283 25.114 12.084 1.00 64.22 H new ATOM 0 HH22 ARG A 111 -2.085 25.644 13.566 1.00 64.22 H new ATOM 1645 N PRO A 112 -6.636 19.536 9.475 1.00 61.20 N ATOM 1646 CA PRO A 112 -7.772 18.681 9.831 1.00 71.31 C ATOM 1647 C PRO A 112 -8.444 19.120 11.127 1.00 34.22 C ATOM 1648 O PRO A 112 -7.919 19.940 11.880 1.00 20.24 O ATOM 1649 CB PRO A 112 -7.136 17.298 10.000 1.00 55.43 C ATOM 1650 CG PRO A 112 -5.715 17.575 10.349 1.00 41.33 C ATOM 1651 CD PRO A 112 -5.347 18.837 9.618 1.00 15.45 C ATOM 0 HA PRO A 112 -8.559 18.714 9.078 1.00 71.31 H new ATOM 0 HB2 PRO A 112 -7.632 16.727 10.785 1.00 55.43 H new ATOM 0 HB3 PRO A 112 -7.212 16.713 9.084 1.00 55.43 H new ATOM 0 HG2 PRO A 112 -5.594 17.698 11.425 1.00 41.33 H new ATOM 0 HG3 PRO A 112 -5.071 16.748 10.049 1.00 41.33 H new ATOM 0 HD2 PRO A 112 -4.627 19.432 10.180 1.00 15.45 H new ATOM 0 HD3 PRO A 112 -4.896 18.623 8.649 1.00 15.45 H new ATOM 1659 N PRO A 113 -9.634 18.562 11.396 1.00 55.32 N ATOM 1660 CA PRO A 113 -10.404 18.881 12.602 1.00 4.13 C ATOM 1661 C PRO A 113 -9.751 18.333 13.867 1.00 15.21 C ATOM 1662 O PRO A 113 -8.966 17.386 13.812 1.00 42.44 O ATOM 1663 CB PRO A 113 -11.750 18.197 12.356 1.00 74.45 C ATOM 1664 CG PRO A 113 -11.443 17.084 11.413 1.00 1.33 C ATOM 1665 CD PRO A 113 -10.320 17.577 10.543 1.00 55.53 C ATOM 0 HA PRO A 113 -10.481 19.956 12.764 1.00 4.13 H new ATOM 0 HB2 PRO A 113 -12.179 17.822 13.285 1.00 74.45 H new ATOM 0 HB3 PRO A 113 -12.474 18.890 11.928 1.00 74.45 H new ATOM 0 HG2 PRO A 113 -11.151 16.184 11.954 1.00 1.33 H new ATOM 0 HG3 PRO A 113 -12.317 16.827 10.814 1.00 1.33 H new ATOM 0 HD2 PRO A 113 -9.653 16.766 10.250 1.00 55.53 H new ATOM 0 HD3 PRO A 113 -10.693 18.031 9.625 1.00 55.53 H new ATOM 1673 N CYS A 114 -10.082 18.933 15.005 1.00 12.40 N ATOM 1674 CA CYS A 114 -9.528 18.505 16.284 1.00 2.25 C ATOM 1675 C CYS A 114 -9.911 17.060 16.587 1.00 15.40 C ATOM 1676 O CYS A 114 -11.052 16.773 16.951 1.00 22.20 O ATOM 1677 CB CYS A 114 -10.016 19.421 17.408 1.00 52.24 C ATOM 1678 SG CYS A 114 -9.091 20.968 17.553 1.00 33.05 S ATOM 0 H CYS A 114 -10.731 19.717 15.068 1.00 12.40 H new ATOM 0 HA CYS A 114 -8.442 18.568 16.220 1.00 2.25 H new ATOM 0 HB2 CYS A 114 -11.068 19.653 17.242 1.00 52.24 H new ATOM 0 HB3 CYS A 114 -9.954 18.883 18.354 1.00 52.24 H new ATOM 0 HG CYS A 114 -9.579 21.675 18.529 1.00 33.05 H new ATOM 1684 N VAL A 115 -8.952 16.154 16.432 1.00 24.23 N ATOM 1685 CA VAL A 115 -9.189 14.738 16.688 1.00 3.22 C ATOM 1686 C VAL A 115 -8.061 14.133 17.517 1.00 14.45 C ATOM 1687 O VAL A 115 -7.159 14.841 17.967 1.00 54.02 O ATOM 1688 CB VAL A 115 -9.327 13.946 15.375 1.00 61.23 C ATOM 1689 CG1 VAL A 115 -10.418 14.546 14.501 1.00 32.23 C ATOM 1690 CG2 VAL A 115 -7.999 13.909 14.633 1.00 33.31 C ATOM 