USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1052 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.3 K(o=-0.3,f=-1.8!) USER MOD Single : A 19 TYR OH : rot 59:sc= 0.023 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.071 K(o=0.071,f=-0.71) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -122:sc= -0.0244 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -41:sc= 0.834 USER MOD Single : A 39 SER OG : rot 180:sc= -0.988 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.289 X(o=-0.29,f=-0.04) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.379 K(o=-0.38,f=-3.1!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot -24:sc= 0.0314 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= -0.0151 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.842 1.126 10.580 1.00 21.14 N ATOM 2 CA GLY A 1 22.053 2.459 10.045 1.00 1.25 C ATOM 3 C GLY A 1 20.852 2.972 9.277 1.00 60.12 C ATOM 4 O GLY A 1 20.601 2.548 8.148 1.00 41.10 O ATOM 0 H1 GLY A 1 22.692 0.821 11.096 1.00 21.14 H new ATOM 0 H2 GLY A 1 21.028 1.137 11.228 1.00 21.14 H new ATOM 0 H3 GLY A 1 21.655 0.464 9.800 1.00 21.14 H new ATOM 0 HA2 GLY A 1 22.277 3.144 10.863 1.00 1.25 H new ATOM 0 HA3 GLY A 1 22.923 2.450 9.389 1.00 1.25 H new ATOM 8 N SER A 2 20.105 3.885 9.889 1.00 54.32 N ATOM 9 CA SER A 2 18.919 4.452 9.257 1.00 4.51 C ATOM 10 C SER A 2 18.560 5.796 9.882 1.00 12.43 C ATOM 11 O SER A 2 18.529 5.936 11.105 1.00 32.23 O ATOM 12 CB SER A 2 17.739 3.488 9.381 1.00 73.01 C ATOM 13 OG SER A 2 16.604 3.978 8.688 1.00 44.42 O ATOM 0 H SER A 2 20.300 4.248 10.822 1.00 54.32 H new ATOM 0 HA SER A 2 19.141 4.610 8.202 1.00 4.51 H new ATOM 0 HB2 SER A 2 18.019 2.513 8.983 1.00 73.01 H new ATOM 0 HB3 SER A 2 17.492 3.344 10.433 1.00 73.01 H new ATOM 0 HG SER A 2 15.864 3.342 8.781 1.00 44.42 H new ATOM 19 N SER A 3 18.290 6.783 9.034 1.00 1.31 N ATOM 20 CA SER A 3 17.937 8.119 9.503 1.00 74.10 C ATOM 21 C SER A 3 17.393 8.969 8.359 1.00 4.42 C ATOM 22 O SER A 3 17.876 8.894 7.230 1.00 1.35 O ATOM 23 CB SER A 3 19.155 8.802 10.127 1.00 14.23 C ATOM 24 OG SER A 3 18.812 10.070 10.659 1.00 54.24 O ATOM 0 H SER A 3 18.309 6.683 8.019 1.00 1.31 H new ATOM 0 HA SER A 3 17.159 8.018 10.260 1.00 74.10 H new ATOM 0 HB2 SER A 3 19.565 8.172 10.916 1.00 14.23 H new ATOM 0 HB3 SER A 3 19.935 8.919 9.375 1.00 14.23 H new ATOM 0 HG SER A 3 19.607 10.485 11.054 1.00 54.24 H new ATOM 30 N GLY A 4 16.383 9.780 8.661 1.00 2.30 N ATOM 31 CA GLY A 4 15.790 10.635 7.649 1.00 31.51 C ATOM 32 C GLY A 4 14.502 10.062 7.091 1.00 13.10 C ATOM 33 O GLY A 4 14.390 8.855 6.882 1.00 63.32 O ATOM 0 H GLY A 4 15.965 9.860 9.588 1.00 2.30 H new ATOM 0 HA2 GLY A 4 15.592 11.617 8.078 1.00 31.51 H new ATOM 0 HA3 GLY A 4 16.502 10.780 6.837 1.00 31.51 H new ATOM 37 N SER A 5 13.525 10.932 6.850 1.00 44.34 N ATOM 38 CA SER A 5 12.236 10.506 6.318 1.00 62.55 C ATOM 39 C SER A 5 11.269 11.681 6.233 1.00 55.55 C ATOM 40 O SER A 5 10.612 12.033 7.213 1.00 32.24 O ATOM 41 CB SER A 5 11.639 9.401 7.193 1.00 41.13 C ATOM 42 OG SER A 5 10.276 9.183 6.878 1.00 74.22 O ATOM 0 H SER A 5 13.602 11.936 7.015 1.00 44.34 H new ATOM 0 HA SER A 5 12.396 10.117 5.313 1.00 62.55 H new ATOM 0 HB2 SER A 5 12.200 8.477 7.052 1.00 41.13 H new ATOM 0 HB3 SER A 5 11.734 9.674 8.244 1.00 41.13 H new ATOM 0 HG SER A 5 9.918 8.472 7.449 1.00 74.22 H new ATOM 48 N SER A 6 11.185 12.287 5.052 1.00 70.03 N ATOM 49 CA SER A 6 10.300 13.425 4.837 1.00 11.52 C ATOM 50 C SER A 6 10.312 13.856 3.374 1.00 44.24 C ATOM 51 O SER A 6 11.373 14.007 2.769 1.00 11.34 O ATOM 52 CB SER A 6 10.717 14.597 5.729 1.00 23.10 C ATOM 53 OG SER A 6 11.925 15.181 5.272 1.00 43.14 O ATOM 0 H SER A 6 11.720 12.008 4.230 1.00 70.03 H new ATOM 0 HA SER A 6 9.287 13.120 5.098 1.00 11.52 H new ATOM 0 HB2 SER A 6 9.928 15.348 5.740 1.00 23.10 H new ATOM 0 HB3 SER A 6 10.842 14.251 6.755 1.00 23.10 H new ATOM 0 HG SER A 6 12.169 15.928 5.857 1.00 43.14 H new ATOM 59 N GLY A 7 9.124 14.051 2.811 1.00 65.14 N ATOM 60 CA GLY A 7 9.020 14.461 1.422 1.00 72.50 C ATOM 61 C GLY A 7 7.651 15.018 1.083 1.00 2.13 C ATOM 62 O GLY A 7 6.747 15.011 1.918 1.00 33.55 O ATOM 0 H GLY A 7 8.232 13.933 3.291 1.00 65.14 H new ATOM 0 HA2 GLY A 7 9.778 15.215 1.211 1.00 72.50 H new ATOM 0 HA3 GLY A 7 9.231 13.608 0.778 1.00 72.50 H new ATOM 66 N MET A 8 7.499 15.505 -0.143 1.00 43.11 N ATOM 67 CA MET A 8 6.231 16.069 -0.589 1.00 42.30 C ATOM 68 C MET A 8 5.337 14.990 -1.192 1.00 62.14 C ATOM 69 O MET A 8 4.175 14.851 -0.812 1.00 25.41 O ATOM 70 CB MET A 8 6.474 17.177 -1.616 1.00 1.43 C ATOM 71 CG MET A 8 5.473 18.319 -1.527 1.00 64.00 C ATOM 72 SD MET A 8 6.052 19.671 -0.484 1.00 30.42 S ATOM 73 CE MET A 8 4.700 20.833 -0.655 1.00 53.21 C ATOM 0 H MET A 8 8.238 15.521 -0.846 1.00 43.11 H new ATOM 0 HA MET A 8 5.726 16.492 0.279 1.00 42.30 H new ATOM 0 HB2 MET A 8 7.480 17.575 -1.478 1.00 1.43 H new ATOM 0 HB3 MET A 8 6.435 16.748 -2.617 1.00 1.43 H new ATOM 0 HG2 MET A 8 5.271 18.699 -2.529 1.00 64.00 H new ATOM 0 HG3 MET A 8 4.530 17.940 -1.134 1.00 64.00 H new ATOM 0 HE1 MET A 8 4.911 21.725 -0.066 1.00 53.21 H new ATOM 0 HE2 MET A 8 4.588 21.109 -1.704 1.00 53.21 H new ATOM 0 HE3 MET A 8 3.778 20.373 -0.300 1.00 53.21 H new ATOM 83 N GLU A 9 5.887 14.230 -2.134 1.00 24.14 N ATOM 84 CA GLU A 9 5.139 13.164 -2.788 1.00 64.22 C ATOM 85 C GLU A 9 5.576 11.796 -2.272 1.00 75.42 C ATOM 86 O GLU A 9 6.763 11.554 -2.047 1.00 74.31 O ATOM 87 CB GLU A 9 5.331 13.234 -4.305 1.00 35.12 C ATOM 88 CG GLU A 9 4.065 13.602 -5.062 1.00 61.21 C ATOM 89 CD GLU A 9 3.347 12.389 -5.622 1.00 13.41 C ATOM 90 OE1 GLU A 9 2.659 11.697 -4.842 1.00 53.33 O ATOM 91 OE2 GLU A 9 3.473 12.133 -6.837 1.00 55.34 O ATOM 0 H GLU A 9 6.848 14.333 -2.461 1.00 24.14 H new ATOM 0 HA GLU A 9 4.083 13.300 -2.555 1.00 64.22 H new ATOM 0 HB2 GLU A 9 6.106 13.967 -4.531 1.00 35.12 H new ATOM 0 HB3 GLU A 9 5.691 12.269 -4.662 1.00 35.12 H new ATOM 0 HG2 GLU A 9 3.392 14.143 -4.396 1.00 61.21 H new ATOM 0 HG3 GLU A 9 4.318 14.279 -5.878 1.00 61.21 H new ATOM 98 N LEU A 10 4.608 10.904 -2.087 1.00 3.34 N ATOM 99 CA LEU A 10 4.891 9.560 -1.597 1.00 20.13 C ATOM 100 C LEU A 10 4.534 8.512 -2.645 1.00 75.14 C ATOM 101 O LEU A 10 5.288 7.566 -2.874 1.00 54.04 O ATOM 102 CB LEU A 10 4.114 9.293 -0.306 1.00 62.30 C ATOM 103 CG LEU A 10 4.904 9.435 0.995 1.00 73.43 C ATOM 104 CD1 LEU A 10 4.030 10.029 2.089 1.00 51.31 C ATOM 105 CD2 LEU A 10 5.463 8.088 1.430 1.00 52.02 C ATOM 0 H LEU A 10 3.621 11.088 -2.269 1.00 3.34 H new ATOM 0 HA LEU A 10 5.959 9.492 -1.392 1.00 20.13 H new ATOM 0 HB2 LEU A 10 3.265 9.976 -0.269 1.00 62.30 H new ATOM 0 HB3 LEU A 10 3.708 8.283 -0.352 1.00 62.30 H new ATOM 0 HG LEU A 10 5.739 10.113 0.817 1.00 73.43 H new ATOM 0 HD11 LEU A 10 4.610 10.122 3.007 1.00 51.31 H new ATOM 0 HD12 LEU A 10 3.679 11.013 1.780 1.00 51.31 H new ATOM 0 HD13 LEU A 10 3.174 9.377 2.265 1.00 51.31 H new ATOM 0 HD21 LEU A 10 6.022 8.209 2.358 1.00 52.02 H new ATOM 0 HD22 LEU A 10 4.643 7.388 1.589 1.00 52.02 H new ATOM 0 HD23 LEU A 10 6.125 7.701 0.655 1.00 52.02 H new ATOM 117 N PHE A 11 3.380 8.688 -3.281 1.00 35.31 N ATOM 118 CA PHE A 11 2.922 7.758 -4.306 1.00 64.52 C ATOM 119 C PHE A 11 3.610 8.037 -5.640 1.00 64.11 C ATOM 120 O PHE A 11 3.168 8.886 -6.414 1.00 72.03 O ATOM 121 CB PHE A 11 1.405 7.854 -4.473 1.00 33.44 C ATOM 122 CG PHE A 11 0.643 7.529 -3.220 1.00 13.32 C ATOM 123 CD1 PHE A 11 0.393 6.213 -2.866 1.00 2.13 C ATOM 124 CD2 PHE A 11 0.177 8.541 -2.394 1.00 75.34 C ATOM 125 CE1 PHE A 11 -0.309 5.911 -1.714 1.00 0.40 C ATOM 126 CE2 PHE A 11 -0.525 8.245 -1.241 1.00 50.11 C ATOM 127 CZ PHE A 11 -0.767 6.929 -0.900 1.00 64.00 C ATOM 0 H PHE A 11 2.745 9.467 -3.104 1.00 35.31 H new ATOM 0 HA PHE A 11 3.182 6.749 -3.986 1.00 64.52 H new ATOM 0 HB2 PHE A 11 1.146 8.863 -4.795 1.00 33.44 H new ATOM 0 HB3 PHE A 11 1.091 7.175 -5.266 1.00 33.44 H new ATOM 0 HD1 PHE A 11 0.751 5.413 -3.498 1.00 2.13 H new ATOM 0 HD2 PHE A 11 0.365 9.572 -2.655 1.00 75.34 H new ATOM 0 HE1 PHE A 11 -0.499 4.881 -1.451 1.00 0.40 H new ATOM 0 HE2 PHE A 11 -0.884 9.042 -0.607 1.00 50.11 H new ATOM 0 HZ PHE A 11 -1.314 6.696 0.002 1.00 64.00 H new ATOM 137 N THR A 12 4.697 7.317 -5.901 1.00 53.23 N ATOM 138 CA THR A 12 5.448 7.488 -7.139 1.00 32.14 C ATOM 139 C THR A 12 5.936 6.147 -7.675 1.00 52.11 C ATOM 140 O THR A 12 6.272 5.246 -6.907 1.00 1.35 O ATOM 141 CB THR A 12 6.658 8.419 -6.937 1.00 1.41 C ATOM 142 OG1 THR A 12 7.436 7.976 -5.820 1.00 12.30 O ATOM 143 CG2 THR A 12 6.205 9.854 -6.710 1.00 30.12 C ATOM 0 H THR A 12 5.077 6.610 -5.272 1.00 53.23 H new ATOM 0 HA THR A 12 4.769 7.939 -7.862 1.00 32.14 H new ATOM 0 HB THR A 12 7.268 8.386 -7.839 1.00 1.41 H new ATOM 0 HG1 THR A 12 8.204 8.572 -5.699 1.00 12.30 H new ATOM 0 HG21 THR A 12 7.077 10.493 -6.570 1.00 30.12 H new ATOM 0 HG22 THR A 12 5.638 10.198 -7.575 1.00 30.12 H new ATOM 0 HG23 THR A 12 5.575 9.900 -5.822 1.00 30.12 H new ATOM 151 N GLU A 13 5.973 6.022 -8.997 1.00 62.04 N ATOM 152 CA GLU A 13 6.422 4.789 -9.635 1.00 53.32 C ATOM 153 C GLU A 13 7.689 4.262 -8.969 1.00 45.15 C ATOM 154 O GLU A 13 7.844 3.057 -8.773 1.00 4.02 O ATOM 155 CB GLU A 13 6.675 5.023 -11.126 1.00 42.11 C ATOM 156 CG GLU A 13 6.344 3.822 -11.996 1.00 52.52 C ATOM 157 CD GLU A 13 7.391 3.568 -13.062 1.00 52.23 C ATOM 158 OE1 GLU A 13 7.547 4.424 -13.958 1.00 21.43 O ATOM 159 OE2 GLU A 13 8.055 2.512 -13.001 1.00 23.03 O ATOM 0 H GLU A 13 5.698 6.758 -9.647 1.00 62.04 H new ATOM 0 HA GLU A 13 5.635 4.043 -9.520 1.00 53.32 H new ATOM 0 HB2 GLU A 13 6.082 5.875 -11.457 1.00 42.11 H new ATOM 0 HB3 GLU A 13 7.722 5.288 -11.271 1.00 42.11 H new ATOM 0 HG2 GLU A 13 6.250 2.937 -11.367 1.00 52.52 H new ATOM 0 HG3 GLU A 13 5.376 3.979 -12.473 1.00 52.52 H new ATOM 166 N ALA A 14 8.594 5.173 -8.626 1.00 14.42 N ATOM 167 CA ALA A 14 9.847 4.802 -7.982 1.00 33.45 C ATOM 168 C ALA A 14 9.592 3.997 -6.711 1.00 3.42 C ATOM 169 O ALA A 14 10.140 2.909 -6.534 1.00 24.15 O ATOM 170 CB ALA A 14 10.668 6.043 -7.666 1.00 73.12 C ATOM 0 H ALA A 14 8.482 6.174 -8.784 1.00 14.42 H new ATOM 0 HA ALA A 14 10.410 4.175 -8.673 1.00 33.45 H new ATOM 0 HB1 ALA A 14 11.601 5.749 -7.185 1.00 73.12 H new ATOM 0 HB2 ALA A 14 10.889 6.578 -8.590 1.00 73.12 H new ATOM 0 HB3 ALA A 14 10.103 6.692 -6.996 1.00 73.12 H new ATOM 176 N TRP A 15 8.759 4.539 -5.829 1.00 42.25 N ATOM 177 CA TRP A 15 8.434 3.871 -4.575 1.00 51.21 C ATOM 178 C TRP A 15 7.666 2.579 -4.829 1.00 61.45 C ATOM 179 O TRP A 15 7.887 1.572 -4.157 1.00 70.20 O ATOM 180 CB TRP A 15 7.613 4.799 -3.678 1.00 33.55 C ATOM 181 CG TRP A 15 7.340 4.224 -2.320 1.00 51.51 C ATOM 182 CD1 TRP A 15 8.078 4.414 -1.187 1.00 45.52 C ATOM 183 CD2 TRP A 15 6.254 3.365 -1.955 1.00 4.32 C ATOM 184 NE1 TRP A 15 7.516 3.725 -0.140 1.00 4.23 N ATOM 185 CE2 TRP A 15 6.396 3.074 -0.584 1.00 24.11 C ATOM 186 CE3 TRP A 15 5.175 2.816 -2.652 1.00 54.13 C ATOM 187 CZ2 TRP A 15 5.500 2.257 0.100 1.00 44.41 C ATOM 188 CZ3 TRP A 15 4.286 2.005 -1.972 1.00 65.21 C ATOM 189 CH2 TRP A 15 4.453 1.732 -0.607 1.00 54.34 C ATOM 0 H TRP A 15 8.297 5.439 -5.960 1.00 42.25 H new ATOM 0 HA TRP A 15 9.368 3.623 -4.072 1.00 51.21 H new ATOM 0 HB2 TRP A 15 8.143 5.745 -3.564 1.00 33.55 H new ATOM 0 HB3 TRP A 15 6.665 5.021 -4.168 1.00 33.55 H new ATOM 0 HD1 TRP A 15 8.972 5.017 -1.123 1.00 45.52 H new ATOM 0 HE1 TRP A 15 7.875 3.702 0.814 1.00 4.23 H new ATOM 0 HE3 TRP A 15 5.038 3.022 -3.703 1.00 54.13 H new ATOM 0 HZ2 TRP A 15 5.627 2.045 1.151 1.00 44.41 H new ATOM 0 HZ3 TRP A 15 3.449 1.574 -2.501 1.00 65.21 H new ATOM 0 HH2 TRP A 15 3.741 1.095 -0.104 1.00 54.34 H new ATOM 200 N ALA A 16 6.762 2.614 -5.803 1.00 63.00 N ATOM 201 CA ALA A 16 5.964 1.444 -6.147 1.00 75.14 C ATOM 202 C ALA A 16 6.852 0.272 -6.550 1.00 45.55 C ATOM 203 O ALA A 16 6.705 -0.836 -6.036 1.00 2.43 O ATOM 204 CB ALA A 16 4.990 1.781 -7.267 1.00 51.23 C ATOM 0 H ALA A 16 6.564 3.440 -6.368 1.00 63.00 H new ATOM 0 HA ALA A 16 5.398 1.149 -5.264 1.00 75.14 H new ATOM 0 HB1 ALA A 16 4.400 0.898 -7.514 1.00 51.23 H new ATOM 0 HB2 ALA A 16 4.326 2.582 -6.943 1.00 51.23 H new ATOM 0 HB3 ALA A 16 5.546 2.104 -8.147 1.00 51.23 H new ATOM 210 N GLN A 17 7.773 0.524 -7.476 1.00 14.33 N ATOM 211 CA GLN A 17 8.683 -0.511 -7.949 1.00 4.10 C ATOM 212 C GLN A 17 9.735 -0.835 -6.892 1.00 74.35 C ATOM 213 O GLN A 17 9.952 -1.999 -6.555 1.00 40.43 O ATOM 214 CB GLN A 17 9.365 -0.068 -9.245 1.00 32.21 C ATOM 215 CG GLN A 17 8.390 0.228 -10.374 1.00 21.01 C ATOM 216 CD GLN A 17 8.736 -0.511 -11.651 1.00 50.03 C ATOM 217 OE1 GLN A 17 9.871 -0.948 -11.843 1.00 11.24 O ATOM 218 NE2 GLN A 17 7.755 -0.656 -12.535 1.00 61.03 N ATOM 0 H GLN A 17 7.908 1.436 -7.913 1.00 14.33 H new ATOM 0 HA GLN A 17 8.100 -1.411 -8.143 1.00 4.10 H new ATOM 0 HB2 GLN A 17 9.960 0.823 -9.047 1.00 32.21 H new ATOM 0 HB3 GLN A 17 10.056 -0.847 -9.567 1.00 32.21 H new ATOM 0 HG2 GLN A 17 7.383 -0.047 -10.061 1.00 21.01 H new ATOM 0 HG3 GLN A 17 8.381 1.300 -10.570 1.00 21.01 H new ATOM 0 HE21 GLN A 17 6.829 -0.278 -12.336 1.00 61.03 H new ATOM 0 HE22 GLN A 17 7.928 -1.145 -13.413 1.00 61.03 H new ATOM 227 N ALA A 18 10.386 0.201 -6.376 1.00 15.32 N ATOM 228 CA ALA A 18 11.414 0.027 -5.357 1.00 11.40 C ATOM 229 C ALA A 18 10.869 -0.733 -4.152 1.00 51.14 C ATOM 230 O ALA A 18 11.563 -1.564 -3.565 1.00 10.21 O ATOM 231 CB ALA A 18 11.964 1.378 -4.925 1.00 43.11 C ATOM 0 H ALA A 18 10.220 1.170 -6.647 1.00 15.32 H new ATOM 0 HA ALA A 18 12.223 -0.561 -5.790 1.00 11.40 H new ATOM 0 HB1 ALA A 18 12.731 1.232 -4.164 1.00 43.11 H new ATOM 0 HB2 ALA A 18 12.399 1.886 -5.786 1.00 43.11 H new ATOM 0 HB3 ALA A 18 11.157 1.985 -4.515 1.00 43.11 H new ATOM 237 N TYR A 19 9.625 -0.443 -3.788 1.00 42.13 N ATOM 238 CA TYR A 19 8.989 -1.098 -2.651 1.00 40.45 C ATOM 239 C TYR A 19 8.653 -2.549 -2.976 1.00 60.41 C ATOM 240 O TYR A 19 8.651 -3.412 -2.096 1.00 52.40 O ATOM 241 CB TYR A 19 7.719 -0.347 -2.249 1.00 52.32 C ATOM 242 CG TYR A 19 6.911 -1.051 -1.182 1.00 54.21 C ATOM 243 CD1 TYR A 19 7.486 -1.405 0.031 1.00 3.33 C ATOM 244 CD2 TYR A 19 5.572 -1.360 -1.387 1.00 61.04 C ATOM 245 CE1 TYR A 19 6.753 -2.049 1.009 1.00 53.53 C ATOM 246 CE2 TYR A 19 4.829 -2.002 -0.416 1.00 65.41 C ATOM 247 CZ TYR A 19 5.425 -2.345 0.781 1.00 72.40 C ATOM 248 OH TYR A 19 4.689 -2.985 1.752 1.00 63.43 O ATOM 0 H TYR A 19 9.037 0.241 -4.264 1.00 42.13 H new ATOM 0 HA TYR A 19 9.691 -1.085 -1.817 1.00 40.45 H new ATOM 0 HB2 TYR A 19 7.992 0.645 -1.890 1.00 52.32 H new ATOM 0 HB3 TYR A 19 7.095 -0.207 -3.132 1.00 52.32 H new ATOM 0 HD1 TYR A 19 8.525 -1.173 0.213 1.00 3.33 H new ATOM 0 HD2 TYR A 19 5.104 -1.093 -2.323 1.00 61.04 H new ATOM 0 HE1 TYR A 19 7.217 -2.319 1.946 1.00 53.53 H new ATOM 0 HE2 TYR A 19 3.789 -2.234 -0.592 1.00 65.41 H new ATOM 0 HH TYR A 19 4.686 -2.445 2.570 1.00 63.43 H new ATOM 258 N CYS A 20 8.369 -2.814 -4.247 1.00 64.30 N ATOM 259 CA CYS A 20 8.032 -4.162 -4.692 1.00 42.30 C ATOM 260 C CYS A 20 9.207 -5.112 -4.485 1.00 62.03 C ATOM 261 O CYS A 20 9.028 -6.256 -4.067 1.00 31.23 O ATOM 262 CB CYS A 20 7.625 -4.148 -6.167 1.00 5.32 C ATOM 263 SG CYS A 20 7.051 -5.758 -6.795 1.00 2.10 S ATOM 0 H CYS A 20 8.365 -2.113 -4.988 1.00 64.30 H new ATOM 0 HA CYS A 20 7.192 -4.516 -4.094 1.00 42.30 H new ATOM 0 HB2 CYS A 20 6.833 -3.412 -6.307 1.00 5.32 H new ATOM 0 HB3 CYS A 20 8.475 -3.819 -6.764 1.00 5.32 H new ATOM 268 N ARG A 21 10.410 -4.631 -4.783 1.00 1.12 N ATOM 269 CA ARG A 21 11.615 -5.438 -4.631 1.00 53.12 C ATOM 270 C ARG A 21 12.077 -5.456 -3.178 1.00 25.23 C ATOM 271 O ARG A 21 12.523 -6.484 -2.668 1.00 31.32 O ATOM 272 CB ARG A 21 12.731 -4.899 -5.527 1.00 23.55 C ATOM 273 CG ARG A 21 12.634 -5.367 -6.970 1.00 0.33 C ATOM 274 CD ARG A 21 13.261 -4.362 -7.924 1.00 65.40 C ATOM 275 NE ARG A 21 14.528 -4.844 -8.469 1.00 22.11 N ATOM 276 CZ ARG A 21 15.695 -4.705 -7.848 1.00 52.35 C ATOM 277 NH1 ARG A 21 15.755 -4.104 -6.669 1.00 13.12 N ATOM 278 NH2 ARG A 21 16.805 -5.169 -8.409 1.00 34.41 N ATOM 0 H ARG A 21 10.576 -3.687 -5.131 1.00 1.12 H new ATOM 0 HA ARG A 21 11.379 -6.459 -4.931 1.00 53.12 H new ATOM 0 HB2 ARG A 21 12.708 -3.809 -5.505 1.00 23.55 H new ATOM 0 HB3 ARG A 21 13.694 -5.206 -5.118 1.00 23.55 H new ATOM 0 HG2 ARG A 21 13.132 -6.331 -7.076 1.00 0.33 H new ATOM 0 HG3 ARG A 21 11.588 -5.518 -7.235 1.00 0.33 H new ATOM 0 HD2 ARG A 21 12.569 -4.157 -8.741 1.00 65.40 H new ATOM 0 HD3 ARG A 21 13.426 -3.420 -7.402 1.00 65.40 H new ATOM 0 HE ARG A 21 14.516 -5.312 -9.375 1.00 22.11 H new ATOM 0 HH11 ARG A 21 14.904 -3.746 -6.235 1.00 13.12 H new ATOM 0 HH12 ARG A 21 16.652 -3.999 -6.195 1.00 13.12 H new ATOM 0 HH21 ARG A 21 16.762 -5.632 -9.317 1.00 34.41 H new ATOM 0 HH22 ARG A 21 17.700 -5.062 -7.932 1.00 34.41 H new ATOM 292 N LYS A 22 11.971 -4.309 -2.514 1.00 62.33 N ATOM 293 CA LYS A 22 12.378 -4.191 -1.118 1.00 72.42 C ATOM 294 C LYS A 22 11.714 -5.268 -0.266 1.00 34.12 C ATOM 295 O LYS A 22 12.319 -5.794 0.669 1.00 60.42 O ATOM 296 CB LYS A 22 12.022 -2.805 -0.578 1.00 30.31 C ATOM 297 CG LYS A 22 12.956 -2.322 0.518 1.00 13.54 C ATOM 298 CD LYS A 22 14.235 -1.736 -0.057 1.00 74.53 C ATOM 299 CE LYS A 22 14.578 -0.404 0.589 1.00 51.31 C ATOM 300 NZ LYS A 22 16.049 -0.186 0.665 1.00 70.23 N ATOM 0 H LYS A 22 11.606 -3.448 -2.921 1.00 62.33 H new ATOM 0 HA LYS A 22 13.458 -4.327 -1.066 1.00 72.42 H new ATOM 0 HB2 LYS A 22 12.038 -2.089 -1.400 1.00 30.31 H new ATOM 0 HB3 LYS A 22 11.003 -2.825 -0.193 1.00 30.31 H new ATOM 0 HG2 LYS A 22 12.450 -1.570 1.123 1.00 13.54 H new ATOM 0 HG3 LYS A 22 13.201 -3.152 1.181 1.00 13.54 H new ATOM 0 HD2 LYS A 22 15.057 -2.436 0.093 1.00 74.53 H new ATOM 0 HD3 LYS A 22 14.123 -1.601 -1.133 1.00 74.53 H new ATOM 0 HE2 LYS A 22 14.120 0.404 0.019 1.00 51.31 H new ATOM 0 HE3 LYS A 22 14.153 -0.367 1.592 1.00 51.31 H new ATOM 0 HZ1 LYS A 22 16.241 0.733 1.112 1.00 70.23 H new ATOM 0 HZ2 LYS A 22 16.483 -0.943 1.230 1.00 70.23 H new ATOM 0 HZ3 LYS A 22 16.451 -0.196 -0.294 1.00 70.23 H new ATOM 314 N LEU A 23 10.468 -5.590 -0.594 1.00 32.30 N ATOM 315 CA LEU A 23 9.721 -6.605 0.142 1.00 62.54 C ATOM 316 C LEU A 23 10.345 -7.985 -0.049 1.00 0.11 C ATOM 317 O LEU A 23 10.527 -8.733 0.910 1.00 34.13 O ATOM 318 CB LEU A 23 8.262 -6.625 -0.315 1.00 74.31 C ATOM 319 CG LEU A 23 7.432 -5.390 0.034 1.00 51.32 C ATOM 320 CD1 LEU A 23 6.090 -5.428 -0.679 1.00 62.43 C ATOM 321 CD2 LEU A 23 7.236 -5.288 1.539 1.00 34.12 C ATOM 0 H LEU A 23 9.953 -5.163 -1.364 1.00 32.30 H new ATOM 0 HA LEU A 23 9.759 -6.352 1.202 1.00 62.54 H new ATOM 0 HB2 LEU A 23 8.243 -6.757 -1.397 1.00 74.31 H new ATOM 0 HB3 LEU A 23 7.778 -7.499 0.121 1.00 74.31 H new ATOM 0 HG LEU A 23 7.973 -4.506 -0.303 1.00 51.32 H new ATOM 0 HD11 LEU A 23 5.514 -4.540 -0.418 1.00 62.43 H new ATOM 0 HD12 LEU A 23 6.251 -5.452 -1.757 1.00 62.43 H new ATOM 0 HD13 LEU A 23 5.541 -6.319 -0.375 1.00 62.43 H new ATOM 0 HD21 LEU A 23 6.643 -4.403 1.770 1.00 34.12 H new ATOM 0 HD22 LEU A 23 6.717 -6.176 1.899 1.00 34.12 H new ATOM 0 HD23 LEU A 23 8.207 -5.211 2.028 1.00 34.12 H new ATOM 333 N ASN A 24 10.672 -8.313 -1.295 1.00 1.05 N ATOM 334 CA ASN A 24 11.277 -9.602 -1.612 1.00 60.12 C ATOM 335 C ASN A 24 12.450 -9.896 -0.681 1.00 62.05 C ATOM 336 O ASN A 24 12.793 -11.054 -0.446 1.00 12.34 O ATOM 337 CB ASN A 24 11.749 -9.623 -3.068 1.00 11.15 C ATOM 338 CG ASN A 24 10.781 -10.355 -3.978 1.00 24.23 C ATOM 339 OD1 ASN A 24 10.540 -11.551 -3.812 1.00 11.32 O ATOM 340 ND2 ASN A 24 10.224 -9.639 -4.947 1.00 32.30 N ATOM 0 H ASN A 24 10.528 -7.705 -2.101 1.00 1.05 H new ATOM 0 HA ASN A 24 10.521 -10.375 -1.471 1.00 60.12 H new ATOM 0 HB2 ASN A 24 11.873 -8.600 -3.422 1.00 11.15 H new ATOM 0 HB3 ASN A 24 12.727 -10.100 -3.123 1.00 11.15 H new ATOM 0 HD21 ASN A 24 9.567 -10.078 -5.592 1.00 32.30 H new ATOM 0 HD22 ASN A 24 10.453 -8.650 -5.047 1.00 32.30 H new ATOM 347 N GLU A 25 13.061 -8.838 -0.156 1.00 34.11 N ATOM 348 CA GLU A 25 14.195 -8.984 0.749 1.00 2.42 C ATOM 349 C GLU A 25 13.747 -9.540 2.098 1.00 63.15 C ATOM 350 O GLU A 25 14.415 -10.393 2.681 1.00 25.12 O ATOM 351 CB GLU A 25 14.895 -7.637 0.947 1.00 73.03 C ATOM 352 CG GLU A 25 15.283 -6.956 -0.355 1.00 60.12 C ATOM 353 CD GLU A 25 16.689 -6.390 -0.320 1.00 64.44 C ATOM 354 OE1 GLU A 25 17.647 -7.170 -0.509 1.00 74.10 O ATOM 355 OE2 GLU A 25 16.833 -5.169 -0.103 1.00 73.51 O ATOM 0 H GLU A 25 12.790 -7.872 -0.342 1.00 34.11 H new ATOM 0 HA GLU A 25 14.896 -9.688 0.301 1.00 2.42 H new ATOM 0 HB2 GLU A 25 14.238 -6.975 1.512 1.00 73.03 H new ATOM 0 HB3 GLU A 25 15.791 -7.788 1.550 1.00 73.03 H new ATOM 0 HG2 GLU A 25 15.204 -7.672 -1.173 1.00 60.12 H new ATOM 0 HG3 GLU A 25 14.577 -6.153 -0.565 1.00 60.12 H new ATOM 362 N SER A 26 12.614 -9.048 2.587 1.00 61.32 N ATOM 363 CA SER A 26 12.079 -9.492 3.869 1.00 51.12 C ATOM 364 C SER A 26 11.460 -10.881 3.748 1.00 51.21 C ATOM 365 O SER A 26 10.301 -11.024 3.362 1.00 34.22 O ATOM 366 CB SER A 26 11.033 -8.499 4.381 1.00 42.25 C ATOM 367 OG SER A 26 11.259 -8.177 5.742 1.00 31.43 O ATOM 0 H SER A 26 12.049 -8.342 2.115 1.00 61.32 H new ATOM 0 HA SER A 26 12.903 -9.541 4.581 1.00 51.12 H new ATOM 0 HB2 SER A 26 11.064 -7.591 3.779 1.00 42.25 H new ATOM 0 HB3 SER A 26 10.036 -8.924 4.265 1.00 42.25 H new ATOM 0 HG SER A 26 10.579 -7.540 6.045 1.00 31.43 H new ATOM 373 N GLU A 27 12.244 -11.902 4.080 1.00 31.53 N ATOM 374 CA GLU A 27 11.773 -13.281 4.008 1.00 4.24 C ATOM 375 C GLU A 27 10.522 -13.474 4.859 1.00 2.13 C ATOM 376 O GLU A 27 9.606 -14.202 4.478 1.00 31.14 O ATOM 377 CB GLU A 27 12.871 -14.242 4.469 1.00 54.31 C ATOM 378 CG GLU A 27 12.964 -15.506 3.630 1.00 33.35 C ATOM 379 CD GLU A 27 14.279 -15.614 2.884 1.00 60.53 C ATOM 380 OE1 GLU A 27 15.338 -15.615 3.545 1.00 64.41 O ATOM 381 OE2 GLU A 27 14.249 -15.698 1.638 1.00 71.01 O ATOM 0 H GLU A 27 13.207 -11.801 4.401 1.00 31.53 H new ATOM 0 HA GLU A 27 11.521 -13.499 2.970 1.00 4.24 H new ATOM 0 HB2 GLU A 27 13.830 -13.725 4.440 1.00 54.31 H new ATOM 0 HB3 GLU A 27 12.689 -14.518 5.508 1.00 54.31 H new ATOM 0 HG2 GLU A 27 12.844 -16.376 4.276 1.00 33.35 H new ATOM 0 HG3 GLU A 27 12.142 -15.524 2.915 1.00 33.35 H new ATOM 388 N ALA A 28 10.491 -12.816 6.014 1.00 20.30 N ATOM 389 CA ALA A 28 9.353 -12.913 6.919 1.00 32.42 C ATOM 390 C ALA A 28 8.054 -12.547 6.209 1.00 62.10 C ATOM 391 O ALA A 28 7.091 -13.313 6.222 1.00 73.54 O ATOM 392 CB ALA A 28 9.565 -12.020 8.132 1.00 53.04 C ATOM 0 H ALA A 28 11.242 -12.210 6.344 1.00 20.30 H new ATOM 0 HA ALA A 28 9.274 -13.947 7.254 1.00 32.42 H new ATOM 0 HB1 ALA A 28 8.707 -12.103 8.799 1.00 53.04 H new ATOM 0 HB2 ALA A 28 10.466 -12.331 8.660 1.00 53.04 H new ATOM 0 HB3 ALA A 28 9.674 -10.985 7.807 1.00 53.04 H new ATOM 398 N TYR A 29 8.035 -11.372 5.591 1.00 41.52 N ATOM 399 CA TYR A 29 6.853 -10.902 4.878 1.00 12.05 C ATOM 400 C TYR A 29 6.282 -12.000 3.987 1.00 71.03 C ATOM 401 O TYR A 29 5.124 -12.392 4.130 1.00 25.11 O ATOM 402 CB TYR A 29 7.195 -9.672 4.036 1.00 51.32 C ATOM 403 CG TYR A 29 6.262 -9.462 2.864 1.00 23.42 C ATOM 404 CD1 TYR A 29 4.888 -9.374 3.051 1.00 3.43 C ATOM 405 CD2 TYR A 29 6.756 -9.354 1.569 1.00 33.31 C ATOM 406 CE1 TYR A 29 4.033 -9.183 1.983 1.00 53.20 C ATOM 407 CE2 TYR A 29 5.908 -9.162 0.496 1.00 12.03 C ATOM 408 CZ TYR A 29 4.547 -9.077 0.708 1.00 22.12 C ATOM 409 OH TYR A 29 3.699 -8.888 -0.359 1.00 41.11 O ATOM 0 H TYR A 29 8.825 -10.727 5.569 1.00 41.52 H new ATOM 0 HA TYR A 29 6.099 -10.630 5.616 1.00 12.05 H new ATOM 0 HB2 TYR A 29 7.170 -8.788 4.673 1.00 51.32 H new ATOM 0 HB3 TYR A 29 8.215 -9.768 3.665 1.00 51.32 H new ATOM 0 HD1 TYR A 29 4.482 -9.456 4.048 1.00 3.43 H new ATOM 0 HD2 TYR A 29 7.820 -9.421 1.399 1.00 33.31 H new ATOM 0 HE1 TYR A 29 2.967 -9.117 2.146 1.00 53.20 H new ATOM 0 HE2 TYR A 29 6.308 -9.079 -0.504 1.00 12.03 H new ATOM 0 HH TYR A 29 3.816 -9.618 -1.003 1.00 41.11 H new ATOM 419 N ARG A 30 7.105 -12.492 3.065 1.00 33.24 N ATOM 420 CA ARG A 30 6.683 -13.545 2.149 1.00 2.04 C ATOM 421 C ARG A 30 5.954 -14.658 2.898 1.00 13.11 C ATOM 422 O ARG A 30 4.877 -15.094 2.490 1.00 43.32 O ATOM 423 CB ARG A 30 7.892 -14.121 1.410 1.00 63.02 C ATOM 424 CG ARG A 30 7.611 -14.461 -0.045 1.00 2.13 C ATOM 425 CD ARG A 30 7.711 -15.957 -0.297 1.00 42.21 C ATOM 426 NE ARG A 30 7.370 -16.303 -1.674 1.00 23.40 N ATOM 427 CZ ARG A 30 7.618 -17.491 -2.216 1.00 2.24 C ATOM 428 NH1 ARG A 30 8.206 -18.440 -1.500 1.00 73.41 N ATOM 429 NH2 ARG A 30 7.279 -17.731 -3.475 1.00 71.34 N ATOM 0 H ARG A 30 8.067 -12.178 2.933 1.00 33.24 H new ATOM 0 HA ARG A 30 5.996 -13.108 1.424 1.00 2.04 H new ATOM 0 HB2 ARG A 30 8.711 -13.403 1.455 1.00 63.02 H new ATOM 0 HB3 ARG A 30 8.228 -15.020 1.926 1.00 63.02 H new ATOM 0 HG2 ARG A 30 6.615 -14.111 -0.316 1.00 2.13 H new ATOM 0 HG3 ARG A 30 8.319 -13.935 -0.686 1.00 2.13 H new ATOM 0 HD2 ARG A 30 8.724 -16.295 -0.078 1.00 42.21 H new ATOM 0 HD3 ARG A 30 7.045 -16.485 0.385 1.00 42.21 H new ATOM 0 HE ARG A 30 6.917 -15.595 -2.251 1.00 23.40 H new ATOM 0 HH11 ARG A 30 8.469 -18.259 -0.531 1.00 73.41 H new ATOM 0 HH12 ARG A 30 8.395 -19.351 -1.918 1.00 73.41 H new ATOM 0 HH21 ARG A 30 6.827 -17.003 -4.029 1.00 71.34 H new ATOM 0 HH22 ARG A 30 7.470 -18.643 -3.890 1.00 71.34 H new ATOM 443 N LYS A 31 6.548 -15.112 3.996 1.00 62.52 N ATOM 444 CA LYS A 31 5.956 -16.173 4.803 1.00 31.31 C ATOM 445 C LYS A 31 4.591 -15.752 5.337 1.00 30.51 C ATOM 446 O LYS A 31 3.696 -16.582 5.502 1.00 73.12 O ATOM 447 CB LYS A 31 6.882 -16.534 5.967 1.00 41.23 C ATOM 448 CG LYS A 31 8.229 -17.080 5.526 1.00 51.22 C ATOM 449 CD LYS A 31 8.842 -17.976 6.588 1.00 31.11 C ATOM 450 CE LYS A 31 9.678 -19.085 5.966 1.00 22.44 C ATOM 451 NZ LYS A 31 10.844 -19.446 6.820 1.00 33.11 N ATOM 0 H LYS A 31 7.439 -14.762 4.348 1.00 62.52 H new ATOM 0 HA LYS A 31 5.824 -17.049 4.167 1.00 31.31 H new ATOM 0 HB2 LYS A 31 7.042 -15.648 6.581 1.00 41.23 H new ATOM 0 HB3 LYS A 31 6.388 -17.274 6.597 1.00 41.23 H new ATOM 0 HG2 LYS A 31 8.109 -17.642 4.600 1.00 51.22 H new ATOM 0 HG3 LYS A 31 8.906 -16.253 5.312 1.00 51.22 H new ATOM 0 HD2 LYS A 31 9.465 -17.379 7.254 1.00 31.11 H new ATOM 0 HD3 LYS A 31 8.051 -18.413 7.198 1.00 31.11 H new ATOM 0 HE2 LYS A 31 9.055 -19.966 5.811 1.00 22.44 H new ATOM 0 HE3 LYS A 31 10.031 -18.767 4.985 1.00 22.44 H new ATOM 0 HZ1 LYS A 31 11.388 -20.205 6.362 1.00 33.11 H new ATOM 0 HZ2 LYS A 31 11.452 -18.612 6.948 1.00 33.11 H new ATOM 0 HZ3 LYS A 31 10.507 -19.774 7.748 1.00 33.11 H new ATOM 465 N ALA A 32 4.437 -14.460 5.605 1.00 63.31 N ATOM 466 CA ALA A 32 3.179 -13.930 6.116 1.00 22.21 C ATOM 467 C ALA A 32 2.099 -13.942 5.040 1.00 65.14 C ATOM 468 O ALA A 32 1.027 -14.515 5.230 1.00 44.31 O ATOM 469 CB ALA A 32 3.380 -12.519 6.650 1.00 72.50 C ATOM 0 H ALA A 32 5.168 -13.760 5.477 1.00 63.31 H new ATOM 0 HA ALA A 32 2.847 -14.572 6.932 1.00 22.21 H new ATOM 0 HB1 ALA A 32 2.433 -12.135 7.029 1.00 72.50 H new ATOM 0 HB2 ALA A 32 4.113 -12.536 7.457 1.00 72.50 H new ATOM 0 HB3 ALA A 32 3.738 -11.874 5.848 1.00 72.50 H new ATOM 475 N ALA A 33 2.390 -13.306 3.910 1.00 62.45 N ATOM 476 CA ALA A 33 1.444 -13.246 2.802 1.00 4.24 C ATOM 477 C ALA A 33 1.574 -14.470 1.902 1.00 54.32 C ATOM 478 O ALA A 33 1.357 -14.389 0.693 1.00 52.24 O ATOM 479 CB ALA A 33 1.656 -11.972 1.997 1.00 30.42 C ATOM 0 H ALA A 33 3.273 -12.825 3.738 1.00 62.45 H new ATOM 0 HA ALA A 33 0.436 -13.238 3.217 1.00 4.24 H new ATOM 0 HB1 ALA A 33 0.943 -11.940 1.173 1.00 30.42 H new ATOM 0 HB2 ALA A 33 1.506 -11.105 2.641 1.00 30.42 H new ATOM 0 HB3 ALA A 33 2.671 -11.957 1.600 1.00 30.42 H new ATOM 485 N SER A 34 1.928 -15.603 2.500 1.00 73.43 N ATOM 486 CA SER A 34 2.090 -16.844 1.751 1.00 40.54 C ATOM 487 C SER A 34 0.813 -17.190 0.991 1.00 62.44 C ATOM 488 O SER A 34 -0.293 -16.896 1.443 1.00 51.42 O ATOM 489 CB SER A 34 2.461 -17.989 2.694 1.00 24.11 C ATOM 490 OG SER A 34 2.760 -19.170 1.971 1.00 63.01 O ATOM 0 H SER A 34 2.108 -15.687 3.500 1.00 73.43 H new ATOM 0 HA SER A 34 2.895 -16.702 1.030 1.00 40.54 H new ATOM 0 HB2 SER A 34 3.321 -17.702 3.299 1.00 24.11 H new ATOM 0 HB3 SER A 34 1.637 -18.179 3.382 1.00 24.11 H new ATOM 0 HG SER A 34 2.996 -19.886 2.597 1.00 63.01 H new ATOM 496 N THR A 35 0.975 -17.819 -0.170 1.00 13.13 N ATOM 497 CA THR A 35 -0.162 -18.206 -0.994 1.00 60.14 C ATOM 498 C THR A 35 -1.177 -17.072 -1.097 1.00 64.35 C ATOM 499 O THR A 35 -2.361 -17.307 -1.340 1.00 42.12 O ATOM 500 CB THR A 35 -0.863 -19.458 -0.434 1.00 62.04 C ATOM 501 OG1 THR A 35 -1.846 -19.927 -1.365 1.00 2.13 O ATOM 502 CG2 THR A 35 -1.526 -19.155 0.901 1.00 23.24 C ATOM 0 H THR A 35 1.883 -18.071 -0.560 1.00 13.13 H new ATOM 0 HA THR A 35 0.229 -18.432 -1.986 1.00 60.14 H new ATOM 0 HB THR A 35 -0.110 -20.231 -0.281 1.00 62.04 H new ATOM 0 HG1 THR A 35 -2.326 -19.163 -1.747 1.00 2.13 H new ATOM 0 HG21 THR A 35 -2.015 -20.054 1.277 1.00 23.24 H new ATOM 0 HG22 THR A 35 -0.771 -18.826 1.616 1.00 23.24 H new ATOM 0 HG23 THR A 35 -2.268 -18.367 0.768 1.00 23.24 H new ATOM 510 N TRP A 36 -0.706 -15.844 -0.913 1.00 35.51 N ATOM 511 CA TRP A 36 -1.574 -14.675 -0.986 1.00 3.12 C ATOM 512 C TRP A 36 -2.338 -14.645 -2.305 1.00 4.41 C ATOM 513 O TRP A 36 -3.567 -14.594 -2.317 1.00 42.14 O ATOM 514 CB TRP A 36 -0.751 -13.394 -0.829 1.00 33.12 C ATOM 515 CG TRP A 36 -1.379 -12.201 -1.486 1.00 23.42 C ATOM 516 CD1 TRP A 36 -1.345 -11.885 -2.814 1.00 72.34 C ATOM 517 CD2 TRP A 36 -2.130 -11.166 -0.844 1.00 32.01 C ATOM 518 NE1 TRP A 36 -2.032 -10.715 -3.036 1.00 23.42 N ATOM 519 CE2 TRP A 36 -2.523 -10.256 -1.844 1.00 0.33 C ATOM 520 CE3 TRP A 36 -2.512 -10.921 0.478 1.00 30.31 C ATOM 521 CZ2 TRP A 36 -3.277 -9.120 -1.560 1.00 51.40 C ATOM 522 CZ3 TRP A 36 -3.259 -9.793 0.758 1.00 32.11 C ATOM 523 CH2 TRP A 36 -3.637 -8.904 -0.258 1.00 4.42 C ATOM 0 H TRP A 36 0.271 -15.632 -0.712 1.00 35.51 H new ATOM 0 HA TRP A 36 -2.296 -14.738 -0.172 1.00 3.12 H new ATOM 0 HB2 TRP A 36 -0.615 -13.186 0.232 1.00 33.12 H new ATOM 0 HB3 TRP A 36 0.241 -13.553 -1.253 1.00 33.12 H new ATOM 0 HD1 TRP A 36 -0.851 -12.468 -3.577 1.00 72.34 H new ATOM 0 HE1 TRP A 36 -2.156 -10.263 -3.942 1.00 23.42 H new ATOM 0 HE3 TRP A 36 -2.228 -11.602 1.267 1.00 30.31 H new ATOM 0 HZ2 TRP A 36 -3.568 -8.433 -2.341 1.00 51.40 H new ATOM 0 HZ3 TRP A 36 -3.557 -9.593 1.777 1.00 32.11 H new ATOM 0 HH2 TRP A 36 -4.223 -8.032 -0.008 1.00 4.42 H new ATOM 534 N GLU A 37 -1.602 -14.677 -3.411 1.00 52.15 N ATOM 535 CA GLU A 37 -2.213 -14.653 -4.735 1.00 44.22 C ATOM 536 C GLU A 37 -3.005 -13.366 -4.945 1.00 75.34 C ATOM 537 O GLU A 37 -3.793 -12.963 -4.090 1.00 44.52 O ATOM 538 CB GLU A 37 -3.128 -15.865 -4.921 1.00 51.41 C ATOM 539 CG GLU A 37 -2.403 -17.104 -5.420 1.00 13.24 C ATOM 540 CD GLU A 37 -2.927 -18.379 -4.788 1.00 20.31 C ATOM 541 OE1 GLU A 37 -4.108 -18.714 -5.021 1.00 25.11 O ATOM 542 OE2 GLU A 37 -2.157 -19.043 -4.062 1.00 53.32 O ATOM 0 H GLU A 37 -0.583 -14.720 -3.417 1.00 52.15 H new ATOM 0 HA GLU A 37 -1.415 -14.693 -5.476 1.00 44.22 H new ATOM 0 HB2 GLU A 37 -3.611 -16.095 -3.971 1.00 51.41 H new ATOM 0 HB3 GLU A 37 -3.918 -15.608 -5.626 1.00 51.41 H new ATOM 0 HG2 GLU A 37 -2.507 -17.170 -6.503 1.00 13.24 H new ATOM 0 HG3 GLU A 37 -1.338 -17.008 -5.207 1.00 13.24 H new ATOM 549 N GLY A 38 -2.791 -12.726 -6.091 1.00 24.42 N ATOM 550 CA GLY A 38 -3.492 -11.492 -6.393 1.00 4.12 C ATOM 551 C GLY A 38 -2.610 -10.269 -6.229 1.00 24.14 C ATOM 552 O GLY A 38 -1.477 -10.371 -5.755 1.00 72.34 O ATOM 0 H GLY A 38 -2.145 -13.040 -6.815 1.00 24.42 H new ATOM 0 HA2 GLY A 38 -3.867 -11.531 -7.416 1.00 4.12 H new ATOM 0 HA3 GLY A 38 -4.359 -11.401 -5.739 1.00 4.12 H new ATOM 556 N SER A 39 -3.128 -9.110 -6.621 1.00 34.24 N ATOM 557 CA SER A 39 -2.378 -7.864 -6.520 1.00 13.45 C ATOM 558 C SER A 39 -3.136 -6.841 -5.677 1.00 50.03 C ATOM 559 O SER A 39 -4.365 -6.773 -5.719 1.00 22.43 O ATOM 560 CB SER A 39 -2.107 -7.293 -7.913 1.00 23.04 C ATOM 561 OG SER A 39 -3.291 -6.774 -8.491 1.00 42.02 O ATOM 0 H SER A 39 -4.065 -9.008 -7.012 1.00 34.24 H new ATOM 0 HA SER A 39 -1.427 -8.079 -6.032 1.00 13.45 H new ATOM 0 HB2 SER A 39 -1.356 -6.506 -7.847 1.00 23.04 H new ATOM 0 HB3 SER A 39 -1.697 -8.072 -8.555 1.00 23.04 H new ATOM 0 HG SER A 39 -3.090 -6.414 -9.380 1.00 42.02 H new ATOM 567 N LEU A 40 -2.393 -6.046 -4.914 1.00 73.52 N ATOM 568 CA LEU A 40 -2.994 -5.026 -4.062 1.00 23.33 C ATOM 569 C LEU A 40 -2.874 -3.645 -4.698 1.00 72.24 C ATOM 570 O LEU A 40 -1.887 -3.342 -5.367 1.00 60.23 O ATOM 571 CB LEU A 40 -2.324 -5.025 -2.686 1.00 25.15 C ATOM 572 CG LEU A 40 -2.698 -3.869 -1.758 1.00 1.21 C ATOM 573 CD1 LEU A 40 -4.118 -4.037 -1.241 1.00 1.23 C ATOM 574 CD2 LEU A 40 -1.714 -3.774 -0.601 1.00 51.31 C ATOM 0 H LEU A 40 -1.375 -6.088 -4.868 1.00 73.52 H new ATOM 0 HA LEU A 40 -4.052 -5.262 -3.946 1.00 23.33 H new ATOM 0 HB2 LEU A 40 -2.569 -5.961 -2.184 1.00 25.15 H new ATOM 0 HB3 LEU A 40 -1.244 -5.014 -2.830 1.00 25.15 H new ATOM 0 HG LEU A 40 -2.649 -2.941 -2.327 1.00 1.21 H new ATOM 0 HD11 LEU A 40 -4.366 -3.205 -0.582 1.00 1.23 H new ATOM 0 HD12 LEU A 40 -4.812 -4.054 -2.082 1.00 1.23 H new ATOM 0 HD13 LEU A 40 -4.196 -4.973 -0.688 1.00 1.23 H new ATOM 0 HD21 LEU A 40 -1.996 -2.946 0.049 1.00 51.31 H new ATOM 0 HD22 LEU A 40 -1.730 -4.704 -0.032 1.00 51.31 H new ATOM 0 HD23 LEU A 40 -0.710 -3.604 -0.990 1.00 51.31 H new ATOM 586 N ALA A 41 -3.887 -2.812 -4.485 1.00 13.43 N ATOM 587 CA ALA A 41 -3.894 -1.462 -5.034 1.00 2.32 C ATOM 588 C ALA A 41 -4.340 -0.446 -3.988 1.00 33.11 C ATOM 589 O ALA A 41 -5.435 -0.550 -3.433 1.00 42.25 O ATOM 590 CB ALA A 41 -4.797 -1.394 -6.257 1.00 21.53 C ATOM 0 H ALA A 41 -4.714 -3.048 -3.936 1.00 13.43 H new ATOM 0 HA ALA A 41 -2.876 -1.213 -5.333 1.00 2.32 H new ATOM 0 HB1 ALA A 41 -4.793 -0.380 -6.657 1.00 21.53 H new ATOM 0 HB2 ALA A 41 -4.433 -2.085 -7.017 1.00 21.53 H new ATOM 0 HB3 ALA A 41 -5.813 -1.668 -5.975 1.00 21.53 H new ATOM 596 N LEU A 42 -3.486 0.536 -3.723 1.00 10.32 N ATOM 597 CA LEU A 42 -3.792 1.572 -2.742 1.00 4.00 C ATOM 598 C LEU A 42 -4.193 2.873 -3.431 1.00 22.22 C ATOM 599 O LEU A 42 -3.339 3.655 -3.846 1.00 12.13 O ATOM 600 CB LEU A 42 -2.586 1.814 -1.834 1.00 23.04 C ATOM 601 CG LEU A 42 -2.002 0.577 -1.148 1.00 65.22 C ATOM 602 CD1 LEU A 42 -0.533 0.791 -0.821 1.00 0.43 C ATOM 603 CD2 LEU A 42 -2.788 0.244 0.111 1.00 60.23 C ATOM 0 H LEU A 42 -2.576 0.637 -4.173 1.00 10.32 H new ATOM 0 HA LEU A 42 -4.631 1.229 -2.137 1.00 4.00 H new ATOM 0 HB2 LEU A 42 -1.799 2.282 -2.426 1.00 23.04 H new ATOM 0 HB3 LEU A 42 -2.874 2.530 -1.064 1.00 23.04 H new ATOM 0 HG LEU A 42 -2.081 -0.266 -1.834 1.00 65.22 H new ATOM 0 HD11 LEU A 42 -0.135 -0.099 -0.334 1.00 0.43 H new ATOM 0 HD12 LEU A 42 0.021 0.979 -1.741 1.00 0.43 H new ATOM 0 HD13 LEU A 42 -0.430 1.647 -0.154 1.00 0.43 H new ATOM 0 HD21 LEU A 42 -2.358 -0.638 0.585 1.00 60.23 H new ATOM 0 HD22 LEU A 42 -2.742 1.086 0.802 1.00 60.23 H new ATOM 0 HD23 LEU A 42 -3.827 0.045 -0.151 1.00 60.23 H new ATOM 615 N ALA A 43 -5.498 3.097 -3.546 1.00 23.23 N ATOM 616 CA ALA A 43 -6.012 4.304 -4.181 1.00 5.03 C ATOM 617 C ALA A 43 -6.067 5.463 -3.190 1.00 64.04 C ATOM 618 O ALA A 43 -6.121 5.256 -1.979 1.00 71.50 O ATOM 619 CB ALA A 43 -7.390 4.045 -4.769 1.00 34.13 C ATOM 0 H ALA A 43 -6.218 2.459 -3.208 1.00 23.23 H new ATOM 0 HA ALA A 43 -5.332 4.580 -4.987 1.00 5.03 H new ATOM 0 HB1 ALA A 43 -7.762 4.955 -5.240 1.00 34.13 H new ATOM 0 HB2 ALA A 43 -7.325 3.252 -5.514 1.00 34.13 H new ATOM 0 HB3 ALA A 43 -8.073 3.742 -3.975 1.00 34.13 H new ATOM 625 N VAL A 44 -6.051 6.685 -3.715 1.00 54.21 N ATOM 626 CA VAL A 44 -6.099 7.878 -2.878 1.00 21.33 C ATOM 627 C VAL A 44 -7.096 8.893 -3.424 1.00 61.03 C ATOM 628 O VAL A 44 -7.010 9.302 -4.583 1.00 61.21 O ATOM 629 CB VAL A 44 -4.714 8.542 -2.767 1.00 54.21 C ATOM 630 CG1 VAL A 44 -4.825 9.897 -2.085 1.00 22.21 C ATOM 631 CG2 VAL A 44 -3.747 7.637 -2.020 1.00 2.12 C ATOM 0 H VAL A 44 -6.005 6.874 -4.716 1.00 54.21 H new ATOM 0 HA VAL A 44 -6.419 7.557 -1.887 1.00 21.33 H new ATOM 0 HB VAL A 44 -4.324 8.699 -3.773 1.00 54.21 H new ATOM 0 HG11 VAL A 44 -3.837 10.351 -2.015 1.00 22.21 H new ATOM 0 HG12 VAL A 44 -5.482 10.544 -2.666 1.00 22.21 H new ATOM 0 HG13 VAL A 44 -5.236 9.768 -1.084 1.00 22.21 H new ATOM 0 HG21 VAL A 44 -2.774 8.123 -1.951 1.00 2.12 H new ATOM 0 HG22 VAL A 44 -4.129 7.446 -1.017 1.00 2.12 H new ATOM 0 HG23 VAL A 44 -3.645 6.693 -2.555 1.00 2.12 H new ATOM 641 N ARG A 45 -8.042 9.297 -2.583 1.00 51.13 N ATOM 642 CA ARG A 45 -9.057 10.265 -2.983 1.00 22.34 C ATOM 643 C ARG A 45 -8.419 11.470 -3.666 1.00 2.11 C ATOM 644 O ARG A 45 -7.339 11.928 -3.292 1.00 71.30 O ATOM 645 CB ARG A 45 -9.863 10.722 -1.765 1.00 53.14 C ATOM 646 CG ARG A 45 -11.053 9.829 -1.452 1.00 44.52 C ATOM 647 CD ARG A 45 -12.368 10.569 -1.635 1.00 54.13 C ATOM 648 NE ARG A 45 -12.949 10.335 -2.955 1.00 24.50 N ATOM 649 CZ ARG A 45 -13.993 11.005 -3.428 1.00 21.44 C ATOM 650 NH1 ARG A 45 -14.569 11.947 -2.693 1.00 3.51 N ATOM 651 NH2 ARG A 45 -14.464 10.733 -4.638 1.00 1.22 N ATOM 0 H ARG A 45 -8.127 8.969 -1.621 1.00 51.13 H new ATOM 0 HA ARG A 45 -9.727 9.780 -3.693 1.00 22.34 H new ATOM 0 HB2 ARG A 45 -9.206 10.755 -0.896 1.00 53.14 H new ATOM 0 HB3 ARG A 45 -10.217 11.739 -1.935 1.00 53.14 H new ATOM 0 HG2 ARG A 45 -11.033 8.954 -2.102 1.00 44.52 H new ATOM 0 HG3 ARG A 45 -10.978 9.467 -0.427 1.00 44.52 H new ATOM 0 HD2 ARG A 45 -13.073 10.251 -0.867 1.00 54.13 H new ATOM 0 HD3 ARG A 45 -12.205 11.638 -1.495 1.00 54.13 H new ATOM 0 HE ARG A 45 -12.529 9.617 -3.546 1.00 24.50 H new ATOM 0 HH11 ARG A 45 -14.210 12.158 -1.762 1.00 3.51 H new ATOM 0 HH12 ARG A 45 -15.371 12.460 -3.059 1.00 3.51 H new ATOM 0 HH21 ARG A 45 -14.024 10.009 -5.206 1.00 1.22 H new ATOM 0 HH22 ARG A 45 -15.266 11.248 -5.001 1.00 1.22 H new ATOM 665 N PRO A 46 -9.101 11.998 -4.693 1.00 13.21 N ATOM 666 CA PRO A 46 -8.621 13.158 -5.450 1.00 51.34 C ATOM 667 C PRO A 46 -8.665 14.444 -4.632 1.00 42.21 C ATOM 668 O PRO A 46 -9.675 14.754 -4.000 1.00 51.41 O ATOM 669 CB PRO A 46 -9.594 13.240 -6.629 1.00 53.41 C ATOM 670 CG PRO A 46 -10.840 12.588 -6.137 1.00 65.30 C ATOM 671 CD PRO A 46 -10.396 11.505 -5.193 1.00 43.11 C ATOM 0 HA PRO A 46 -7.578 13.047 -5.747 1.00 51.34 H new ATOM 0 HB2 PRO A 46 -9.777 14.274 -6.920 1.00 53.41 H new ATOM 0 HB3 PRO A 46 -9.198 12.727 -7.506 1.00 53.41 H new ATOM 0 HG2 PRO A 46 -11.483 13.308 -5.630 1.00 65.30 H new ATOM 0 HG3 PRO A 46 -11.416 12.173 -6.964 1.00 65.30 H new ATOM 0 HD2 PRO A 46 -11.111 11.360 -4.383 1.00 43.11 H new ATOM 0 HD3 PRO A 46 -10.292 10.546 -5.701 1.00 43.11 H new ATOM 679 N ASP A 47 -7.565 15.188 -4.649 1.00 4.13 N ATOM 680 CA ASP A 47 -7.480 16.443 -3.909 1.00 63.52 C ATOM 681 C ASP A 47 -6.310 17.286 -4.404 1.00 44.14 C ATOM 682 O ASP A 47 -5.203 16.791 -4.618 1.00 63.14 O ATOM 683 CB ASP A 47 -7.329 16.167 -2.412 1.00 45.02 C ATOM 684 CG ASP A 47 -8.265 17.012 -1.571 1.00 5.23 C ATOM 685 OD1 ASP A 47 -9.486 16.754 -1.599 1.00 44.04 O ATOM 686 OD2 ASP A 47 -7.775 17.932 -0.883 1.00 24.23 O ATOM 0 H ASP A 47 -6.720 14.945 -5.166 1.00 4.13 H new ATOM 0 HA ASP A 47 -8.402 16.999 -4.077 1.00 63.52 H new ATOM 0 HB2 ASP A 47 -7.524 15.112 -2.218 1.00 45.02 H new ATOM 0 HB3 ASP A 47 -6.299 16.362 -2.112 1.00 45.02 H new ATOM 691 N PRO A 48 -6.557 18.591 -4.592 1.00 35.31 N ATOM 692 CA PRO A 48 -5.537 19.531 -5.065 1.00 21.12 C ATOM 693 C PRO A 48 -4.456 19.786 -4.019 1.00 54.14 C ATOM 694 O PRO A 48 -3.276 19.908 -4.350 1.00 12.55 O ATOM 695 CB PRO A 48 -6.332 20.810 -5.336 1.00 10.42 C ATOM 696 CG PRO A 48 -7.523 20.713 -4.445 1.00 70.21 C ATOM 697 CD PRO A 48 -7.854 19.248 -4.357 1.00 4.44 C ATOM 0 HA PRO A 48 -5.005 19.152 -5.937 1.00 21.12 H new ATOM 0 HB2 PRO A 48 -5.741 21.698 -5.112 1.00 10.42 H new ATOM 0 HB3 PRO A 48 -6.626 20.879 -6.383 1.00 10.42 H new ATOM 0 HG2 PRO A 48 -7.308 21.125 -3.459 1.00 70.21 H new ATOM 0 HG3 PRO A 48 -8.361 21.279 -4.851 1.00 70.21 H new ATOM 0 HD2 PRO A 48 -8.266 18.987 -3.382 1.00 4.44 H new ATOM 0 HD3 PRO A 48 -8.593 18.957 -5.104 1.00 4.44 H new ATOM 705 N LYS A 49 -4.866 19.866 -2.758 1.00 61.21 N ATOM 706 CA LYS A 49 -3.933 20.104 -1.664 1.00 41.11 C ATOM 707 C LYS A 49 -2.647 19.308 -1.862 1.00 1.14 C ATOM 708 O LYS A 49 -1.561 19.766 -1.504 1.00 31.52 O ATOM 709 CB LYS A 49 -4.576 19.731 -0.326 1.00 74.34 C ATOM 710 CG LYS A 49 -4.444 20.809 0.735 1.00 71.25 C ATOM 711 CD LYS A 49 -4.777 20.274 2.117 1.00 15.42 C ATOM 712 CE LYS A 49 -3.758 20.727 3.151 1.00 62.12 C ATOM 713 NZ LYS A 49 -2.862 19.614 3.570 1.00 72.42 N ATOM 0 H LYS A 49 -5.839 19.769 -2.468 1.00 61.21 H new ATOM 0 HA LYS A 49 -3.685 21.165 -1.657 1.00 41.11 H new ATOM 0 HB2 LYS A 49 -5.633 19.520 -0.487 1.00 74.34 H new ATOM 0 HB3 LYS A 49 -4.120 18.812 0.043 1.00 74.34 H new ATOM 0 HG2 LYS A 49 -3.427 21.202 0.731 1.00 71.25 H new ATOM 0 HG3 LYS A 49 -5.108 21.640 0.496 1.00 71.25 H new ATOM 0 HD2 LYS A 49 -5.770 20.614 2.410 1.00 15.42 H new ATOM 0 HD3 LYS A 49 -4.809 19.185 2.089 1.00 15.42 H new ATOM 0 HE2 LYS A 49 -3.160 21.540 2.740 1.00 62.12 H new ATOM 0 HE3 LYS A 49 -4.277 21.123 4.023 1.00 62.12 H new ATOM 0 HZ1 LYS A 49 -2.182 19.963 4.275 1.00 72.42 H new ATOM 0 HZ2 LYS A 49 -3.430 18.849 3.986 1.00 72.42 H new ATOM 0 HZ3 LYS A 49 -2.347 19.252 2.742 1.00 72.42 H new ATOM 727 N ALA A 50 -2.776 18.117 -2.434 1.00 71.54 N ATOM 728 CA ALA A 50 -1.624 17.259 -2.684 1.00 22.34 C ATOM 729 C ALA A 50 -1.129 17.406 -4.118 1.00 11.32 C ATOM 730 O ALA A 50 0.065 17.286 -4.389 1.00 3.55 O ATOM 731 CB ALA A 50 -1.974 15.807 -2.391 1.00 23.34 C ATOM 0 H ALA A 50 -3.668 17.723 -2.734 1.00 71.54 H new ATOM 0 HA ALA A 50 -0.820 17.570 -2.017 1.00 22.34 H new ATOM 0 HB1 ALA A 50 -1.105 15.178 -2.582 1.00 23.34 H new ATOM 0 HB2 ALA A 50 -2.271 15.708 -1.347 1.00 23.34 H new ATOM 0 HB3 ALA A 50 -2.797 15.494 -3.034 1.00 23.34 H new ATOM 737 N GLY A 51 -2.055 17.668 -5.035 1.00 30.23 N ATOM 738 CA GLY A 51 -1.693 17.827 -6.431 1.00 44.04 C ATOM 739 C GLY A 51 -2.242 16.716 -7.303 1.00 53.41 C ATOM 740 O GLY A 51 -1.578 16.263 -8.236 1.00 73.11 O ATOM 0 H GLY A 51 -3.050 17.773 -4.836 1.00 30.23 H new ATOM 0 HA2 GLY A 51 -2.065 18.786 -6.793 1.00 44.04 H new ATOM 0 HA3 GLY A 51 -0.607 17.852 -6.521 1.00 44.04 H new ATOM 744 N PHE A 52 -3.458 16.275 -6.999 1.00 24.43 N ATOM 745 CA PHE A 52 -4.096 15.206 -7.760 1.00 51.42 C ATOM 746 C PHE A 52 -5.610 15.398 -7.801 1.00 25.23 C ATOM 747 O PHE A 52 -6.356 14.807 -7.020 1.00 71.43 O ATOM 748 CB PHE A 52 -3.758 13.845 -7.152 1.00 23.34 C ATOM 749 CG PHE A 52 -2.308 13.474 -7.278 1.00 55.11 C ATOM 750 CD1 PHE A 52 -1.794 13.036 -8.488 1.00 53.54 C ATOM 751 CD2 PHE A 52 -1.459 13.563 -6.187 1.00 23.45 C ATOM 752 CE1 PHE A 52 -0.460 12.695 -8.609 1.00 73.50 C ATOM 753 CE2 PHE A 52 -0.124 13.223 -6.301 1.00 41.52 C ATOM 754 CZ PHE A 52 0.375 12.788 -7.514 1.00 21.35 C ATOM 0 H PHE A 52 -4.022 16.641 -6.232 1.00 24.43 H new ATOM 0 HA PHE A 52 -3.715 15.243 -8.781 1.00 51.42 H new ATOM 0 HB2 PHE A 52 -4.033 13.849 -6.097 1.00 23.34 H new ATOM 0 HB3 PHE A 52 -4.364 13.079 -7.637 1.00 23.34 H new ATOM 0 HD1 