0 H VAL A 115 -8.003 16.375 16.130 1.00 24.23 H new ATOM 0 HA VAL A 115 -10.123 14.669 17.245 1.00 3.22 H new ATOM 0 HB VAL A 115 -9.611 12.922 15.617 1.00 61.23 H new ATOM 0 HG11 VAL A 115 -10.501 13.973 13.578 1.00 32.23 H new ATOM 0 HG12 VAL A 115 -11.369 14.516 15.033 1.00 32.23 H new ATOM 0 HG13 VAL A 115 -10.167 15.580 14.265 1.00 32.23 H new ATOM 0 HG21 VAL A 115 -8.115 13.345 13.707 1.00 33.31 H new ATOM 0 HG22 VAL A 115 -7.683 14.926 14.401 1.00 33.31 H new ATOM 0 HG23 VAL A 115 -7.246 13.429 15.258 1.00 33.31 H new ATOM 1700 N ILE A 116 -8.119 12.821 17.716 1.00 31.11 N ATOM 1701 CA ILE A 116 -7.102 12.120 18.490 1.00 2.52 C ATOM 1702 C ILE A 116 -6.763 10.773 17.861 1.00 11.23 C ATOM 1703 O ILE A 116 -7.630 9.911 17.710 1.00 25.35 O ATOM 1704 CB ILE A 116 -7.556 11.896 19.944 1.00 34.24 C ATOM 1705 CG1 ILE A 116 -8.904 11.172 19.974 1.00 12.24 C ATOM 1706 CG2 ILE A 116 -7.645 13.223 20.683 1.00 51.13 C ATOM 1707 CD1 ILE A 116 -8.835 9.791 20.588 1.00 51.22 C ATOM 0 H ILE A 116 -8.860 12.222 17.352 1.00 31.11 H new ATOM 0 HA ILE A 116 -6.214 12.752 18.489 1.00 2.52 H new ATOM 0 HB ILE A 116 -6.817 11.272 20.447 1.00 34.24 H new ATOM 0 HG12 ILE A 116 -9.619 11.775 20.535 1.00 12.24 H new ATOM 0 HG13 ILE A 116 -9.286 11.090 18.956 1.00 12.24 H new ATOM 0 HG21 ILE A 116 -7.967 13.047 21.709 1.00 51.13 H new ATOM 0 HG22 ILE A 116 -6.667 13.703 20.687 1.00 51.13 H new ATOM 0 HG23 ILE A 116 -8.365 13.871 20.183 1.00 51.13 H new ATOM 0 HD11 ILE A 116 -9.826 9.337 20.576 1.00 51.22 H new ATOM 0 HD12 ILE A 116 -8.146 9.172 20.014 1.00 51.22 H new ATOM 0 HD13 ILE A 116 -8.484 9.867 21.617 1.00 51.22 H new ATOM 1719 N LEU A 117 -5.498 10.598 17.498 1.00 64.25 N ATOM 1720 CA LEU A 117 -5.043 9.354 16.886 1.00 24.13 C ATOM 1721 C LEU A 117 -5.600 8.145 17.631 1.00 14.31 C ATOM 1722 O LEU A 117 -6.361 7.356 17.072 1.00 72.30 O ATOM 1723 CB LEU A 117 -3.514 9.298 16.873 1.00 0.32 C ATOM 1724 CG LEU A 117 -2.817 9.676 18.181 1.00 54.41 C ATOM 1725 CD1 LEU A 117 -2.635 11.183 18.272 1.00 44.41 C ATOM 1726 CD2 LEU A 117 -3.607 9.160 19.375 1.00 54.04 C ATOM 0 H LEU A 117 -4.769 11.301 17.616 1.00 64.25 H new ATOM 0 HA LEU A 117 -5.411 9.327 15.860 1.00 24.13 H new ATOM 0 HB2 LEU A 117 -3.210 8.287 16.602 1.00 0.32 H new ATOM 0 HB3 LEU A 117 -3.153 9.961 16.087 1.00 0.32 H new ATOM 0 HG LEU A 117 -1.832 9.210 18.193 1.00 54.41 H new ATOM 0 HD11 LEU A 117 -2.138 11.433 19.209 1.00 44.41 H new ATOM 0 HD12 LEU A 117 -2.027 11.527 17.435 1.00 44.41 H new ATOM 0 HD13 LEU A 117 -3.610 11.670 18.237 1.00 44.41 H new ATOM 0 HD21 LEU A 117 -3.096 9.438 20.297 1.00 54.04 H new ATOM 0 HD22 LEU A 117 -4.605 9.597 19.367 1.00 54.04 H new ATOM 0 HD23 LEU A 117 -3.686 8.074 19.317 1.00 54.04 H new TER 1738 LEU A 117