PHE A 52 -2.444 12.960 -9.347 1.00 53.54 H new ATOM 0 HD2 PHE A 52 -1.844 13.902 -5.237 1.00 23.45 H new ATOM 0 HE1 PHE A 52 -0.072 12.357 -9.558 1.00 73.50 H new ATOM 0 HE2 PHE A 52 0.528 13.297 -5.443 1.00 41.52 H new ATOM 0 HZ PHE A 52 1.418 12.521 -7.605 1.00 21.35 H new ATOM 764 N PRO A 53 -6.074 16.244 -8.732 1.00 21.11 N ATOM 765 CA PRO A 53 -7.501 16.533 -8.897 1.00 72.12 C ATOM 766 C PRO A 53 -8.274 15.341 -9.454 1.00 1.31 C ATOM 767 O PRO A 53 -9.486 15.412 -9.652 1.00 72.21 O ATOM 768 CB PRO A 53 -7.515 17.693 -9.896 1.00 71.32 C ATOM 769 CG PRO A 53 -6.246 17.549 -10.661 1.00 64.41 C ATOM 770 CD PRO A 53 -5.241 16.982 -9.695 1.00 54.54 C ATOM 0 HA PRO A 53 -7.982 16.765 -7.947 1.00 72.12 H new ATOM 0 HB2 PRO A 53 -8.382 17.638 -10.554 1.00 71.32 H new ATOM 0 HB3 PRO A 53 -7.562 18.655 -9.385 1.00 71.32 H new ATOM 0 HG2 PRO A 53 -6.380 16.888 -11.518 1.00 64.41 H new ATOM 0 HG3 PRO A 53 -5.913 18.511 -11.050 1.00 64.41 H new ATOM 0 HD2 PRO A 53 -4.528 16.326 -10.195 1.00 54.54 H new ATOM 0 HD3 PRO A 53 -4.664 17.768 -9.208 1.00 54.54 H new ATOM 778 N LYS A 54 -7.563 14.247 -9.704 1.00 75.55 N ATOM 779 CA LYS A 54 -8.182 13.038 -10.237 1.00 4.33 C ATOM 780 C LYS A 54 -7.966 11.857 -9.296 1.00 5.23 C ATOM 781 O LYS A 54 -8.812 10.970 -9.193 1.00 65.33 O ATOM 782 CB LYS A 54 -7.609 12.715 -11.619 1.00 60.21 C ATOM 783 CG LYS A 54 -8.186 11.451 -12.236 1.00 10.55 C ATOM 784 CD LYS A 54 -9.689 11.561 -12.427 1.00 62.41 C ATOM 785 CE LYS A 54 -10.161 10.731 -13.611 1.00 32.41 C ATOM 786 NZ LYS A 54 -11.623 10.886 -13.849 1.00 21.21 N ATOM 0 H LYS A 54 -6.558 14.172 -9.546 1.00 75.55 H new ATOM 0 HA LYS A 54 -9.253 13.217 -10.327 1.00 4.33 H new ATOM 0 HB2 LYS A 54 -7.799 13.555 -12.287 1.00 60.21 H new ATOM 0 HB3 LYS A 54 -6.527 12.609 -11.539 1.00 60.21 H new ATOM 0 HG2 LYS A 54 -7.709 11.264 -13.198 1.00 10.55 H new ATOM 0 HG3 LYS A 54 -7.961 10.597 -11.597 1.00 10.55 H new ATOM 0 HD2 LYS A 54 -10.197 11.228 -11.522 1.00 62.41 H new ATOM 0 HD3 LYS A 54 -9.962 12.605 -12.581 1.00 62.41 H new ATOM 0 HE2 LYS A 54 -9.614 11.030 -14.505 1.00 32.41 H new ATOM 0 HE3 LYS A 54 -9.931 9.680 -13.433 1.00 32.41 H new ATOM 0 HZ1 LYS A 54 -11.906 10.305 -14.664 1.00 21.21 H new ATOM 0 HZ2 LYS A 54 -12.147 10.577 -13.005 1.00 21.21 H new ATOM 0 HZ3 LYS A 54 -11.839 11.884 -14.044 1.00 21.21 H new ATOM 800 N GLY A 55 -6.826 11.853 -8.610 1.00 1.13 N ATOM 801 CA GLY A 55 -6.521 10.776 -7.686 1.00 4.11 C ATOM 802 C GLY A 55 -5.397 9.889 -8.182 1.00 22.54 C ATOM 803 O GLY A 55 -5.111 9.846 -9.378 1.00 32.20 O ATOM 0 H GLY A 55 -6.109 12.576 -8.678 1.00 1.13 H new ATOM 0 HA2 GLY A 55 -6.247 11.198 -6.719 1.00 4.11 H new ATOM 0 HA3 GLY A 55 -7.415 10.172 -7.529 1.00 4.11 H new ATOM 807 N VAL A 56 -4.755 9.178 -7.259 1.00 32.23 N ATOM 808 CA VAL A 56 -3.656 8.286 -7.609 1.00 3.14 C ATOM 809 C VAL A 56 -3.757 6.966 -6.854 1.00 35.14 C ATOM 810 O VAL A 56 -4.101 6.939 -5.672 1.00 74.25 O ATOM 811 CB VAL A 56 -2.291 8.934 -7.306 1.00 75.01 C ATOM 812 CG1 VAL A 56 -2.158 9.229 -5.819 1.00 70.51 C ATOM 813 CG2 VAL A 56 -1.159 8.037 -7.784 1.00 63.01 C ATOM 0 H VAL A 56 -4.977 9.203 -6.264 1.00 32.23 H new ATOM 0 HA VAL A 56 -3.731 8.095 -8.680 1.00 3.14 H new ATOM 0 HB VAL A 56 -2.228 9.879 -7.846 1.00 75.01 H new ATOM 0 HG11 VAL A 56 -1.188 9.686 -5.624 1.00 70.51 H new ATOM 0 HG12 VAL A 56 -2.950 9.912 -5.511 1.00 70.51 H new ATOM 0 HG13 VAL A 56 -2.241 8.300 -5.255 1.00 70.51 H new ATOM 0 HG21 VAL A 56 -0.202 8.509 -7.562 1.00 63.01 H new ATOM 0 HG22 VAL A 56 -1.216 7.076 -7.273 1.00 63.01 H new ATOM 0 HG23 VAL A 56 -1.247 7.882 -8.859 1.00 63.01 H new ATOM 823 N ALA A 57 -3.456 5.872 -7.545 1.00 34.42 N ATOM 824 CA ALA A 57 -3.512 4.547 -6.940 1.00 71.42 C ATOM 825 C ALA A 57 -2.275 3.729 -7.295 1.00 61.44 C ATOM 826 O ALA A 57 -1.933 3.579 -8.468 1.00 71.25 O ATOM 827 CB ALA A 57 -4.773 3.818 -7.379 1.00 21.32 C ATOM 0 H ALA A 57 -3.171 5.877 -8.524 1.00 34.42 H new ATOM 0 HA ALA A 57 -3.536 4.670 -5.857 1.00 71.42 H new ATOM 0 HB1 ALA A 57 -4.801 2.830 -6.919 1.00 21.32 H new ATOM 0 HB2 ALA A 57 -5.649 4.387 -7.069 1.00 21.32 H new ATOM 0 HB3 ALA A 57 -4.774 3.713 -8.464 1.00 21.32 H new ATOM 833 N VAL A 58 -1.607 3.200 -6.275 1.00 44.40 N ATOM 834 CA VAL A 58 -0.407 2.397 -6.480 1.00 73.33 C ATOM 835 C VAL A 58 -0.738 0.908 -6.482 1.00 23.10 C ATOM 836 O VAL A 58 -1.440 0.415 -5.599 1.00 43.42 O ATOM 837 CB VAL A 58 0.648 2.676 -5.394 1.00 30.44 C ATOM 838 CG1 VAL A 58 1.754 1.633 -5.443 1.00 41.35 C ATOM 839 CG2 VAL A 58 1.217 4.077 -5.553 1.00 1.44 C ATOM 0 H VAL A 58 -1.877 3.313 -5.298 1.00 44.40 H new ATOM 0 HA VAL A 58 0.001 2.678 -7.451 1.00 73.33 H new ATOM 0 HB VAL A 58 0.166 2.613 -4.418 1.00 30.44 H new ATOM 0 HG11 VAL A 58 2.490 1.847 -4.668 1.00 41.35 H new ATOM 0 HG12 VAL A 58 1.329 0.643 -5.276 1.00 41.35 H new ATOM 0 HG13 VAL A 58 2.237 1.660 -6.420 1.00 41.35 H new ATOM 0 HG21 VAL A 58 1.961 4.258 -4.777 1.00 1.44 H new ATOM 0 HG22 VAL A 58 1.684 4.171 -6.533 1.00 1.44 H new ATOM 0 HG23 VAL A 58 0.414 4.808 -5.463 1.00 1.44 H new ATOM 849 N VAL A 59 -0.225 0.195 -7.481 1.00 0.33 N ATOM 850 CA VAL A 59 -0.464 -1.238 -7.598 1.00 24.32 C ATOM 851 C VAL A 59 0.702 -2.038 -7.024 1.00 55.45 C ATOM 852 O VAL A 59 1.798 -1.509 -6.836 1.00 22.01 O ATOM 853 CB VAL A 59 -0.682 -1.653 -9.065 1.00 35.21 C ATOM 854 CG1 VAL A 59 -1.079 -3.119 -9.153 1.00 13.25 C ATOM 855 CG2 VAL A 59 -1.734 -0.768 -9.717 1.00 53.13 C ATOM 0 H VAL A 59 0.358 0.587 -8.220 1.00 0.33 H new ATOM 0 HA VAL A 59 -1.367 -1.456 -7.028 1.00 24.32 H new ATOM 0 HB VAL A 59 0.256 -1.523 -9.604 1.00 35.21 H new ATOM 0 HG11 VAL A 59 -1.229 -3.393 -10.197 1.00 13.25 H new ATOM 0 HG12 VAL A 59 -0.289 -3.736 -8.725 1.00 13.25 H new ATOM 0 HG13 VAL A 59 -2.004 -3.279 -8.600 1.00 13.25 H new ATOM 0 HG21 VAL A 59 -1.876 -1.075 -10.753 1.00 53.13 H new ATOM 0 HG22 VAL A 59 -2.676 -0.865 -9.178 1.00 53.13 H new ATOM 0 HG23 VAL A 59 -1.405 0.271 -9.688 1.00 53.13 H new ATOM 865 N LEU A 60 0.456 -3.314 -6.748 1.00 40.21 N ATOM 866 CA LEU A 60 1.485 -4.188 -6.196 1.00 42.32 C ATOM 867 C LEU A 60 1.171 -5.652 -6.488 1.00 41.41 C ATOM 868 O LEU A 60 0.588 -6.350 -5.659 1.00 13.22 O ATOM 869 CB LEU A 60 1.608 -3.973 -4.686 1.00 40.11 C ATOM 870 CG LEU A 60 2.019 -2.570 -4.240 1.00 3.13 C ATOM 871 CD1 LEU A 60 1.913 -2.438 -2.728 1.00 74.12 C ATOM 872 CD2 LEU A 60 3.434 -2.255 -4.706 1.00 33.41 C ATOM 0 H LEU A 60 -0.446 -3.766 -6.897 1.00 40.21 H new ATOM 0 HA LEU A 60 2.433 -3.937 -6.672 1.00 42.32 H new ATOM 0 HB2 LEU A 60 0.649 -4.213 -4.226 1.00 40.11 H new ATOM 0 HB3 LEU A 60 2.336 -4.684 -4.296 1.00 40.11 H new ATOM 0 HG LEU A 60 1.339 -1.851 -4.696 1.00 3.13 H new ATOM 0 HD11 LEU A 60 2.210 -1.433 -2.429 1.00 74.12 H new ATOM 0 HD12 LEU A 60 0.884 -2.620 -2.418 1.00 74.12 H new ATOM 0 HD13 LEU A 60 2.569 -3.167 -2.252 1.00 74.12 H new ATOM 0 HD21 LEU A 60 3.710 -1.252 -4.380 1.00 33.41 H new ATOM 0 HD22 LEU A 60 4.127 -2.979 -4.279 1.00 33.41 H new ATOM 0 HD23 LEU A 60 3.479 -2.308 -5.794 1.00 33.41 H new ATOM 884 N ASP A 61 1.562 -6.110 -7.672 1.00 3.24 N ATOM 885 CA ASP A 61 1.326 -7.492 -8.073 1.00 0.30 C ATOM 886 C ASP A 61 2.114 -8.457 -7.192 1.00 50.42 C ATOM 887 O ASP A 61 3.327 -8.606 -7.347 1.00 75.23 O ATOM 888 CB ASP A 61 1.709 -7.692 -9.540 1.00 50.21 C ATOM 889 CG ASP A 61 1.820 -9.157 -9.915 1.00 30.33 C ATOM 890 OD1 ASP A 61 1.410 -10.010 -9.099 1.00 45.45 O ATOM 891 OD2 ASP A 61 2.316 -9.451 -11.023 1.00 73.11 O ATOM 0 H ASP A 61 2.044 -5.544 -8.371 1.00 3.24 H new ATOM 0 HA ASP A 61 0.264 -7.703 -7.951 1.00 0.30 H new ATOM 0 HB2 ASP A 61 0.964 -7.213 -10.175 1.00 50.21 H new ATOM 0 HB3 ASP A 61 2.660 -7.197 -9.735 1.00 50.21 H new ATOM 896 N LEU A 62 1.418 -9.108 -6.267 1.00 51.43 N ATOM 897 CA LEU A 62 2.052 -10.058 -5.359 1.00 51.35 C ATOM 898 C LEU A 62 1.809 -11.493 -5.817 1.00 1.33 C ATOM 899 O LEU A 62 0.915 -11.755 -6.621 1.00 32.33 O ATOM 900 CB LEU A 62 1.522 -9.867 -3.937 1.00 51.24 C ATOM 901 CG LEU A 62 1.237 -8.425 -3.516 1.00 25.15 C ATOM 902 CD1 LEU A 62 0.690 -8.383 -2.097 1.00 0.54 C ATOM 903 CD2 LEU A 62 2.497 -7.578 -3.628 1.00 54.14 C ATOM 0 H LEU A 62 0.414 -8.996 -6.126 1.00 51.43 H new ATOM 0 HA LEU A 62 3.126 -9.870 -5.367 1.00 51.35 H new ATOM 0 HB2 LEU A 62 0.603 -10.443 -3.833 1.00 51.24 H new ATOM 0 HB3 LEU A 62 2.245 -10.292 -3.241 1.00 51.24 H new ATOM 0 HG LEU A 62 0.484 -8.012 -4.187 1.00 25.15 H new ATOM 0 HD11 LEU A 62 0.493 -7.349 -1.814 1.00 0.54 H new ATOM 0 HD12 LEU A 62 -0.236 -8.956 -2.047 1.00 0.54 H new ATOM 0 HD13 LEU A 62 1.421 -8.814 -1.412 1.00 0.54 H new ATOM 0 HD21 LEU A 62 2.276 -6.555 -3.324 1.00 54.14 H new ATOM 0 HD22 LEU A 62 3.271 -7.989 -2.980 1.00 54.14 H new ATOM 0 HD23 LEU A 62 2.848 -7.582 -4.660 1.00 54.14 H new ATOM 915 N TRP A 63 2.610 -12.416 -5.298 1.00 13.04 N ATOM 916 CA TRP A 63 2.480 -13.825 -5.652 1.00 4.35 C ATOM 917 C TRP A 63 3.023 -14.717 -4.540 1.00 34.21 C ATOM 918 O TRP A 63 4.232 -14.916 -4.424 1.00 45.43 O ATOM 919 CB TRP A 63 3.219 -14.114 -6.960 1.00 1.35 C ATOM 920 CG TRP A 63 2.337 -14.036 -8.169 1.00 12.42 C ATOM 921 CD1 TRP A 63 2.419 -13.128 -9.186 1.00 1.43 C ATOM 922 CD2 TRP A 63 1.239 -14.899 -8.486 1.00 3.31 C ATOM 923 NE1 TRP A 63 1.438 -13.374 -10.116 1.00 61.13 N ATOM 924 CE2 TRP A 63 0.702 -14.455 -9.710 1.00 62.43 C ATOM 925 CE3 TRP A 63 0.660 -16.003 -7.856 1.00 73.33 C ATOM 926 CZ2 TRP A 63 -0.387 -15.079 -10.313 1.00 73.24 C ATOM 927 CZ3 TRP A 63 -0.422 -16.620 -8.456 1.00 22.21 C ATOM 928 CH2 TRP A 63 -0.935 -16.158 -9.674 1.00 74.24 C ATOM 0 H TRP A 63 3.355 -12.215 -4.632 1.00 13.04 H new ATOM 0 HA TRP A 63 1.421 -14.045 -5.785 1.00 4.35 H new ATOM 0 HB2 TRP A 63 4.039 -13.404 -7.071 1.00 1.35 H new ATOM 0 HB3 TRP A 63 3.663 -15.108 -6.906 1.00 1.35 H new ATOM 0 HD1 TRP A 63 3.148 -12.333 -9.250 1.00 1.43 H new ATOM 0 HE1 TRP A 63 1.283 -12.838 -10.970 1.00 61.13 H new ATOM 0 HE3 TRP A 63 1.050 -16.368 -6.917 1.00 73.33 H new ATOM 0 HZ2 TRP A 63 -0.785 -14.724 -11.252 1.00 73.24 H new ATOM 0 HZ3 TRP A 63 -0.879 -17.473 -7.977 1.00 22.21 H new ATOM 0 HH2 TRP A 63 -1.780 -16.663 -10.118 1.00 74.24 H new ATOM 939 N HIS A 64 2.121 -15.253 -3.724 1.00 53.23 N ATOM 940 CA HIS A 64 2.509 -16.125 -2.621 1.00 32.21 C ATOM 941 C HIS A 64 3.368 -15.372 -1.610 1.00 31.33 C ATOM 942 O HIS A 64 4.265 -15.945 -0.994 1.00 23.20 O ATOM 943 CB HIS A 64 3.272 -17.341 -3.149 1.00 53.24 C ATOM 944 CG HIS A 64 2.600 -18.012 -4.307 1.00 41.03 C ATOM 945 ND1 HIS A 64 3.277 -18.792 -5.222 1.00 33.43 N ATOM 946 CD2 HIS A 64 1.304 -18.018 -4.697 1.00 72.23 C ATOM 947 CE1 HIS A 64 2.427 -19.247 -6.124 1.00 34.13 C ATOM 948 NE2 HIS A 64 1.222 -18.792 -5.829 1.00 62.13 N ATOM 0 H HIS A 64 1.116 -15.099 -3.806 1.00 53.23 H new ATOM 0 HA HIS A 64 1.601 -16.463 -2.121 1.00 32.21 H new ATOM 0 HB2 HIS A 64 4.272 -17.030 -3.450 1.00 53.24 H new ATOM 0 HB3 HIS A 64 3.393 -18.063 -2.341 1.00 53.24 H new ATOM 0 HD2 HIS A 64 0.486 -17.509 -4.209 1.00 72.23 H new ATOM 0 HE1 HIS A 64 2.675 -19.883 -6.961 1.00 34.13 H new ATOM 0 HE2 HIS A 64 0.370 -18.984 -6.356 1.00 62.13 H new ATOM 957 N GLY A 65 3.084 -14.084 -1.443 1.00 3.21 N ATOM 958 CA GLY A 65 3.840 -13.273 -0.506 1.00 25.23 C ATOM 959 C GLY A 65 4.962 -12.506 -1.176 1.00 21.03 C ATOM 960 O GLY A 65 5.316 -11.408 -0.746 1.00 32.02 O ATOM 0 H GLY A 65 2.344 -13.588 -1.940 1.00 3.21 H new ATOM 0 HA2 GLY A 65 3.168 -12.571 -0.014 1.00 25.23 H new ATOM 0 HA3 GLY A 65 4.256 -13.914 0.271 1.00 25.23 H new ATOM 964 N ALA A 66 5.525 -13.085 -2.232 1.00 14.11 N ATOM 965 CA ALA A 66 6.613 -12.447 -2.963 1.00 31.50 C ATOM 966 C ALA A 66 6.076 -11.507 -4.037 1.00 24.24 C ATOM 967 O ALA A 66 5.233 -11.890 -4.848 1.00 33.51 O ATOM 968 CB ALA A 66 7.518 -13.501 -3.586 1.00 4.33 C ATOM 0 H ALA A 66 5.246 -13.994 -2.600 1.00 14.11 H new ATOM 0 HA ALA A 66 7.195 -11.854 -2.257 1.00 31.50 H new ATOM 0 HB1 ALA A 66 8.326 -13.011 -4.129 1.00 4.33 H new ATOM 0 HB2 ALA A 66 7.937 -14.131 -2.801 1.00 4.33 H new ATOM 0 HB3 ALA A 66 6.939 -14.117 -4.275 1.00 4.33 H new ATOM 974 N CYS A 67 6.570 -10.273 -4.036 1.00 33.41 N ATOM 975 CA CYS A 67 6.140 -9.277 -5.008 1.00 53.43 C ATOM 976 C CYS A 67 6.634 -9.633 -6.408 1.00 15.31 C ATOM 977 O CYS A 67 7.562 -10.426 -6.566 1.00 54.52 O ATOM 978 CB CYS A 67 6.654 -7.891 -4.613 1.00 24.12 C ATOM 979 SG CYS A 67 5.768 -6.513 -5.410 1.00 3.14 S ATOM 0 H CYS A 67 7.269 -9.940 -3.372 1.00 33.41 H new ATOM 0 HA CYS A 67 5.050 -9.264 -5.018 1.00 53.43 H new ATOM 0 HB2 CYS A 67 6.576 -7.781 -3.531 1.00 24.12 H new ATOM 0 HB3 CYS A 67 7.712 -7.822 -4.865 1.00 24.12 H new ATOM 984 N ARG A 68 6.006 -9.043 -7.420 1.00 14.53 N ATOM 985 CA ARG A 68 6.381 -9.298 -8.805 1.00 35.14 C ATOM 986 C ARG A 68 6.477 -7.994 -9.591 1.00 71.13 C ATOM 987 O ARG A 68 7.489 -7.719 -10.235 1.00 12.41 O ATOM 988 CB ARG A 68 5.364 -10.232 -9.466 1.00 44.24 C ATOM 989 CG ARG A 68 5.974 -11.156 -10.507 1.00 43.01 C ATOM 990 CD ARG A 68 6.502 -12.435 -9.876 1.00 13.43 C ATOM 991 NE ARG A 68 7.938 -12.598 -10.088 1.00 71.31 N ATOM 992 CZ ARG A 68 8.497 -12.690 -11.290 1.00 61.31 C ATOM 993 NH1 ARG A 68 7.745 -12.635 -12.381 1.00 4.11 N ATOM 994 NH2 ARG A 68 9.811 -12.838 -11.402 1.00 22.52 N ATOM 0 H ARG A 68 5.235 -8.385 -7.306 1.00 14.53 H new ATOM 0 HA ARG A 68 7.360 -9.777 -8.809 1.00 35.14 H new ATOM 0 HB2 ARG A 68 4.882 -10.834 -8.696 1.00 44.24 H new ATOM 0 HB3 ARG A 68 4.585 -9.632 -9.936 1.00 44.24 H new ATOM 0 HG2 ARG A 68 5.225 -11.403 -11.260 1.00 43.01 H new ATOM 0 HG3 ARG A 68 6.785 -10.641 -11.021 1.00 43.01 H new ATOM 0 HD2 ARG A 68 6.292 -12.425 -8.806 1.00 13.43 H new ATOM 0 HD3 ARG A 68 5.974 -13.291 -10.296 1.00 13.43 H new ATOM 0 HE ARG A 68 8.544 -12.644 -9.269 1.00 71.31 H new ATOM 0 HH11 ARG A 68 6.735 -12.522 -12.299 1.00 4.11 H new ATOM 0 HH12 ARG A 68 8.177 -12.706 -13.302 1.00 4.11 H new ATOM 0 HH21 ARG A 68 10.393 -12.881 -10.565 1.00 22.52 H new ATOM 0 HH22 ARG A 68 10.239 -12.909 -12.325 1.00 22.52 H new ATOM 1008 N GLY A 69 5.416 -7.195 -9.536 1.00 34.33 N ATOM 1009 CA GLY A 69 5.400 -5.931 -10.247 1.00 72.01 C ATOM 1010 C GLY A 69 4.624 -4.858 -9.508 1.00 70.24 C ATOM 1011 O GLY A 69 3.829 -5.160 -8.619 1.00 3.05 O ATOM 0 H GLY A 69 4.566 -7.401 -9.011 1.00 34.33 H new ATOM 0 HA2 GLY A 69 6.424 -5.592 -10.402 1.00 72.01 H new ATOM 0 HA3 GLY A 69 4.960 -6.078 -11.233 1.00 72.01 H new ATOM 1015 N ALA A 70 4.853 -3.603 -9.878 1.00 4.45 N ATOM 1016 CA ALA A 70 4.169 -2.483 -9.244 1.00 62.14 C ATOM 1017 C ALA A 70 4.190 -1.249 -10.140 1.00 63.32 C ATOM 1018 O ALA A 70 5.235 -0.874 -10.674 1.00 74.40 O ATOM 1019 CB ALA A 70 4.805 -2.171 -7.897 1.00 54.42 C ATOM 0 H ALA A 70 5.507 -3.336 -10.614 1.00 4.45 H new ATOM 0 HA ALA A 70 3.129 -2.767 -9.085 1.00 62.14 H new ATOM 0 HB1 ALA A 70 4.284 -1.332 -7.434 1.00 54.42 H new ATOM 0 HB2 ALA A 70 4.733 -3.045 -7.249 1.00 54.42 H new ATOM 0 HB3 ALA A 70 5.854 -1.912 -8.041 1.00 54.42 H new ATOM 1025 N LYS A 71 3.031 -0.621 -10.302 1.00 35.12 N ATOM 1026 CA LYS A 71 2.915 0.572 -11.133 1.00 21.23 C ATOM 1027 C LYS A 71 1.933 1.567 -10.522 1.00 70.25 C ATOM 1028 O LYS A 71 1.065 1.192 -9.734 1.00 4.32 O ATOM 1029 CB LYS A 71 2.463 0.193 -12.544 1.00 61.40 C ATOM 1030 CG LYS A 71 1.140 -0.553 -12.579 1.00 43.05 C ATOM 1031 CD LYS A 71 0.550 -0.577 -13.980 1.00 62.31 C ATOM 1032 CE LYS A 71 -0.356 0.620 -14.223 1.00 34.11 C ATOM 1033 NZ LYS A 71 -0.280 1.097 -15.631 1.00 62.24 N ATOM 0 H LYS A 71 2.157 -0.919 -9.868 1.00 35.12 H new ATOM 0 HA LYS A 71 3.896 1.044 -11.187 1.00 21.23 H new ATOM 0 HB2 LYS A 71 2.376 1.099 -13.144 1.00 61.40 H new ATOM 0 HB3 LYS A 71 3.231 -0.425 -13.009 1.00 61.40 H new ATOM 0 HG2 LYS A 71 1.288 -1.574 -12.228 1.00 43.05 H new ATOM 0 HG3 LYS A 71 0.436 -0.079 -11.895 1.00 43.05 H new ATOM 0 HD2 LYS A 71 1.355 -0.581 -14.715 1.00 62.31 H new ATOM 0 HD3 LYS A 71 -0.016 -1.498 -14.122 1.00 62.31 H new ATOM 0 HE2 LYS A 71 -1.385 0.350 -13.986 1.00 34.11 H new ATOM 0 HE3 LYS A 71 -0.076 1.430 -13.550 1.00 34.11 H new ATOM 0 HZ1 LYS A 71 -0.912 1.914 -15.755 1.00 62.24 H new ATOM 0 HZ2 LYS A 71 0.697 1.379 -15.850 1.00 62.24 H new ATOM 0 HZ3 LYS A 71 -0.572 0.332 -16.273 1.00 62.24 H new ATOM 1047 N ALA A 72 2.075 2.834 -10.894 1.00 42.40 N ATOM 1048 CA ALA A 72 1.198 3.882 -10.386 1.00 55.43 C ATOM 1049 C ALA A 72 0.035 4.135 -11.340 1.00 12.11 C ATOM 1050 O ALA A 72 0.160 3.949 -12.550 1.00 60.33 O ATOM 1051 CB ALA A 72 1.984 5.165 -10.158 1.00 43.13 C ATOM 0 H ALA A 72 2.789 3.160 -11.545 1.00 42.40 H new ATOM 0 HA ALA A 72 0.787 3.547 -9.434 1.00 55.43 H new ATOM 0 HB1 ALA A 72 1.316 5.938 -9.779 1.00 43.13 H new ATOM 0 HB2 ALA A 72 2.776 4.982 -9.432 1.00 43.13 H new ATOM 0 HB3 ALA A 72 2.423 5.495 -11.099 1.00 43.13 H new ATOM 1057 N VAL A 73 -1.096 4.560 -10.786 1.00 74.33 N ATOM 1058 CA VAL A 73 -2.282 4.839 -11.587 1.00 52.34 C ATOM 1059 C VAL A 73 -2.831 6.230 -11.292 1.00 12.21 C ATOM 1060 O VAL A 73 -2.830 6.677 -10.146 1.00 1.33 O ATOM 1061 CB VAL A 73 -3.388 3.798 -11.334 1.00 21.31 C ATOM 1062 CG1 VAL A 73 -4.593 4.072 -12.220 1.00 12.42 C ATOM 1063 CG2 VAL A 73 -2.858 2.391 -11.563 1.00 32.34 C ATOM 0 H VAL A 73 -1.216 4.719 -9.786 1.00 74.33 H new ATOM 0 HA VAL A 73 -1.977 4.787 -12.632 1.00 52.34 H new ATOM 0 HB VAL A 73 -3.706 3.878 -10.294 1.00 21.31 H new ATOM 0 HG11 VAL A 73 -5.364 3.326 -12.027 1.00 12.42 H new ATOM 0 HG12 VAL A 73 -4.986 5.065 -12.002 1.00 12.42 H new ATOM 0 HG13 VAL A 73 -4.294 4.022 -13.267 1.00 12.42 H new ATOM 0 HG21 VAL A 73 -3.653 1.668 -11.380 1.00 32.34 H new ATOM 0 HG22 VAL A 73 -2.511 2.296 -12.592 1.00 32.34 H new ATOM 0 HG23 VAL A 73 -2.029 2.199 -10.882 1.00 32.34 H new ATOM 1073 N GLU A 74 -3.299 6.909 -12.334 1.00 53.41 N ATOM 1074 CA GLU A 74 -3.852 8.251 -12.184 1.00 60.44 C ATOM 1075 C GLU A 74 -5.377 8.215 -12.198 1.00 40.43 C ATOM 1076 O GLU A 74 -5.999 8.182 -13.259 1.00 62.44 O ATOM 1077 CB GLU A 74 -3.341 9.163 -13.302 1.00 52.03 C ATOM 1078 CG GLU A 74 -1.935 9.688 -13.065 1.00 21.43 C ATOM 1079 CD GLU A 74 -1.578 10.837 -13.987 1.00 51.21 C ATOM 1080 OE1 GLU A 74 -2.497 11.584 -14.388 1.00 25.45 O ATOM 1081 OE2 GLU A 74 -0.382 10.990 -14.310 1.00 4.42 O ATOM 0 H GLU A 74 -3.307 6.553 -13.290 1.00 53.41 H new ATOM 0 HA GLU A 74 -3.525 8.647 -11.223 1.00 60.44 H new ATOM 0 HB2 GLU A 74 -3.361 8.615 -14.244 1.00 52.03 H new ATOM 0 HB3 GLU A 74 -4.022 10.008 -13.410 1.00 52.03 H new ATOM 0 HG2 GLU A 74 -1.844 10.016 -12.030 1.00 21.43 H new ATOM 0 HG3 GLU A 74 -1.220 8.878 -13.207 1.00 21.43 H new ATOM 1088 N GLY A 75 -5.974 8.224 -11.010 1.00 54.41 N ATOM 1089 CA GLY A 75 -7.421 8.193 -10.907 1.00 62.31 C ATOM 1090 C GLY A 75 -7.936 6.865 -10.386 1.00 51.44 C ATOM 1091 O GLY A 75 -7.954 6.629 -9.179 1.00 65.31 O ATOM 0 H GLY A 75 -5.481 8.252 -10.117 1.00 54.41 H new ATOM 0 HA2 GLY A 75 -7.752 8.993 -10.245 1.00 62.31 H new ATOM 0 HA3 GLY A 75 -7.856 8.389 -11.887 1.00 62.31 H new ATOM 1095 N GLU A 76 -8.359 5.997 -11.300 1.00 50.50 N ATOM 1096 CA GLU A 76 -8.880 4.688 -10.926 1.00 23.12 C ATOM 1097 C GLU A 76 -7.932 3.578 -11.372 1.00 34.42 C ATOM 1098 O GLU A 76 -7.587 3.478 -12.549 1.00 43.53 O ATOM 1099 CB GLU A 76 -10.264 4.469 -11.541 1.00 2.05 C ATOM 1100 CG GLU A 76 -10.226 4.121 -13.019 1.00 72.10 C ATOM 1101 CD GLU A 76 -11.400 4.699 -13.785 1.00 43.20 C ATOM 1102 OE1 GLU A 76 -12.528 4.192 -13.612 1.00 45.31 O ATOM 1103 OE2 GLU A 76 -11.190 5.657 -14.558 1.00 64.32 O ATOM 0 H GLU A 76 -8.351 6.177 -12.304 1.00 50.50 H new ATOM 0 HA GLU A 76 -8.965 4.656 -9.840 1.00 23.12 H new ATOM 0 HB2 GLU A 76 -10.769 3.668 -11.001 1.00 2.05 H new ATOM 0 HB3 GLU A 76 -10.860 5.371 -11.404 1.00 2.05 H new ATOM 0 HG2 GLU A 76 -9.297 4.492 -13.452 1.00 72.10 H new ATOM 0 HG3 GLU A 76 -10.221 3.037 -13.133 1.00 72.10 H new ATOM 1110 N ALA A 77 -7.517 2.745 -10.423 1.00 52.44 N ATOM 1111 CA ALA A 77 -6.612 1.642 -10.717 1.00 61.43 C ATOM 1112 C ALA A 77 -7.371 0.324 -10.834 1.00 10.24 C ATOM 1113 O ALA A 77 -8.592 0.287 -10.689 1.00 53.23 O ATOM 1114 CB ALA A 77 -5.536 1.541 -9.645 1.00 55.04 C ATOM 0 H ALA A 77 -7.794 2.814 -9.444 1.00 52.44 H new ATOM 0 HA ALA A 77 -6.135 1.842 -11.677 1.00 61.43 H new ATOM 0 HB1 ALA A 77 -4.867 0.712 -9.878 1.00 55.04 H new ATOM 0 HB2 ALA A 77 -4.966 2.470 -9.613 1.00 55.04 H new ATOM 0 HB3 ALA A 77 -6.003 1.369 -8.675 1.00 55.04 H new ATOM 1120 N GLU A 78 -6.639 -0.754 -11.096 1.00 31.31 N ATOM 1121 CA GLU A 78 -7.246 -2.073 -11.234 1.00 12.33 C ATOM 1122 C GLU A 78 -6.393 -3.138 -10.551 1.00 22.11 C ATOM 1123 O GLU A 78 -5.172 -3.165 -10.707 1.00 72.02 O ATOM 1124 CB GLU A 78 -7.431 -2.422 -12.711 1.00 63.33 C ATOM 1125 CG GLU A 78 -6.134 -2.776 -13.420 1.00 72.34 C ATOM 1126 CD GLU A 78 -6.343 -3.117 -14.883 1.00 43.32 C ATOM 1127 OE1 GLU A 78 -7.156 -4.019 -15.173 1.00 30.03 O ATOM 1128 OE2 GLU A 78 -5.691 -2.481 -15.738 1.00 10.33 O ATOM 0 H GLU A 78 -5.626 -0.740 -11.217 1.00 31.31 H new ATOM 0 HA GLU A 78 -8.222 -2.048 -10.750 1.00 12.33 H new ATOM 0 HB2 GLU A 78 -8.121 -3.262 -12.794 1.00 63.33 H new ATOM 0 HB3 GLU A 78 -7.895 -1.577 -13.220 1.00 63.33 H new ATOM 0 HG2 GLU A 78 -5.441 -1.938 -13.341 1.00 72.34 H new ATOM 0 HG3 GLU A 78 -5.668 -3.623 -12.916 1.00 72.34 H new ATOM 1135 N ALA A 79 -7.044 -4.013 -9.792 1.00 72.02 N ATOM 1136 CA ALA A 79 -6.347 -5.081 -9.087 1.00 1.31 C ATOM 1137 C ALA A 79 -7.320 -5.929 -8.276 1.00 74.51 C ATOM 1138 O ALA A 79 -8.454 -5.521 -8.022 1.00 42.12 O ATOM 1139 CB ALA A 79 -5.270 -4.500 -8.182 1.00 22.31 C ATOM 0 H ALA A 79 -8.054 -4.003 -9.650 1.00 72.02 H new ATOM 0 HA ALA A 79 -5.875 -5.725 -9.829 1.00 1.31 H new ATOM 0 HB1 ALA A 79 -4.757 -5.309 -7.661 1.00 22.31 H new ATOM 0 HB2 ALA A 79 -4.552 -3.942 -8.783 1.00 22.31 H new ATOM 0 HB3 ALA A 79 -5.729 -3.832 -7.453 1.00 22.31 H new ATOM 1145 N ASP A 80 -6.872 -7.113 -7.872 1.00 63.00 N ATOM 1146 CA ASP A 80 -7.703 -8.020 -7.089 1.00 61.12 C ATOM 1147 C ASP A 80 -8.302 -7.304 -5.884 1.00 10.44 C ATOM 1148 O ASP A 80 -9.481 -7.474 -5.570 1.00 21.13 O ATOM 1149 CB ASP A 80 -6.884 -9.226 -6.627 1.00 25.33 C ATOM 1150 CG ASP A 80 -6.438 -10.101 -7.782 1.00 13.04 C ATOM 1151 OD1 ASP A 80 -6.088 -9.547 -8.845 1.00 74.44 O ATOM 1152 OD2 ASP A 80 -6.437 -11.339 -7.621 1.00 75.20 O ATOM 0 H ASP A 80 -5.937 -7.467 -8.074 1.00 63.00 H new ATOM 0 HA ASP A 80 -8.518 -8.367 -7.725 1.00 61.12 H new ATOM 0 HB2 ASP A 80 -6.008 -8.878 -6.079 1.00 25.33 H new ATOM 0 HB3 ASP A 80 -7.478 -9.821 -5.933 1.00 25.33 H new ATOM 1157 N PHE A 81 -7.483 -6.501 -5.211 1.00 75.12 N ATOM 1158 CA PHE A 81 -7.932 -5.760 -4.038 1.00 75.43 C ATOM 1159 C PHE A 81 -7.664 -4.267 -4.204 1.00 31.33 C ATOM 1160 O PHE A 81 -6.513 -3.830 -4.222 1.00 72.22 O ATOM 1161 CB PHE A 81 -7.231 -6.280 -2.781 1.00 50.10 C ATOM 1162 CG PHE A 81 -7.561 -7.710 -2.459 1.00 40.23 C ATOM 1163 CD1 PHE A 81 -8.837 -8.066 -2.056 1.00 1.11 C ATOM 1164 CD2 PHE A 81 -6.593 -8.697 -2.559 1.00 11.35 C ATOM 1165 CE1 PHE A 81 -9.143 -9.381 -1.759 1.00 52.12 C ATOM 1166 CE2 PHE A 81 -6.894 -10.012 -2.263 1.00 65.15 C ATOM 1167 CZ PHE A 81 -8.170 -10.355 -1.862 1.00 13.03 C ATOM 0 H PHE A 81 -6.505 -6.347 -5.458 1.00 75.12 H new ATOM 0 HA PHE A 81 -9.007 -5.909 -3.933 1.00 75.43 H new ATOM 0 HB2 PHE A 81 -6.153 -6.184 -2.910 1.00 50.10 H new ATOM 0 HB3 PHE A 81 -7.508 -5.652 -1.934 1.00 50.10 H new ATOM 0 HD1 PHE A 81 -9.602 -7.308 -1.973 1.00 1.11 H new ATOM 0 HD2 PHE A 81 -5.593 -8.435 -2.872 1.00 11.35 H new ATOM 0 HE1 PHE A 81 -10.142 -9.646 -1.447 1.00 52.12 H new ATOM 0 HE2 PHE A 81 -6.131 -10.772 -2.345 1.00 65.15 H new ATOM 0 HZ PHE A 81 -8.406 -11.383 -1.629 1.00 13.03 H new ATOM 1177 N VAL A 82 -8.736 -3.489 -4.323 1.00 42.11 N ATOM 1178 CA VAL A 82 -8.617 -2.045 -4.486 1.00 33.44 C ATOM 1179 C VAL A 82 -9.216 -1.307 -3.294 1.00 32.33 C ATOM 1180 O VAL A 82 -10.346 -1.578 -2.887 1.00 12.54 O ATOM 1181 CB VAL A 82 -9.313 -1.567 -5.774 1.00 32.30 C ATOM 1182 CG1 VAL A 82 -9.297 -0.049 -5.858 1.00 14.55 C ATOM 1183 CG2 VAL A 82 -8.652 -2.183 -6.997 1.00 64.00 C ATOM 0 H VAL A 82 -9.696 -3.835 -4.310 1.00 42.11 H new ATOM 0 HA VAL A 82 -7.553 -1.820 -4.552 1.00 33.44 H new ATOM 0 HB VAL A 82 -10.352 -1.895 -5.747 1.00 32.30 H new ATOM 0 HG11 VAL A 82 -9.793 0.270 -6.775 1.00 14.55 H new ATOM 0 HG12 VAL A 82 -9.820 0.369 -4.998 1.00 14.55 H new ATOM 0 HG13 VAL A 82 -8.266 0.304 -5.862 1.00 14.55 H new ATOM 0 HG21 VAL A 82 -9.157 -1.834 -7.898 1.00 64.00 H new ATOM 0 HG22 VAL A 82 -7.603 -1.888 -7.031 1.00 64.00 H new ATOM 0 HG23 VAL A 82 -8.721 -3.269 -6.940 1.00 64.00 H new ATOM 1193 N ILE A 83 -8.451 -0.373 -2.738 1.00 72.44 N ATOM 1194 CA ILE A 83 -8.907 0.406 -1.594 1.00 22.34 C ATOM 1195 C ILE A 83 -8.738 1.900 -1.844 1.00 11.25 C ATOM 1196 O ILE A 83 -7.675 2.353 -2.266 1.00 25.24 O ATOM 1197 CB ILE A 83 -8.143 0.021 -0.312 1.00 11.41 C ATOM 1198 CG1 ILE A 83 -8.030 -1.500 -0.196 1.00 12.41 C ATOM 1199 CG2 ILE A 83 -8.837 0.601 0.912 1.00 15.40 C ATOM 1200 CD1 ILE A 83 -7.089 -1.954 0.898 1.00 10.31 C ATOM 0 H ILE A 83 -7.513 -0.138 -3.062 1.00 72.44 H new ATOM 0 HA ILE A 83 -9.965 0.181 -1.459 1.00 22.34 H new ATOM 0 HB ILE A 83 -7.137 0.437 -0.367 1.00 11.41 H new ATOM 0 HG12 ILE A 83 -9.020 -1.917 -0.009 1.00 12.41 H new ATOM 0 HG13 ILE A 83 -7.689 -1.905 -1.149 1.00 12.41 H new ATOM 0 HG21 ILE A 83 -8.286 0.321 1.810 1.00 15.40 H new ATOM 0 HG22 ILE A 83 -8.870 1.687 0.831 1.00 15.40 H new ATOM 0 HG23 ILE A 83 -9.853 0.211 0.973 1.00 15.40 H new ATOM 0 HD11 ILE A 83 -7.058 -3.043 0.923 1.00 10.31 H new ATOM 0 HD12 ILE A 83 -6.089 -1.567 0.702 1.00 10.31 H new ATOM 0 HD13 ILE A 83 -7.441 -1.579 1.859 1.00 10.31 H new ATOM 1212 N GLU A 84 -9.795 2.662 -1.577 1.00 43.53 N ATOM 1213 CA GLU A 84 -9.763 4.106 -1.773 1.00 10.23 C ATOM 1214 C GLU A 84 -10.081 4.838 -0.472 1.00 44.31 C ATOM 1215 O GLU A 84 -11.017 4.480 0.242 1.00 4.10 O ATOM 1216 CB GLU A 84 -10.758 4.519 -2.859 1.00 34.14 C ATOM 1217 CG GLU A 84 -10.939 6.023 -2.981 1.00 22.14 C ATOM 1218 CD GLU A 84 -12.372 6.416 -3.283 1.00 3.41 C ATOM 1219 OE1 GLU A 84 -12.733 6.470 -4.477 1.00 32.50 O ATOM 1220 OE2 GLU A 84 -13.131 6.669 -2.325 1.00 13.31 O ATOM 0 H GLU A 84 -10.683 2.303 -1.225 1.00 43.53 H new ATOM 0 HA GLU A 84 -8.757 4.381 -2.089 1.00 10.23 H new ATOM 0 HB2 GLU A 84 -10.421 4.123 -3.817 1.00 34.14 H new ATOM 0 HB3 GLU A 84 -11.724 4.062 -2.647 1.00 34.14 H new ATOM 0 HG2 GLU A 84 -10.624 6.500 -2.053 1.00 22.14 H new ATOM 0 HG3 GLU A 84 -10.289 6.401 -3.770 1.00 22.14 H new ATOM 1227 N ALA A 85 -9.293 5.866 -0.171 1.00 12.22 N ATOM 1228 CA ALA A 85 -9.490 6.650 1.042 1.00 55.40 C ATOM 1229 C ALA A 85 -8.787 8.000 0.944 1.00 33.31 C ATOM 1230 O ALA A 85 -8.048 8.257 -0.006 1.00 1.42 O ATOM 1231 CB ALA A 85 -8.991 5.879 2.255 1.00 52.03 C ATOM 0 H ALA A 85 -8.513 6.175 -0.751 1.00 12.22 H new ATOM 0 HA ALA A 85 -10.558 6.834 1.157 1.00 55.40 H new ATOM 0 HB1 ALA A 85 -9.144 6.476 3.154 1.00 52.03 H new ATOM 0 HB2 ALA A 85 -9.542 4.943 2.343 1.00 52.03 H new ATOM 0 HB3 ALA A 85 -7.929 5.665 2.138 1.00 52.03 H new ATOM 1237 N ASP A 86 -9.023 8.857 1.931 1.00 10.51 N ATOM 1238 CA ASP A 86 -8.411 10.181 1.956 1.00 73.32 C ATOM 1239 C ASP A 86 -6.897 10.077 2.111 1.00 52.13 C ATOM 1240 O ASP A 86 -6.397 9.289 2.913 1.00 24.43 O ATOM 1241 CB ASP A 86 -8.998 11.015 3.096 1.00 20.33 C ATOM 1242 CG ASP A 86 -10.448 11.385 2.857 1.00 73.03 C ATOM 1243 OD1 ASP A 86 -10.783 11.765 1.715 1.00 74.20 O ATOM 1244 OD2 ASP A 86 -11.248 11.294 3.811 1.00 0.51 O ATOM 0 H ASP A 86 -9.633 8.659 2.724 1.00 10.51 H new ATOM 0 HA ASP A 86 -8.627 10.673 1.008 1.00 73.32 H new ATOM 0 HB2 ASP A 86 -8.918 10.457 4.029 1.00 20.33 H new ATOM 0 HB3 ASP A 86 -8.409 11.924 3.217 1.00 20.33 H new ATOM 1249 N LEU A 87 -6.173 10.877 1.336 1.00 65.33 N ATOM 1250 CA LEU A 87 -4.714 10.875 1.386 1.00 74.41 C ATOM 1251 C LEU A 87 -4.219 10.996 2.822 1.00 31.13 C ATOM 1252 O LEU A 87 -3.311 10.278 3.239 1.00 65.23 O ATOM 1253 CB LEU A 87 -4.155 12.021 0.543 1.00 55.52 C ATOM 1254 CG LEU A 87 -2.658 12.294 0.690 1.00 25.14 C ATOM 1255 CD1 LEU A 87 -1.847 11.115 0.172 1.00 22.13 C ATOM 1256 CD2 LEU A 87 -2.273 13.570 -0.043 1.00 14.42 C ATOM 0 H LEU A 87 -6.571 11.535 0.666 1.00 65.33 H new ATOM 0 HA LEU A 87 -4.362 9.927 0.979 1.00 74.41 H new ATOM 0 HB2 LEU A 87 -4.364 11.810 -0.506 1.00 55.52 H new ATOM 0 HB3 LEU A 87 -4.697 12.932 0.799 1.00 55.52 H new ATOM 0 HG LEU A 87 -2.435 12.426 1.749 1.00 25.14 H new ATOM 0 HD11 LEU A 87 -0.784 11.327 0.285 1.00 22.13 H new ATOM 0 HD12 LEU A 87 -2.101 10.221 0.741 1.00 22.13 H new ATOM 0 HD13 LEU A 87 -2.075 10.951 -0.881 1.00 22.13 H new ATOM 0 HD21 LEU A 87 -1.204 13.748 0.073 1.00 14.42 H new ATOM 0 HD22 LEU A 87 -2.511 13.467 -1.102 1.00 14.42 H new ATOM 0 HD23 LEU A 87 -2.828 14.411 0.374 1.00 14.42 H new ATOM 1268 N ALA A 88 -4.824 11.907 3.578 1.00 42.24 N ATOM 1269 CA ALA A 88 -4.447 12.119 4.969 1.00 60.11 C ATOM 1270 C ALA A 88 -4.389 10.799 5.729 1.00 33.33 C ATOM 1271 O ALA A 88 -3.401 10.497 6.399 1.00 43.54 O ATOM 1272 CB ALA A 88 -5.422 13.075 5.641 1.00 63.14 C ATOM 0 H ALA A 88 -5.578 12.510 3.249 1.00 42.24 H new ATOM 0 HA ALA A 88 -3.451 12.562 4.986 1.00 60.11 H new ATOM 0 HB1 ALA A 88 -5.128 13.224 6.680 1.00 63.14 H new ATOM 0 HB2 ALA A 88 -5.411 14.032 5.120 1.00 63.14 H new ATOM 0 HB3 ALA A 88 -6.427 12.654 5.605 1.00 63.14 H new ATOM 1278 N THR A 89 -5.457 10.013 5.624 1.00 21.13 N ATOM 1279 CA THR A 89 -5.528 8.725 6.304 1.00 53.24 C ATOM 1280 C THR A 89 -4.450 7.776 5.796 1.00 70.33 C ATOM 1281 O THR A 89 -3.900 6.982 6.559 1.00 21.32 O ATOM 1282 CB THR A 89 -6.908 8.066 6.113 1.00 3.24 C ATOM 1283 OG1 THR A 89 -7.939 8.941 6.584 1.00 42.51 O ATOM 1284 CG2 THR A 89 -6.981 6.741 6.857 1.00 42.33 C ATOM 0 H THR A 89 -6.284 10.246 5.075 1.00 21.13 H new ATOM 0 HA THR A 89 -5.368 8.917 7.365 1.00 53.24 H new ATOM 0 HB THR A 89 -7.052 7.877 5.049 1.00 3.24 H new ATOM 0 HG1 THR A 89 -8.813 8.515 6.457 1.00 42.51 H new ATOM 0 HG21 THR A 89 -7.964 6.294 6.708 1.00 42.33 H new ATOM 0 HG22 THR A 89 -6.214 6.067 6.476 1.00 42.33 H new ATOM 0 HG23 THR A 89 -6.818 6.912 7.921 1.00 42.33 H new ATOM 1292 N TRP A 90 -4.149 7.863 4.505 1.00 11.33 N ATOM 1293 CA TRP A 90 -3.135 7.011 3.897 1.00 63.10 C ATOM 1294 C TRP A 90 -1.754 7.316 4.467 1.00 70.31 C ATOM 1295 O TRP A 90 -1.079 6.428 4.988 1.00 51.21 O ATOM 1296 CB TRP A 90 -3.125 7.198 2.378 1.00 22.12 C ATOM 1297 CG TRP A 90 -4.196 6.419 1.677 1.00 21.44 C ATOM 1298 CD1 TRP A 90 -5.152 6.912 0.837 1.00 42.52 C ATOM 1299 CD2 TRP A 90 -4.420 5.007 1.758 1.00 74.11 C ATOM 1300 NE1 TRP A 90 -5.957 5.892 0.389 1.00 12.33 N ATOM 1301 CE2 TRP A 90 -5.529 4.713 0.940 1.00 44.14 C ATOM 1302 CE3 TRP A 90 -3.791 3.961 2.439 1.00 13.41 C ATOM 1303 CZ2 TRP A 90 -6.020 3.419 0.788 1.00 52.22 C ATOM 1304 CZ3 TRP A 90 -4.280 2.678 2.288 1.00 63.24 C ATOM 1305 CH2 TRP A 90 -5.385 2.416 1.467 1.00 72.15 C ATOM 0 H TRP A 90 -4.593 8.516 3.859 1.00 11.33 H new ATOM 0 HA TRP A 90 -3.382 5.975 4.127 1.00 63.10 H new ATOM 0 HB2 TRP A 90 -3.246 8.257 2.149 1.00 22.12 H new ATOM 0 HB3 TRP A 90 -2.153 6.897 1.988 1.00 22.12 H new ATOM 0 HD1 TRP A 90 -5.260 7.951 0.564 1.00 42.52 H new ATOM 0 HE1 TRP A 90 -6.745 5.996 -0.250 1.00 12.33 H new ATOM 0 HE3 TRP A 90 -2.937 4.153 3.072 1.00 13.41 H new ATOM 0 HZ2 TRP A 90 -6.872 3.215 0.156 1.00 52.22 H new ATOM 0 HZ3 TRP A 90 -3.803 1.863 2.812 1.00 63.24 H new ATOM 0 HH2 TRP A 90 -5.742 1.402 1.368 1.00 72.15 H new ATOM 1316 N GLN A 91 -1.341 8.575 4.366 1.00 70.40 N ATOM 1317 CA GLN A 91 -0.041 8.995 4.872 1.00 12.35 C ATOM 1318 C GLN A 91 0.242 8.369 6.233 1.00 71.21 C ATOM 1319 O GLN A 91 1.348 7.896 6.491 1.00 4.14 O ATOM 1320 CB GLN A 91 0.021 10.520 4.977 1.00 51.33 C ATOM 1321 CG GLN A 91 -0.059 11.226 3.633 1.00 61.45 C ATOM 1322 CD GLN A 91 1.255 11.867 3.231 1.00 22.24 C ATOM 1323 OE1 GLN A 91 2.246 11.789 3.960 1.00 15.52 O ATOM 1324 NE2 GLN A 91 1.271 12.505 2.067 1.00 21.32 N ATOM 0 H GLN A 91 -1.888 9.322 3.938 1.00 70.40 H new ATOM 0 HA GLN A 91 0.720 8.655 4.170 1.00 12.35 H new ATOM 0 HB2 GLN A 91 -0.797 10.866 5.609 1.00 51.33 H new ATOM 0 HB3 GLN A 91 0.949 10.804 5.473 1.00 51.33 H new ATOM 0 HG2 GLN A 91 -0.358 10.510 2.868 1.00 61.45 H new ATOM 0 HG3 GLN A 91 -0.834 11.991 3.674 1.00 61.45 H new ATOM 0 HE21 GLN A 91 0.427 12.545 1.495 1.00 21.32 H new ATOM 0 HE22 GLN A 91 2.127 12.956 1.744 1.00 21.32 H new ATOM 1333 N GLU A 92 -0.767 8.369 7.100 1.00 63.22 N ATOM 1334 CA GLU A 92 -0.624 7.801 8.435 1.00 32.44 C ATOM 1335 C GLU A 92 -0.142 6.355 8.364 1.00 62.44 C ATOM 1336 O GLU A 92 0.965 6.035 8.797 1.00 33.23 O ATOM 1337 CB GLU A 92 -1.956 7.868 9.187 1.00 5.41 C ATOM 1338 CG GLU A 92 -2.683 9.191 9.017 1.00 12.32 C ATOM 1339 CD GLU A 92 -2.920 9.901 10.337 1.00 73.33 C ATOM 1340 OE1 GLU A 92 -2.203 9.594 11.311 1.00 4.11 O ATOM 1341 OE2 GLU A 92 -3.823 10.761 10.394 1.00 31.10 O ATOM 0 H GLU A 92 -1.690 8.755 6.902 1.00 63.22 H new ATOM 0 HA GLU A 92 0.120 8.388 8.973 1.00 32.44 H new ATOM 0 HB2 GLU A 92 -2.601 7.061 8.840 1.00 5.41 H new ATOM 0 HB3 GLU A 92 -1.774 7.696 10.248 1.00 5.41 H new ATOM 0 HG2 GLU A 92 -2.103 9.838 8.360 1.00 12.32 H new ATOM 0 HG3 GLU A 92 -3.640 9.015 8.527 1.00 12.32 H new ATOM 1348 N VAL A 93 -0.980 5.483 7.812 1.00 53.31 N ATOM 1349 CA VAL A 93 -0.641 4.072 7.681 1.00 30.21 C ATOM 1350 C VAL A 93 0.840 3.889 7.369 1.00 1.44 C ATOM 1351 O VAL A 93 1.572 3.252 8.127 1.00 24.43 O ATOM 1352 CB VAL A 93 -1.474 3.393 6.578 1.00 75.32 C ATOM 1353 CG1 VAL A 93 -0.987 1.973 6.339 1.00 75.33 C ATOM 1354 CG2 VAL A 93 -2.951 3.406 6.943 1.00 34.11 C ATOM 0 H VAL A 93 -1.900 5.730 7.448 1.00 53.31 H new ATOM 0 HA VAL A 93 -0.869 3.603 8.638 1.00 30.21 H new ATOM 0 HB VAL A 93 -1.347 3.955 5.652 1.00 75.32 H new ATOM 0 HG11 VAL A 93 -1.588 1.509 5.556 1.00 75.33 H new ATOM 0 HG12 VAL A 93 0.058 1.994 6.030 1.00 75.33 H new ATOM 0 HG13 VAL A 93 -1.082 1.396 7.259 1.00 75.33 H new ATOM 0 HG21 VAL A 93 -3.525 2.922 6.153 1.00 34.11 H new ATOM 0 HG22 VAL A 93 -3.099 2.869 7.880 1.00 34.11 H new ATOM 0 HG23 VAL A 93 -3.288 4.436 7.058 1.00 34.11 H new ATOM 1364 N LEU A 94 1.276 4.453 6.248 1.00 5.42 N ATOM 1365 CA LEU A 94 2.672 4.355 5.835 1.00 22.30 C ATOM 1366 C LEU A 94 3.598 4.936 6.898 1.00 41.22 C ATOM 1367 O LEU A 94 4.692 4.423 7.128 1.00 3.03 O ATOM 1368 CB LEU A 94 2.883 5.081 4.505 1.00 40.21 C ATOM 1369 CG LEU A 94 3.290 4.207 3.319 1.00 23.11 C ATOM 1370 CD1 LEU A 94 2.729 4.770 2.022 1.00 24.14 C ATOM 1371 CD2 LEU A 94 4.805 4.087 3.240 1.00 32.11 C ATOM 0 H LEU A 94 0.683 4.983 5.609 1.00 5.42 H new ATOM 0 HA LEU A 94 2.914 3.300 5.708 1.00 22.30 H new ATOM 0 HB2 LEU A 94 1.960 5.601 4.248 1.00 40.21 H new ATOM 0 HB3 LEU A 94 3.649 5.843 4.648 1.00 40.21 H new ATOM 0 HG LEU A 94 2.874 3.211 3.467 1.00 23.11 H new ATOM 0 HD11 LEU A 94 3.030 4.134 1.189 1.00 24.14 H new ATOM 0 HD12 LEU A 94 1.641 4.802 2.080 1.00 24.14 H new ATOM 0 HD13 LEU A 94 3.114 5.778 1.866 1.00 24.14 H new ATOM 0 HD21 LEU A 94 5.077 3.461 2.390 1.00 32.11 H new ATOM 0 HD22 LEU A 94 5.242 5.078 3.116 1.00 32.11 H new ATOM 0 HD23 LEU A 94 5.183 3.636 4.158 1.00 32.11 H new ATOM 1383 N GLU A 95 3.150 6.007 7.544 1.00 52.31 N ATOM 1384 CA GLU A 95 3.938 6.657 8.585 1.00 55.45 C ATOM 1385 C GLU A 95 4.080 5.752 9.805 1.00 73.22 C ATOM 1386 O GLU A 95 4.831 6.054 10.731 1.00 14.12 O ATOM 1387 CB GLU A 95 3.291 7.983 8.992 1.00 22.44 C ATOM 1388 CG GLU A 95 3.730 9.162 8.140 1.00 65.14 C ATOM 1389 CD GLU A 95 4.346 10.278 8.962 1.00 72.02 C ATOM 1390 OE1 GLU A 95 5.481 10.099 9.451 1.00 12.02 O ATOM 1391 OE2 GLU A 95 3.692 11.331 9.114 1.00 2.35 O ATOM 0 H GLU A 95 2.246 6.443 7.365 1.00 52.31 H new ATOM 0 HA GLU A 95 4.932 6.854 8.183 1.00 55.45 H new ATOM 0 HB2 GLU A 95 2.207 7.883 8.928 1.00 22.44 H new ATOM 0 HB3 GLU A 95 3.531 8.190 10.035 1.00 22.44 H new ATOM 0 HG2 GLU A 95 4.452 8.821 7.398 1.00 65.14 H new ATOM 0 HG3 GLU A 95 2.871 9.550 7.593 1.00 65.14 H new ATOM 1398 N GLY A 96 3.352 4.639 9.797 1.00 54.04 N ATOM 1399 CA GLY A 96 3.411 3.706 10.907 1.00 5.22 C ATOM 1400 C GLY A 96 2.414 4.042 11.999 1.00 0.33 C ATOM 1401 O GLY A 96 2.133 3.217 12.868 1.00 31.52 O ATOM 0 H GLY A 96 2.723 4.367 9.042 1.00 54.04 H new ATOM 0 HA2 GLY A 96 3.218 2.698 10.541 1.00 5.22 H new ATOM 0 HA3 GLY A 96 4.418 3.706 11.325 1.00 5.22 H new ATOM 1405 N ARG A 97 1.879 5.259 11.957 1.00 43.13 N ATOM 1406 CA ARG A 97 0.912 5.703 12.953 1.00 73.54 C ATOM 1407 C ARG A 97 -0.397 4.929 12.821 1.00 3.42 C ATOM 1408 O ARG A 97 -1.008 4.547 13.820 1.00 4.13 O ATOM 1409 CB ARG A 97 0.647 7.202 12.804 1.00 61.22 C ATOM 1410 CG ARG A 97 1.812 8.073 13.245 1.00 12.43 C ATOM 1411 CD ARG A 97 1.432 8.957 14.423 1.00 32.32 C ATOM 1412 NE ARG A 97 2.154 10.226 14.411 1.00 53.01 N ATOM 1413 CZ ARG A 97 1.954 11.194 15.298 1.00 3.23 C ATOM 1414 NH1 ARG A 97 1.060 11.037 16.264 1.00 4.53 N ATOM 1415 NH2 ARG A 97 2.651 12.321 15.221 1.00 61.21 N ATOM 0 H ARG A 97 2.099 5.954 11.244 1.00 43.13 H new ATOM 0 HA ARG A 97 1.330 5.511 13.941 1.00 73.54 H new ATOM 0 HB2 ARG A 97 0.416 7.420 11.761 1.00 61.22 H new ATOM 0 HB3 ARG A 97 -0.235 7.466 13.388 1.00 61.22 H new ATOM 0 HG2 ARG A 97 2.656 7.441 13.520 1.00 12.43 H new ATOM 0 HG3 ARG A 97 2.138 8.696 12.412 1.00 12.43 H new ATOM 0 HD2 ARG A 97 0.359 9.150 14.400 1.00 32.32 H new ATOM 0 HD3 ARG A 97 1.641 8.430 15.354 1.00 32.32 H new ATOM 0 HE ARG A 97 2.850 10.377 13.681 1.00 53.01 H new ATOM 0 HH11 ARG A 97 0.524 10.171 16.327 1.00 4.53 H new ATOM 0 HH12 ARG A 97 0.908 11.782 16.944 1.00 4.53 H new ATOM 0 HH21 ARG A 97 3.341 12.444 14.480 1.00 61.21 H new ATOM 0 HH22 ARG A 97 2.497 13.064 15.903 1.00 61.21 H new ATOM 1429 N LEU A 98 -0.823 4.702 11.583 1.00 5.13 N ATOM 1430 CA LEU A 98 -2.059 3.974 11.321 1.00 52.04 C ATOM 1431 C LEU A 98 -1.766 2.609 10.705 1.00 2.22 C ATOM 1432 O LEU A 98 -0.609 2.251 10.486 1.00 54.42 O ATOM 1433 CB LEU A 98 -2.962 4.784 10.388 1.00 21.31 C ATOM 1434 CG LEU A 98 -3.805 5.874 11.051 1.00 70.43 C ATOM 1435 CD1 LEU A 98 -4.663 6.587 10.018 1.00 63.05 C ATOM 1436 CD2 LEU A 98 -4.673 5.282 12.151 1.00 14.22 C ATOM 0 H LEU A 98 -0.330 5.012 10.745 1.00 5.13 H new ATOM 0 HA LEU A 98 -2.571 3.821 12.271 1.00 52.04 H new ATOM 0 HB2 LEU A 98 -2.338 5.249 9.624 1.00 21.31 H new ATOM 0 HB3 LEU A 98 -3.633 4.095 9.875 1.00 21.31 H new ATOM 0 HG LEU A 98 -3.132 6.604 11.501 1.00 70.43 H new ATOM 0 HD11 LEU A 98 -5.256 7.359 10.508 1.00 63.05 H new ATOM 0 HD12 LEU A 98 -4.021 7.045 9.266 1.00 63.05 H new ATOM 0 HD13 LEU A 98 -5.328 5.868 9.539 1.00 63.05 H new ATOM 0 HD21 LEU A 98 -5.266 6.072 12.612 1.00 14.22 H new ATOM 0 HD22 LEU A 98 -5.338 4.531 11.725 1.00 14.22 H new ATOM 0 HD23 LEU A 98 -4.038 4.818 12.906 1.00 14.22 H new ATOM 1448 N GLU A 99 -2.824 1.852 10.428 1.00 43.15 N ATOM 1449 CA GLU A 99 -2.680 0.527 9.837 1.00 43.53 C ATOM 1450 C GLU A 99 -3.673 0.330 8.695 1.00 74.02 C ATOM 1451 O GLU A 99 -4.763 0.904 8.680 1.00 44.41 O ATOM 1452 CB GLU A 99 -2.885 -0.555 10.899 1.00 34.11 C ATOM 1453 CG GLU A 99 -1.590 -1.181 11.388 1.00 52.13 C ATOM 1454 CD GLU A 99 -1.768 -2.620 11.830 1.00 72.22 C ATOM 1455 OE1 GLU A 99 -2.742 -2.902 12.559 1.00 75.45 O ATOM 1456 OE2 GLU A 99 -0.933 -3.466 11.445 1.00 72.42 O ATOM 0 H GLU A 99 -3.789 2.134 10.603 1.00 43.15 H new ATOM 0 HA GLU A 99 -1.670 0.444 9.435 1.00 43.53 H new ATOM 0 HB2 GLU A 99 -3.413 -0.123 11.749 1.00 34.11 H new ATOM 0 HB3 GLU A 99 -3.525 -1.337 10.490 1.00 34.11 H new ATOM 0 HG2 GLU A 99 -0.847 -1.139 10.592 1.00 52.13 H new ATOM 0 HG3 GLU A 99 -1.199 -0.595 12.220 1.00 52.13 H new ATOM 1463 N PRO A 100 -3.289 -0.501 7.714 1.00 13.32 N ATOM 1464 CA PRO A 100 -4.132 -0.794 6.550 1.00 24.01 C ATOM 1465 C PRO A 100 -5.354 -1.630 6.914 1.00 3.23 C ATOM 1466 O PRO A 100 -6.462 -1.364 6.447 1.00 21.10 O ATOM 1467 CB PRO A 100 -3.200 -1.583 5.628 1.00 43.23 C ATOM 1468 CG PRO A 100 -2.195 -2.198 6.541 1.00 32.00 C ATOM 1469 CD PRO A 100 -2.005 -1.220 7.667 1.00 52.23 C ATOM 0 HA PRO A 100 -4.533 0.113 6.099 1.00 24.01 H new ATOM 0 HB2 PRO A 100 -3.746 -2.344 5.070 1.00 43.23 H new ATOM 0 HB3 PRO A 100 -2.723 -0.932 4.896 1.00 43.23 H new ATOM 0 HG2 PRO A 100 -2.545 -3.160 6.915 1.00 32.00 H new ATOM 0 HG3 PRO A 100 -1.255 -2.381 6.020 1.00 32.00 H new ATOM 0 HD2 PRO A 100 -1.794 -1.727 8.608 1.00 52.23 H new ATOM 0 HD3 PRO A 100 -1.172 -0.543 7.475 1.00 52.23 H new ATOM 1477 N LEU A 101 -5.146 -2.640 7.752 1.00 41.21 N ATOM 1478 CA LEU A 101 -6.231 -3.514 8.180 1.00 74.41 C ATOM 1479 C LEU A 101 -7.080 -2.844 9.256 1.00 54.14 C ATOM 1480 O LEU A 101 -8.310 -2.876 9.200 1.00 44.20 O ATOM 1481 CB LEU A 101 -5.670 -4.836 8.707 1.00 34.51 C ATOM 1482 CG LEU A 101 -5.420 -5.924 7.662 1.00 32.51 C ATOM 1483 CD1 LEU A 101 -6.735 -6.525 7.192 1.00 61.42 C ATOM 1484 CD2 LEU A 101 -4.637 -5.363 6.485 1.00 54.51 C ATOM 0 H LEU A 101 -4.235 -2.873 8.148 1.00 41.21 H new ATOM 0 HA LEU A 101 -6.865 -3.714 7.316 1.00 74.41 H new ATOM 0 HB2 LEU A 101 -4.730 -4.630 9.220 1.00 34.51 H new ATOM 0 HB3 LEU A 101 -6.361 -5.229 9.453 1.00 34.51 H new ATOM 0 HG LEU A 101 -4.828 -6.714 8.123 1.00 32.51 H new ATOM 0 HD11 LEU A 101 -6.537 -7.297 6.449 1.00 61.42 H new ATOM 0 HD12 LEU A 101 -7.258 -6.964 8.041 1.00 61.42 H new ATOM 0 HD13 LEU A 101 -7.354 -5.745 6.749 1.00 61.42 H new ATOM 0 HD21 LEU A 101 -4.468 -6.151 5.751 1.00 54.51 H new ATOM 0 HD22 LEU A 101 -5.203 -4.553 6.024 1.00 54.51 H new ATOM 0 HD23 LEU A 101 -3.678 -4.982 6.835 1.00 54.51 H new ATOM 1496 N SER A 102 -6.416 -2.236 10.232 1.00 4.51 N ATOM 1497 CA SER A 102 -7.108 -1.558 11.322 1.00 13.42 C ATOM 1498 C SER A 102 -7.892 -0.356 10.803 1.00 41.13 C ATOM 1499 O SER A 102 -9.080 -0.208 11.084 1.00 14.33 O ATOM 1500 CB SER A 102 -6.108 -1.108 12.388 1.00 10.14 C ATOM 1501 OG SER A 102 -6.776 -0.618 13.539 1.00 72.04 O ATOM 0 H SER A 102 -5.398 -2.199 10.291 1.00 4.51 H new ATOM 0 HA SER A 102 -7.810 -2.263 11.768 1.00 13.42 H new ATOM 0 HB2 SER A 102 -5.466 -1.944 12.665 1.00 10.14 H new ATOM 0 HB3 SER A 102 -5.462 -0.331 11.980 1.00 10.14 H new ATOM 0 HG SER A 102 -6.115 -0.338 14.206 1.00 72.04 H new ATOM 1507 N ALA A 103 -7.215 0.500 10.044 1.00 33.33 N ATOM 1508 CA ALA A 103 -7.848 1.688 9.484 1.00 43.14 C ATOM 1509 C ALA A 103 -9.136 1.331 8.750 1.00 4.35 C ATOM 1510 O ALA A 103 -10.170 1.973 8.941 1.00 21.35 O ATOM 1511 CB ALA A 103 -6.887 2.405 8.547 1.00 22.11 C ATOM 0 H ALA A 103 -6.230 0.393 9.803 1.00 33.33 H new ATOM 0 HA ALA A 103 -8.103 2.355 10.307 1.00 43.14 H new ATOM 0 HB1 ALA A 103 -7.372 3.290 8.136 1.00 22.11 H new ATOM 0 HB2 ALA A 103 -5.995 2.703 9.099 1.00 22.11 H new ATOM 0 HB3 ALA A 103 -6.604 1.736 7.734 1.00 22.11 H new ATOM 1517 N LEU A 104 -9.068 0.305 7.910 1.00 25.15 N ATOM 1518 CA LEU A 104 -10.229 -0.139 7.147 1.00 10.32 C ATOM 1519 C LEU A 104 -11.251 -0.817 8.054 1.00 4.33 C ATOM 1520 O LEU A 104 -12.439 -0.868 7.738 1.00 20.13 O ATOM 1521 CB LEU A 104 -9.798 -1.098 6.036 1.00 13.03 C ATOM 1522 CG LEU A 104 -9.949 -2.589 6.342 1.00 23.21 C ATOM 1523 CD1 LEU A 104 -11.374 -3.048 6.075 1.00 2.04 C ATOM 1524 CD2 LEU A 104 -8.961 -3.403 5.520 1.00 62.33 C ATOM 0 H LEU A 104 -8.220 -0.236 7.740 1.00 25.15 H new ATOM 0 HA LEU A 104 -10.696 0.738 6.699 1.00 10.32 H new ATOM 0 HB2 LEU A 104 -10.378 -0.870 5.141 1.00 13.03 H new ATOM 0 HB3 LEU A 104 -8.753 -0.900 5.798 1.00 13.03 H new ATOM 0 HG LEU A 104 -9.731 -2.748 7.398 1.00 23.21 H new ATOM 0 HD11 LEU A 104 -11.462 -4.111 6.298 1.00 2.04 H new ATOM 0 HD12 LEU A 104 -12.062 -2.486 6.707 1.00 2.04 H new ATOM 0 HD13 LEU A 104 -11.621 -2.876 5.028 1.00 2.04 H new ATOM 0 HD21 LEU A 104 -9.082 -4.462 5.750 1.00 62.33 H new ATOM 0 HD22 LEU A 104 -9.148 -3.238 4.459 1.00 62.33 H new ATOM 0 HD23 LEU A 104 -7.944 -3.093 5.762 1.00 62.33 H new ATOM 1536 N MET A 105 -10.778 -1.337 9.183 1.00 14.42 N ATOM 1537 CA MET A 105 -11.652 -2.009 10.137 1.00 2.11 C ATOM 1538 C MET A 105 -12.328 -1.001 11.060 1.00 12.43 C ATOM 1539 O MET A 105 -13.421 -1.247 11.570 1.00 35.12 O ATOM 1540 CB MET A 105 -10.856 -3.020 10.964 1.00 24.43 C ATOM 1541 CG MET A 105 -10.817 -4.411 10.351 1.00 3.32 C ATOM 1542 SD MET A 105 -11.588 -5.655 11.403 1.00 30.55 S ATOM 1543 CE MET A 105 -13.290 -5.555 10.854 1.00 41.22 C ATOM 0 H MET A 105 -9.796 -1.306 9.458 1.00 14.42 H new ATOM 0 HA MET A 105 -12.424 -2.535 9.576 1.00 2.11 H new ATOM 0 HB2 MET A 105 -9.836 -2.656 11.084 1.00 24.43 H new ATOM 0 HB3 MET A 105 -11.291 -3.084 11.962 1.00 24.43 H new ATOM 0 HG2 MET A 105 -11.323 -4.393 9.386 1.00 3.32 H new ATOM 0 HG3 MET A 105 -9.781 -4.692 10.162 1.00 3.32 H new ATOM 0 HE1 MET A 105 -13.895 -6.268 11.414 1.00 41.22 H new ATOM 0 HE2 MET A 105 -13.668 -4.547 11.023 1.00 41.22 H new ATOM 0 HE3 MET A 105 -13.344 -5.789 9.791 1.00 41.22 H new ATOM 1553 N ARG A 106 -11.672 0.136 11.270 1.00 43.54 N ATOM 1554 CA ARG A 106 -12.210 1.181 12.133 1.00 42.53 C ATOM 1555 C ARG A 106 -13.262 2.006 11.396 1.00 60.53 C ATOM 1556 O ARG A 106 -14.095 2.663 12.017 1.00 55.54 O ATOM 1557 CB ARG A 106 -11.087 2.093 12.626 1.00 3.33 C ATOM 1558 CG ARG A 106 -10.201 1.452 13.683 1.00 33.31 C ATOM 1559 CD ARG A 106 -9.091 2.391 14.124 1.00 32.32 C ATOM 1560 NE ARG A 106 -9.514 3.266 15.215 1.00 42.12 N ATOM 1561 CZ ARG A 106 -10.136 4.425 15.028 1.00 42.25 C ATOM 1562 NH1 ARG A 106 -10.407 4.846 13.800 1.00 63.54 N ATOM 1563 NH2 ARG A 106 -10.490 5.165 16.071 1.00 44.31 N ATOM 0 H ARG A 106 -10.767 0.357 10.854 1.00 43.54 H new ATOM 0 HA ARG A 106 -12.683 0.702 12.990 1.00 42.53 H new ATOM 0 HB2 ARG A 106 -10.470 2.387 11.777 1.00 3.33 H new ATOM 0 HB3 ARG A 106 -11.523 3.005 13.034 1.00 3.33 H new ATOM 0 HG2 ARG A 106 -10.806 1.172 14.545 1.00 33.31 H new ATOM 0 HG3 ARG A 106 -9.767 0.534 13.287 1.00 33.31 H new ATOM 0 HD2 ARG A 106 -8.227 1.807 14.442 1.00 32.32 H new ATOM 0 HD3 ARG A 106 -8.771 2.997 13.276 1.00 32.32 H new ATOM 0 HE ARG A 106 -9.321 2.971 16.172 1.00 42.12 H new ATOM 0 HH11 ARG A 106 -10.138 4.280 12.996 1.00 63.54 H new ATOM 0 HH12 ARG A 106 -10.885 5.736 13.660 1.00 63.54 H new ATOM 0 HH21 ARG A 106 -10.285 4.844 17.017 1.00 44.31 H new ATOM 0 HH22 ARG A 106 -10.967 6.055 15.927 1.00 44.31 H new ATOM 1577 N GLY A 107 -13.216 1.965 10.067 1.00 22.52 N ATOM 1578 CA GLY A 107 -14.169 2.712 9.269 1.00 11.21 C ATOM 1579 C GLY A 107 -13.535 3.899 8.570 1.00 51.43 C ATOM 1580 O GLY A 107 -14.183 4.926 8.363 1.00 53.35 O ATOM 0 H GLY A 107 -12.535 1.428 9.530 1.00 22.52 H new ATOM 0 HA2 GLY A 107 -14.613 2.051 8.525 1.00 11.21 H new ATOM 0 HA3 GLY A 107 -14.979 3.061 9.909 1.00 11.21 H new ATOM 1584 N LEU A 108 -12.265 3.761 8.208 1.00 42.21 N ATOM 1585 CA LEU A 108 -11.541 4.831 7.529 1.00 13.33 C ATOM 1586 C LEU A 108 -11.411 4.540 6.038 1.00 44.52 C ATOM 1587 O LEU A 108 -11.693 5.398 5.200 1.00 74.34 O ATOM 1588 CB LEU A 108 -10.154 5.009 8.149 1.00 32.25 C ATOM 1589 CG LEU A 108 -10.121 5.250 9.659 1.00 2.14 C ATOM 1590 CD1 LEU A 108 -8.688 5.234 10.170 1.00 41.02 C ATOM 1591 CD2 LEU A 108 -10.797 6.568 10.004 1.00 4.14 C ATOM 0 H LEU A 108 -11.714 2.918 8.373 1.00 42.21 H new ATOM 0 HA LEU A 108 -12.108 5.754 7.652 1.00 13.33 H new ATOM 0 HB2 LEU A 108 -9.563 4.120 7.930 1.00 32.25 H new ATOM 0 HB3 LEU A 108 -9.662 5.848 7.656 1.00 32.25 H new ATOM 0 HG LEU A 108 -10.669 4.445 10.148 1.00 2.14 H new ATOM 0 HD11 LEU A 108 -8.684 5.407 11.246 1.00 41.02 H new ATOM 0 HD12 LEU A 108 -8.236 4.265 9.956 1.00 41.02 H new ATOM 0 HD13 LEU A 108 -8.116 6.018 9.674 1.00 41.02 H new ATOM 0 HD21 LEU A 108 -10.764 6.723 11.082 1.00 4.14 H new ATOM 0 HD22 LEU A 108 -10.277 7.385 9.504 1.00 4.14 H new ATOM 0 HD23 LEU A 108 -11.835 6.542 9.673 1.00 4.14 H new ATOM 1603 N LEU A 109 -10.983 3.325 5.712 1.00 12.34 N ATOM 1604 CA LEU A 109 -10.817 2.920 4.322 1.00 72.23 C ATOM 1605 C LEU A 109 -12.082 2.248 3.796 1.00 51.05 C ATOM 1606 O LEU A 109 -13.124 2.267 4.450 1.00 4.35 O ATOM 1607 CB LEU A 109 -9.627 1.969 4.186 1.00 70.44 C ATOM 1608 CG LEU A 109 -8.311 2.448 4.799 1.00 51.24 C ATOM 1609 CD1 LEU A 109 -7.288 1.323 4.814 1.00 2.31 C ATOM 1610 CD2 LEU A 109 -7.773 3.649 4.034 1.00 54.40 C ATOM 0 H LEU A 109 -10.745 2.603 6.392 1.00 12.34 H new ATOM 0 HA LEU A 109 -10.629 3.815 3.729 1.00 72.23 H new ATOM 0 HB2 LEU A 109 -9.894 1.017 4.646 1.00 70.44 H new ATOM 0 HB3 LEU A 109 -9.462 1.775 3.126 1.00 70.44 H new ATOM 0 HG LEU A 109 -8.501 2.752 5.828 1.00 51.24 H new ATOM 0 HD11 LEU A 109 -6.358 1.683 5.254 1.00 2.31 H new ATOM 0 HD12 LEU A 109 -7.671 0.491 5.405 1.00 2.31 H new ATOM 0 HD13 LEU A 109 -7.101 0.988 3.794 1.00 2.31 H new ATOM 0 HD21 LEU A 109 -6.836 3.977 4.484 1.00 54.40 H new ATOM 0 HD22 LEU A 109 -7.599 3.370 2.995 1.00 54.40 H new ATOM 0 HD23 LEU A 109 -8.499 4.461 4.075 1.00 54.40 H new ATOM 1622 N GLU A 110 -11.982 1.653 2.611 1.00 44.43 N ATOM 1623 CA GLU A 110 -13.118 0.974 1.999 1.00 23.20 C ATOM 1624 C GLU A 110 -12.680 0.182 0.770 1.00 54.53 C ATOM 1625 O GLU A 110 -12.395 0.755 -0.283 1.00 12.12 O ATOM 1626 CB GLU A 110 -14.195 1.987 1.609 1.00 15.44 C ATOM 1627 CG GLU A 110 -15.589 1.388 1.516 1.00 4.32 C ATOM 1628 CD GLU A 110 -16.595 2.110 2.392 1.00 4.15 C ATOM 1629 OE1 GLU A 110 -16.182 2.680 3.425 1.00 65.12 O ATOM 1630 OE2 GLU A 110 -17.794 2.105 2.046 1.00 32.12 O ATOM 0 H GLU A 110 -11.126 1.628 2.056 1.00 44.43 H new ATOM 0 HA GLU A 110 -13.531 0.279 2.730 1.00 23.20 H new ATOM 0 HB2 GLU A 110 -14.204 2.795 2.341 1.00 15.44 H new ATOM 0 HB3 GLU A 110 -13.934 2.430 0.648 1.00 15.44 H new ATOM 0 HG2 GLU A 110 -15.926 1.421 0.480 1.00 4.32 H new ATOM 0 HG3 GLU A 110 -15.549 0.338 1.805 1.00 4.32 H new ATOM 1637 N LEU A 111 -12.629 -1.137 0.911 1.00 21.13 N ATOM 1638 CA LEU A 111 -12.226 -2.010 -0.186 1.00 54.12 C ATOM 1639 C LEU A 111 -13.347 -2.147 -1.212 1.00 52.23 C ATOM 1640 O LEU A 111 -14.339 -2.836 -0.975 1.00 60.43 O ATOM 1641 CB LEU A 111 -11.838 -3.390 0.349 1.00 43.54 C ATOM 1642 CG LEU A 111 -11.287 -4.378 -0.681 1.00 14.40 C ATOM 1643 CD1 LEU A 111 -9.800 -4.148 -0.900 1.00 0.51 C ATOM 1644 CD2 LEU A 111 -11.547 -5.810 -0.237 1.00 14.21 C ATOM 0 H LEU A 111 -12.862 -1.627 1.775 1.00 21.13 H new ATOM 0 HA LEU A 111 -11.362 -1.561 -0.676 1.00 54.12 H new ATOM 0 HB2 LEU A 111 -11.091 -3.257 1.132 1.00 43.54 H new ATOM 0 HB3 LEU A 111 -12.715 -3.836 0.818 1.00 43.54 H new ATOM 0 HG LEU A 111 -11.802 -4.212 -1.627 1.00 14.40 H new ATOM 0 HD11 LEU A 111 -9.426 -4.860 -1.636 1.00 0.51 H new ATOM 0 HD12 LEU A 111 -9.638 -3.133 -1.263 1.00 0.51 H new ATOM 0 HD13 LEU A 111 -9.268 -4.286 0.041 1.00 0.51 H new ATOM 0 HD21 LEU A 111 -11.149 -6.500 -0.981 1.00 14.21 H new ATOM 0 HD22 LEU A 111 -11.059 -5.988 0.721 1.00 14.21 H new ATOM 0 HD23 LEU A 111 -12.620 -5.969 -0.132 1.00 14.21 H new ATOM 1656 N LYS A 112 -13.181 -1.487 -2.353 1.00 52.14 N ATOM 1657 CA LYS A 112 -14.176 -1.537 -3.419 1.00 30.43 C ATOM 1658 C LYS A 112 -14.169 -2.899 -4.106 1.00 0.11 C ATOM 1659 O LYS A 112 -15.218 -3.512 -4.305 1.00 42.44 O ATOM 1660 CB LYS A 112 -13.911 -0.434 -4.446 1.00 22.23 C ATOM 1661 CG LYS A 112 -14.664 0.854 -4.163 1.00 32.31 C ATOM 1662 CD LYS A 112 -15.405 1.347 -5.394 1.00 35.31 C ATOM 1663 CE LYS A 112 -14.452 1.941 -6.419 1.00 4.13 C ATOM 1664 NZ LYS A 112 -15.173 2.466 -7.610 1.00 54.00 N ATOM 0 H LYS A 112 -12.366 -0.911 -2.564 1.00 52.14 H new ATOM 0 HA LYS A 112 -15.158 -1.380 -2.973 1.00 30.43 H new ATOM 0 HB2 LYS A 112 -12.842 -0.222 -4.471 1.00 22.23 H new ATOM 0 HB3 LYS A 112 -14.188 -0.797 -5.436 1.00 22.23 H new ATOM 0 HG2 LYS A 112 -15.373 0.692 -3.351 1.00 32.31 H new ATOM 0 HG3 LYS A 112 -13.964 1.619 -3.827 1.00 32.31 H new ATOM 0 HD2 LYS A 112 -15.955 0.521 -5.844 1.00 35.31 H new ATOM 0 HD3 LYS A 112 -16.140 2.097 -5.101 1.00 35.31 H new ATOM 0 HE2 LYS A 112 -13.879 2.746 -5.958 1.00 4.13 H new ATOM 0 HE3 LYS A 112 -13.737 1.180 -6.734 1.00 4.13 H new ATOM 0 HZ1 LYS A 112 -14.487 2.862 -8.284 1.00 54.00 H new ATOM 0 HZ2 LYS A 112 -15.700 1.693 -8.065 1.00 54.00 H new ATOM 0 HZ3 LYS A 112 -15.837 3.210 -7.314 1.00 54.00 H new ATOM 1678 N LYS A 113 -12.979 -3.369 -4.466 1.00 52.31 N ATOM 1679 CA LYS A 113 -12.834 -4.659 -5.130 1.00 0.35 C ATOM 1680 C LYS A 113 -12.785 -5.792 -4.110 1.00 30.53 C ATOM 1681 O LYS A 113 -12.959 -5.570 -2.912 1.00 22.30 O ATOM 1682 CB LYS A 113 -11.567 -4.675 -5.987 1.00 11.24 C ATOM 1683 CG LYS A 113 -11.843 -4.729 -7.479 1.00 54.40 C ATOM 1684 CD LYS A 113 -12.007 -3.336 -8.067 1.00 21.44 C ATOM 1685 CE LYS A 113 -13.421 -2.812 -7.872 1.00 12.33 C ATOM 1686 NZ LYS A 113 -13.699 -1.632 -8.736 1.00 34.11 N ATOM 0 H LYS A 113 -12.101 -2.875 -4.309 1.00 52.31 H new ATOM 0 HA LYS A 113 -13.701 -4.809 -5.773 1.00 0.35 H new ATOM 0 HB2 LYS A 113 -10.978 -3.784 -5.767 1.00 11.24 H new ATOM 0 HB3 LYS A 113 -10.960 -5.536 -5.707 1.00 11.24 H new ATOM 0 HG2 LYS A 113 -11.025 -5.244 -7.983 1.00 54.40 H new ATOM 0 HG3 LYS A 113 -12.746 -5.311 -7.662 1.00 54.40 H new ATOM 0 HD2 LYS A 113 -11.297 -2.655 -7.596 1.00 21.44 H new ATOM 0 HD3 LYS A 113 -11.770 -3.359 -9.131 1.00 21.44 H new ATOM 0 HE2 LYS A 113 -14.136 -3.603 -8.097 1.00 12.33 H new ATOM 0 HE3 LYS A 113 -13.566 -2.539 -6.827 1.00 12.33 H new ATOM 0 HZ1 LYS A 113 -14.673 -1.305 -8.574 1.00 34.11 H new ATOM 0 HZ2 LYS A 113 -13.033 -0.867 -8.504 1.00 34.11 H new ATOM 0 HZ3 LYS A 113 -13.585 -1.899 -9.735 1.00 34.11 H new ATOM 1700 N GLY A 114 -12.545 -7.008 -4.592 1.00 42.10 N ATOM 1701 CA GLY A 114 -12.475 -8.157 -3.709 1.00 43.43 C ATOM 1702 C GLY A 114 -13.434 -8.047 -2.539 1.00 62.44 C ATOM 1703 O GLY A 114 -14.586 -7.646 -2.706 1.00 30.12 O ATOM 0 H GLY A 114 -12.398 -7.217 -5.579 1.00 42.10 H new ATOM 0 HA2 GLY A 114 -12.699 -9.061 -4.275 1.00 43.43 H new ATOM 0 HA3 GLY A 114 -11.457 -8.261 -3.333 1.00 43.43 H new ATOM 1707 N THR A 115 -12.959 -8.409 -1.351 1.00 51.21 N ATOM 1708 CA THR A 115 -13.782 -8.352 -0.150 1.00 52.32 C ATOM 1709 C THR A 115 -12.926 -8.437 1.107 1.00 30.15 C ATOM 1710 O THR A 115 -11.852 -9.041 1.099 1.00 41.41 O ATOM 1711 CB THR A 115 -14.821 -9.489 -0.128 1.00 12.42 C ATOM 1712 OG1 THR A 115 -15.756 -9.278 0.936 1.00 11.35 O ATOM 1713 CG2 THR A 115 -14.143 -10.839 0.047 1.00 21.04 C ATOM 0 H THR A 115 -12.008 -8.745 -1.195 1.00 51.21 H new ATOM 0 HA THR A 115 -14.302 -7.394 -0.168 1.00 52.32 H new ATOM 0 HB THR A 115 -15.349 -9.486 -1.081 1.00 12.42 H new ATOM 0 HG1 THR A 115 -16.414 -10.004 0.942 1.00 11.35 H new ATOM 0 HG21 THR A 115 -14.897 -11.626 0.060 1.00 21.04 H new ATOM 0 HG22 THR A 115 -13.454 -11.010 -0.780 1.00 21.04 H new ATOM 0 HG23 THR A 115 -13.591 -10.850 0.987 1.00 21.04 H new ATOM 1721 N ILE A 116 -13.407 -7.831 2.188 1.00 2.30 N ATOM 1722 CA ILE A 116 -12.686 -7.841 3.454 1.00 62.11 C ATOM 1723 C ILE A 116 -12.520 -9.261 3.982 1.00 21.51 C ATOM 1724 O ILE A 116 -11.524 -9.582 4.630 1.00 23.25 O ATOM 1725 CB ILE A 116 -13.405 -6.991 4.518 1.00 1.02 C ATOM 1726 CG1 ILE A 116 -12.508 -6.802 5.743 1.00 24.32 C ATOM 1727 CG2 ILE A 116 -14.722 -7.642 4.915 1.00 2.03 C ATOM 1728 CD1 ILE A 116 -13.068 -5.832 6.759 1.00 1.42 C ATOM 0 H ILE A 116 -14.293 -7.327 2.212 1.00 2.30 H new ATOM 0 HA ILE A 116 -11.703 -7.411 3.260 1.00 62.11 H new ATOM 0 HB ILE A 116 -13.620 -6.010 4.094 1.00 1.02 H new ATOM 0 HG12 ILE A 116 -12.354 -7.769 6.222 1.00 24.32 H new ATOM 0 HG13 ILE A 116 -11.530 -6.449 5.416 1.00 24.32 H new ATOM 0 HG21 ILE A 116 -15.218 -7.029 5.668 1.00 2.03 H new ATOM 0 HG22 ILE A 116 -15.363 -7.730 4.038 1.00 2.03 H new ATOM 0 HG23 ILE A 116 -14.529 -8.634 5.324 1.00 2.03 H new ATOM 0 HD11 ILE A 116 -12.379 -5.748 7.600 1.00 1.42 H new ATOM 0 HD12 ILE A 116 -13.196 -4.854 6.296 1.00 1.42 H new ATOM 0 HD13 ILE A 116 -14.032 -6.194 7.115 1.00 1.42 H new ATOM 1740 N ALA A 117 -13.502 -10.111 3.697 1.00 0.23 N ATOM 1741 CA ALA A 117 -13.463 -11.500 4.139 1.00 11.13 C ATOM 1742 C ALA A 117 -12.249 -12.225 3.568 1.00 2.50 C ATOM 1743 O ALA A 117 -11.933 -13.342 3.975 1.00 55.15 O ATOM 1744 CB ALA A 117 -14.744 -12.216 3.740 1.00 33.24 C ATOM 0 H ALA A 117 -14.334 -9.862 3.162 1.00 0.23 H new ATOM 0 HA ALA A 117 -13.379 -11.507 5.226 1.00 11.13 H new ATOM 0 HB1 ALA A 117 -14.702 -13.252 4.076 1.00 33.24 H new ATOM 0 HB2 ALA A 117 -15.597 -11.719 4.202 1.00 33.24 H new ATOM 0 HB3 ALA A 117 -14.852 -12.190 2.656 1.00 33.24 H new ATOM 1750 N ALA A 118 -11.572 -11.580 2.622 1.00 20.14 N ATOM 1751 CA ALA A 118 -10.392 -12.163 1.996 1.00 74.42 C ATOM 1752 C ALA A 118 -9.119 -11.730 2.715 1.00 45.42 C ATOM 1753 O ALA A 118 -8.025 -12.197 2.395 1.00 4.13 O ATOM 1754 CB ALA A 118 -10.329 -11.776 0.526 1.00 72.12 C ATOM 0 H ALA A 118 -11.821 -10.654 2.273 1.00 20.14 H new ATOM 0 HA ALA A 118 -10.469 -13.248 2.071 1.00 74.42 H new ATOM 0 HB1 ALA A 118 -9.443 -12.218 0.071 1.00 72.12 H new ATOM 0 HB2 ALA A 118 -11.220 -12.141 0.015 1.00 72.12 H new ATOM 0 HB3 ALA A 118 -10.279 -10.691 0.437 1.00 72.12 H new ATOM 1760 N LEU A 119 -9.268 -10.835 3.684 1.00 3.13 N ATOM 1761 CA LEU A 119 -8.129 -10.338 4.449 1.00 51.32 C ATOM 1762 C LEU A 119 -8.019 -11.053 5.791 1.00 62.45 C ATOM 1763 O LEU A 119 -7.092 -10.807 6.562 1.00 33.01 O ATOM 1764 CB LEU A 119 -8.258 -8.829 4.672 1.00 73.45 C ATOM 1765 CG LEU A 119 -8.529 -7.988 3.424 1.00 0.42 C ATOM 1766 CD1 LEU A 119 -8.960 -6.581 3.813 1.00 61.42 C ATOM 1767 CD2 LEU A 119 -7.296 -7.943 2.533 1.00 15.03 C ATOM 0 H LEU A 119 -10.166 -10.438 3.959 1.00 3.13 H new ATOM 0 HA LEU A 119 -7.224 -10.539 3.876 1.00 51.32 H new ATOM 0 HB2 LEU A 119 -9.063 -8.655 5.385 1.00 73.45 H new ATOM 0 HB3 LEU A 119 -7.339 -8.470 5.135 1.00 73.45 H new ATOM 0 HG LEU A 119 -9.340 -8.453 2.864 1.00 0.42 H new ATOM 0 HD11 LEU A 119 -9.149 -5.996 2.913 1.00 61.42 H new ATOM 0 HD12 LEU A 119 -9.870 -6.631 4.410 1.00 61.42 H new ATOM 0 HD13 LEU A 119 -8.170 -6.106 4.395 1.00 61.42 H new ATOM 0 HD21 LEU A 119 -7.507 -7.340 1.650 1.00 15.03 H new ATOM 0 HD22 LEU A 119 -6.465 -7.501 3.083 1.00 15.03 H new ATOM 0 HD23 LEU A 119 -7.031 -8.955 2.227 1.00 15.03 H new ATOM 1779 N ALA A 120 -8.969 -11.944 6.061 1.00 40.44 N ATOM 1780 CA ALA A 120 -8.975 -12.699 7.307 1.00 14.10 C ATOM 1781 C ALA A 120 -7.600 -13.289 7.599 1.00 40.11 C ATOM 1782 O ALA A 120 -6.973 -12.989 8.616 1.00 75.23 O ATOM 1783 CB ALA A 120 -10.024 -13.800 7.250 1.00 25.20 C ATOM 0 H ALA A 120 -9.743 -12.160 5.433 1.00 40.44 H new ATOM 0 HA ALA A 120 -9.226 -12.014 8.117 1.00 14.10 H new ATOM 0 HB1 ALA A 120 -10.018 -14.357 8.187 1.00 25.20 H new ATOM 0 HB2 ALA A 120 -11.008 -13.357 7.097 1.00 25.20 H new ATOM 0 HB3 ALA A 120 -9.798 -14.476 6.425 1.00 25.20 H new ATOM 1789 N PRO A 121 -7.118 -14.147 6.689 1.00 43.21 N ATOM 1790 CA PRO A 121 -5.812 -14.797 6.828 1.00 24.22 C ATOM 1791 C PRO A 121 -4.655 -13.817 6.660 1.00 75.14 C ATOM 1792 O PRO A 121 -3.636 -13.921 7.342 1.00 2.11 O ATOM 1793 CB PRO A 121 -5.807 -15.829 5.697 1.00 23.31 C ATOM 1794 CG PRO A 121 -6.749 -15.283 4.681 1.00 12.41 C ATOM 1795 CD PRO A 121 -7.811 -14.549 5.453 1.00 25.13 C ATOM 0 HA PRO A 121 -5.676 -15.230 7.819 1.00 24.22 H new ATOM 0 HB2 PRO A 121 -4.807 -15.956 5.282 1.00 23.31 H new ATOM 0 HB3 PRO A 121 -6.131 -16.807 6.052 1.00 23.31 H new ATOM 0 HG2 PRO A 121 -6.234 -14.613 3.992 1.00 12.41 H new ATOM 0 HG3 PRO A 121 -7.184 -16.083 4.083 1.00 12.41 H new ATOM 0 HD2 PRO A 121 -8.184 -13.685 4.902 1.00 25.13 H new ATOM 0 HD3 PRO A 121 -8.669 -15.188 5.663 1.00 25.13 H new ATOM 1803 N TYR A 122 -4.822 -12.866 5.747 1.00 44.40 N ATOM 1804 CA TYR A 122 -3.790 -11.867 5.488 1.00 72.33 C ATOM 1805 C TYR A 122 -4.025 -10.612 6.323 1.00 54.03 C ATOM 1806 O TYR A 122 -3.852 -9.493 5.843 1.00 40.32 O ATOM 1807 CB TYR A 122 -3.763 -11.507 4.002 1.00 64.00 C ATOM 1808 CG TYR A 122 -3.937 -12.698 3.087 1.00 41.35 C ATOM 1809 CD1 TYR A 122 -3.016 -13.738 3.084 1.00 60.24 C ATOM 1810 CD2 TYR A 122 -5.024 -12.782 2.225 1.00 24.20 C ATOM 1811 CE1 TYR A 122 -3.172 -14.827 2.249 1.00 64.35 C ATOM 1812 CE2 TYR A 122 -5.188 -13.868 1.387 1.00 32.33 C ATOM 1813 CZ TYR A 122 -4.259 -14.888 1.402 1.00 14.14 C ATOM 1814 OH TYR A 122 -4.419 -15.972 0.570 1.00 2.20 O ATOM 0 H TYR A 122 -5.660 -12.766 5.175 1.00 44.40 H new ATOM 0 HA TYR A 122 -2.827 -12.293 5.770 1.00 72.33 H new ATOM 0 HB2 TYR A 122 -4.553 -10.784 3.798 1.00 64.00 H new ATOM 0 HB3 TYR A 122 -2.816 -11.018 3.772 1.00 64.00 H new ATOM 0 HD1 TYR A 122 -2.164 -13.694 3.746 1.00 60.24 H new ATOM 0 HD2 TYR A 122 -5.753 -11.985 2.210 1.00 24.20 H new ATOM 0 HE1 TYR A 122 -2.446 -15.627 2.259 1.00 64.35 H new ATOM 0 HE2 TYR A 122 -6.039 -13.918 0.724 1.00 32.33 H new ATOM 0 HH TYR A 122 -3.548 -16.392 0.409 1.00 2.20 H new ATOM 1824 N ALA A 123 -4.420 -10.809 7.577 1.00 42.15 N ATOM 1825 CA ALA A 123 -4.676 -9.694 8.480 1.00 21.32 C ATOM 1826 C ALA A 123 -3.384 -9.196 9.118 1.00 1.44 C ATOM 1827 O ALA A 123 -3.120 -7.994 9.150 1.00 54.30 O ATOM 1828 CB ALA A 123 -5.672 -10.104 9.555 1.00 74.23 C ATOM 0 H ALA A 123 -4.569 -11.730 7.990 1.00 42.15 H new ATOM 0 HA ALA A 123 -5.101 -8.877 7.897 1.00 21.32 H new ATOM 0 HB1 ALA A 123 -5.854 -9.262 10.223 1.00 74.23 H new ATOM 0 HB2 ALA A 123 -6.609 -10.405 9.087 1.00 74.23 H new ATOM 0 HB3 ALA A 123 -5.267 -10.939 10.127 1.00 74.23 H new ATOM 1834 N GLN A 124 -2.582 -10.127 9.625 1.00 64.33 N ATOM 1835 CA GLN A 124 -1.317 -9.781 10.262 1.00 10.50 C ATOM 1836 C GLN A 124 -0.248 -9.471 9.219 1.00 52.41 C ATOM 1837 O GLN A 124 0.518 -8.519 9.365 1.00 11.31 O ATOM 1838 CB GLN A 124 -0.848 -10.922 11.167 1.00 50.54 C ATOM 1839 CG GLN A 124 -1.596 -10.997 12.488 1.00 52.13 C ATOM 1840 CD GLN A 124 -2.294 -12.329 12.688 1.00 11.31 C ATOM 1841 OE1 GLN A 124 -3.402 -12.542 12.195 1.00 21.03 O ATOM 1842 NE2 GLN A 124 -1.647 -13.232 13.414 1.00 34.01 N ATOM 0 H GLN A 124 -2.786 -11.126 9.607 1.00 64.33 H new ATOM 0 HA GLN A 124 -1.477 -8.889 10.867 1.00 10.50 H new ATOM 0 HB2 GLN A 124 -0.967 -11.867 10.637 1.00 50.54 H new ATOM 0 HB3 GLN A 124 0.216 -10.801 11.368 1.00 50.54 H new ATOM 0 HG2 GLN A 124 -0.897 -10.831 13.307 1.00 52.13 H new ATOM 0 HG3 GLN A 124 -2.333 -10.195 12.530 1.00 52.13 H new ATOM 0 HE21 GLN A 124 -0.730 -13.012 13.803 1.00 34.01 H new ATOM 0 HE22 GLN A 124 -2.066 -14.146 13.583 1.00 34.01 H new ATOM 1851 N ALA A 125 -0.203 -10.281 8.167 1.00 70.04 N ATOM 1852 CA ALA A 125 0.771 -10.093 7.099 1.00 54.41 C ATOM 1853 C ALA A 125 0.991 -8.611 6.812 1.00 73.31 C ATOM 1854 O ALA A 125 2.117 -8.177 6.567 1.00 54.31 O ATOM 1855 CB ALA A 125 0.319 -10.815 5.838 1.00 14.21 C ATOM 0 H ALA A 125 -0.830 -11.074 8.031 1.00 70.04 H new ATOM 0 HA ALA A 125 1.719 -10.518 7.427 1.00 54.41 H new ATOM 0 HB1 ALA A 125 1.056 -10.666 5.049 1.00 14.21 H new ATOM 0 HB2 ALA A 125 0.220 -11.881 6.045 1.00 14.21 H new ATOM 0 HB3 ALA A 125 -0.643 -10.417 5.516 1.00 14.21 H new ATOM 1861 N ALA A 126 -0.091 -7.840 6.843 1.00 42.34 N ATOM 1862 CA ALA A 126 -0.015 -6.407 6.587 1.00 74.41 C ATOM 1863 C ALA A 126 1.099 -5.762 7.404 1.00 44.53 C ATOM 1864 O ALA A 126 1.961 -5.073 6.859 1.00 54.42 O ATOM 1865 CB ALA A 126 -1.350 -5.745 6.896 1.00 10.40 C ATOM 0 H ALA A 126 -1.030 -8.184 7.043 1.00 42.34 H new ATOM 0 HA ALA A 126 0.214 -6.263 5.531 1.00 74.41 H new ATOM 0 HB1 ALA A 126 -1.279 -4.675 6.701 1.00 10.40 H new ATOM 0 HB2 ALA A 126 -2.126 -6.179 6.265 1.00 10.40 H new ATOM 0 HB3 ALA A 126 -1.602 -5.906 7.944 1.00 10.40 H new ATOM 1871 N GLN A 127 1.075 -5.991 8.713 1.00 3.44 N ATOM 1872 CA GLN A 127 2.084 -5.429 9.604 1.00 23.21 C ATOM 1873 C GLN A 127 3.459 -5.439 8.945 1.00 22.33 C ATOM 1874 O GLN A 127 4.248 -4.511 9.117 1.00 13.13 O ATOM 1875 CB GLN A 127 2.128 -6.213 10.916 1.00 25.04 C ATOM 1876 CG GLN A 127 0.799 -6.241 11.654 1.00 11.22 C ATOM 1877 CD GLN A 127 0.924 -6.794 13.060 1.00 14.52 C ATOM 1878 OE1 GLN A 127 1.220 -7.973 13.252 1.00 74.01 O ATOM 1879 NE2 GLN A 127 0.698 -5.941 14.054 1.00 75.33 N ATOM 0 H GLN A 127 0.369 -6.561 9.180 1.00 3.44 H new ATOM 0 HA GLN A 127 1.811 -4.395 9.815 1.00 23.21 H new ATOM 0 HB2 GLN A 127 2.440 -7.236 10.708 1.00 25.04 H new ATOM 0 HB3 GLN A 127 2.886 -5.775 11.566 1.00 25.04 H new ATOM 0 HG2 GLN A 127 0.392 -5.231 11.700 1.00 11.22 H new ATOM 0 HG3 GLN A 127 0.088 -6.846 11.091 1.00 11.22 H new ATOM 0 HE21 GLN A 127 0.455 -4.972 13.849 1.00 75.33 H new ATOM 0 HE22 GLN A 127 0.767 -6.256 15.022 1.00 75.33 H new ATOM 1888 N GLU A 128 3.741 -6.497 8.190 1.00 55.21 N ATOM 1889 CA GLU A 128 5.021 -6.629 7.506 1.00 3.32 C ATOM 1890 C GLU A 128 5.153 -5.592 6.394 1.00 42.12 C ATOM 1891 O GLU A 128 6.035 -4.733 6.432 1.00 31.22 O ATOM 1892 CB GLU A 128 5.174 -8.036 6.928 1.00 61.25 C ATOM 1893 CG GLU A 128 5.002 -9.140 7.957 1.00 20.51 C ATOM 1894 CD GLU A 128 5.945 -8.990 9.136 1.00 53.33 C ATOM 1895 OE1 GLU A 128 7.133 -8.681 8.911 1.00 2.41 O ATOM 1896 OE2 GLU A 128 5.492 -9.181 10.284 1.00 10.32 O ATOM 0 H GLU A 128 3.099 -7.275 8.037 1.00 55.21 H new ATOM 0 HA GLU A 128 5.813 -6.457 8.235 1.00 3.32 H new ATOM 0 HB2 GLU A 128 4.441 -8.175 6.133 1.00 61.25 H new ATOM 0 HB3 GLU A 128 6.160 -8.127 6.472 1.00 61.25 H new ATOM 0 HG2 GLU A 128 3.973 -9.139 8.317 1.00 20.51 H new ATOM 0 HG3 GLU A 128 5.172 -10.105 7.481 1.00 20.51 H new ATOM 1903 N LEU A 129 4.271 -5.679 5.405 1.00 51.03 N ATOM 1904 CA LEU A 129 4.287 -4.750 4.281 1.00 44.35 C ATOM 1905 C LEU A 129 4.660 -3.344 4.742 1.00 75.55 C ATOM 1906 O LEU A 129 5.415 -2.639 4.072 1.00 14.50 O ATOM 1907 CB LEU A 129 2.922 -4.728 3.591 1.00 44.03 C ATOM 1908 CG LEU A 129 2.537 -5.995 2.827 1.00 34.00 C ATOM 1909 CD1 LEU A 129 1.028 -6.193 2.849 1.00 5.52 C ATOM 1910 CD2 LEU A 129 3.048 -5.932 1.396 1.00 54.02 C ATOM 0 H LEU A 129 3.535 -6.384 5.359 1.00 51.03 H new ATOM 0 HA LEU A 129 5.040 -5.091 3.571 1.00 44.35 H new ATOM 0 HB2 LEU A 129 2.159 -4.536 4.345 1.00 44.03 H new ATOM 0 HB3 LEU A 129 2.902 -3.888 2.896 1.00 44.03 H new ATOM 0 HG LEU A 129 3.003 -6.849 3.319 1.00 34.00 H new ATOM 0 HD11 LEU A 129 0.772 -7.099 2.300 1.00 5.52 H new ATOM 0 HD12 LEU A 129 0.688 -6.285 3.881 1.00 5.52 H new ATOM 0 HD13 LEU A 129 0.542 -5.337 2.382 1.00 5.52 H new ATOM 0 HD21 LEU A 129 2.764 -6.842 0.868 1.00 54.02 H new ATOM 0 HD22 LEU A 129 2.612 -5.069 0.892 1.00 54.02 H new ATOM 0 HD23 LEU A 129 4.134 -5.839 1.401 1.00 54.02 H new ATOM 1922 N VAL A 130 4.125 -2.943 5.891 1.00 71.52 N ATOM 1923 CA VAL A 130 4.403 -1.623 6.444 1.00 24.14 C ATOM 1924 C VAL A 130 5.873 -1.485 6.825 1.00 72.03 C ATOM 1925 O VAL A 130 6.541 -0.528 6.433 1.00 50.25 O ATOM 1926 CB VAL A 130 3.534 -1.339 7.684 1.00 2.40 C ATOM 1927 CG1 VAL A 130 3.877 0.019 8.276 1.00 3.24 C ATOM 1928 CG2 VAL A 130 2.058 -1.417 7.328 1.00 70.44 C ATOM 0 H VAL A 130 3.497 -3.513 6.457 1.00 71.52 H new ATOM 0 HA VAL A 130 4.162 -0.898 5.667 1.00 24.14 H new ATOM 0 HB VAL A 130 3.744 -2.100 8.436 1.00 2.40 H new ATOM 0 HG11 VAL A 130 3.253 0.203 9.151 1.00 3.24 H new ATOM 0 HG12 VAL A 130 4.927 0.033 8.569 1.00 3.24 H new ATOM 0 HG13 VAL A 130 3.697 0.796 7.533 1.00 3.24 H new ATOM 0 HG21 VAL A 130 1.458 -1.214 8.215 1.00 70.44 H new ATOM 0 HG22 VAL A 130 1.830 -0.679 6.559 1.00 70.44 H new ATOM 0 HG23 VAL A 130 1.826 -2.414 6.954 1.00 70.44 H new ATOM 1938 N LYS A 131 6.373 -2.448 7.591 1.00 63.34 N ATOM 1939 CA LYS A 131 7.765 -2.437 8.025 1.00 73.34 C ATOM 1940 C LYS A 131 8.691 -2.062 6.872 1.00 71.13 C ATOM 1941 O LYS A 131 9.474 -1.117 6.974 1.00 50.12 O ATOM 1942 CB LYS A 131 8.158 -3.807 8.583 1.00 71.32 C ATOM 1943 CG LYS A 131 9.651 -3.964 8.814 1.00 31.22 C ATOM 1944 CD LYS A 131 10.111 -3.185 10.035 1.00 72.44 C ATOM 1945 CE LYS A 131 11.619 -2.985 10.032 1.00 15.43 C ATOM 1946 NZ LYS A 131 11.993 -1.590 10.396 1.00 70.25 N ATOM 0 H LYS A 131 5.834 -3.247 7.925 1.00 63.34 H new ATOM 0 HA LYS A 131 7.869 -1.688 8.810 1.00 73.34 H new ATOM 0 HB2 LYS A 131 7.634 -3.970 9.525 1.00 71.32 H new ATOM 0 HB3 LYS A 131 7.822 -4.581 7.893 1.00 71.32 H new ATOM 0 HG2 LYS A 131 9.891 -5.019 8.943 1.00 31.22 H new ATOM 0 HG3 LYS A 131 10.195 -3.618 7.935 1.00 31.22 H new ATOM 0 HD2 LYS A 131 9.614 -2.215 10.058 1.00 72.44 H new ATOM 0 HD3 LYS A 131 9.815 -3.716 10.940 1.00 72.44 H new ATOM 0 HE2 LYS A 131 12.079 -3.680 10.735 1.00 15.43 H new ATOM 0 HE3 LYS A 131 12.015 -3.222 9.044 1.00 15.43 H new ATOM 0 HZ1 LYS A 131 13.028 -1.494 10.383 1.00 70.25 H new ATOM 0 HZ2 LYS A 131 11.575 -0.929 9.711 1.00 70.25 H new ATOM 0 HZ3 LYS A 131 11.637 -1.373 11.349 1.00 70.25 H new ATOM 1960 N VAL A 132 8.596 -2.807 5.775 1.00 52.21 N ATOM 1961 CA VAL A 132 9.423 -2.550 4.602 1.00 1.13 C ATOM 1962 C VAL A 132 9.081 -1.205 3.973 1.00 44.45 C ATOM 1963 O VAL A 132 9.950 -0.524 3.428 1.00 62.22 O ATOM 1964 CB VAL A 132 9.256 -3.656 3.544 1.00 35.40 C ATOM 1965 CG1 VAL A 132 10.076 -3.338 2.303 1.00 14.44 C ATOM 1966 CG2 VAL A 132 9.648 -5.008 4.120 1.00 33.45 C ATOM 0 H VAL A 132 7.954 -3.593 5.674 1.00 52.21 H new ATOM 0 HA VAL A 132 10.459 -2.536 4.942 1.00 1.13 H new ATOM 0 HB VAL A 132 8.206 -3.701 3.254 1.00 35.40 H new ATOM 0 HG11 VAL A 132 9.945 -4.131 1.567 1.00 14.44 H new ATOM 0 HG12 VAL A 132 9.742 -2.391 1.879 1.00 14.44 H new ATOM 0 HG13 VAL A 132 11.130 -3.264 2.572 1.00 14.44 H new ATOM 0 HG21 VAL A 132 9.524 -5.778 3.358 1.00 33.45 H new ATOM 0 HG22 VAL A 132 10.690 -4.979 4.440 1.00 33.45 H new ATOM 0 HG23 VAL A 132 9.012 -5.237 4.975 1.00 33.45 H new ATOM 1976 N ALA A 133 7.811 -0.825 4.053 1.00 55.12 N ATOM 1977 CA ALA A 133 7.353 0.441 3.493 1.00 2.33 C ATOM 1978 C ALA A 133 8.249 1.592 3.938 1.00 44.41 C ATOM 1979 O ALA A 133 8.566 2.484 3.151 1.00 3.43 O ATOM 1980 CB ALA A 133 5.910 0.707 3.897 1.00 63.23 C ATOM 0 H ALA A 133 7.079 -1.376 4.501 1.00 55.12 H new ATOM 0 HA ALA A 133 7.407 0.370 2.407 1.00 2.33 H new ATOM 0 HB1 ALA A 133 5.582 1.655 3.472 1.00 63.23 H new ATOM 0 HB2 ALA A 133 5.274 -0.097 3.525 1.00 63.23 H new ATOM 0 HB3 ALA A 133 5.839 0.753 4.984 1.00 63.23 H new ATOM 1986 N ARG A 134 8.653 1.567 5.205 1.00 73.25 N ATOM 1987 CA ARG A 134 9.511 2.609 5.753 1.00 12.53 C ATOM 1988 C ARG A 134 10.913 2.531 5.158 1.00 40.35 C ATOM 1989 O ARG A 134 11.476 3.540 4.735 1.00 13.52 O ATOM 1990 CB ARG A 134 9.586 2.489 7.276 1.00 35.24 C ATOM 1991 CG ARG A 134 8.288 2.849 7.981 1.00 33.41 C ATOM 1992 CD ARG A 134 8.471 2.914 9.489 1.00 51.23 C ATOM 1993 NE ARG A 134 7.918 4.142 10.055 1.00 33.41 N ATOM 1994 CZ ARG A 134 8.049 4.487 11.331 1.00 64.04 C ATOM 1995 NH1 ARG A 134 8.712 3.702 12.168 1.00 24.13 N ATOM 1996 NH2 ARG A 134 7.518 5.620 11.770 1.00 13.25 N ATOM 0 H ARG A 134 8.399 0.836 5.870 1.00 73.25 H new ATOM 0 HA ARG A 134 9.078 3.574 5.491 1.00 12.53 H new ATOM 0 HB2 ARG A 134 9.861 1.467 7.538 1.00 35.24 H new ATOM 0 HB3 ARG A 134 10.381 3.137 7.644 1.00 35.24 H new ATOM 0 HG2 ARG A 134 7.929 3.811 7.615 1.00 33.41 H new ATOM 0 HG3 ARG A 134 7.524 2.111 7.738 1.00 33.41 H new ATOM 0 HD2 ARG A 134 7.988 2.053 9.950 1.00 51.23 H new ATOM 0 HD3 ARG A 134 9.532 2.850 9.728 1.00 51.23 H new ATOM 0 HE ARG A 134 7.403 4.769 9.437 1.00 33.41 H new ATOM 0 HH11 ARG A 134 9.123 2.831 11.833 1.00 24.13 H new ATOM 0 HH12 ARG A 134 8.811 3.969 13.147 1.00 24.13 H new ATOM 0 HH21 ARG A 134 7.009 6.227 11.128 1.00 13.25 H new ATOM 0 HH22 ARG A 134 7.619 5.884 12.750 1.00 13.25 H new ATOM 2010 N GLU A 135 11.471 1.324 5.126 1.00 51.20 N ATOM 2011 CA GLU A 135 12.807 1.115 4.582 1.00 4.32 C ATOM 2012 C GLU A 135 13.019 1.948 3.321 1.00 13.13 C ATOM 2013 O GLU A 135 14.020 2.652 3.190 1.00 62.34 O ATOM 2014 CB GLU A 135 13.029 -0.366 4.271 1.00 31.44 C ATOM 2015 CG GLU A 135 13.376 -1.200 5.493 1.00 63.23 C ATOM 2016 CD GLU A 135 14.312 -2.347 5.169 1.00 22.33 C ATOM 2017 OE1 GLU A 135 14.087 -3.026 4.145 1.00 4.22 O ATOM 2018 OE2 GLU A 135 15.270 -2.568 5.940 1.00 64.53 O ATOM 0 H GLU A 135 11.018 0.477 5.470 1.00 51.20 H new ATOM 0 HA GLU A 135 13.530 1.434 5.333 1.00 4.32 H new ATOM 0 HB2 GLU A 135 12.128 -0.771 3.810 1.00 31.44 H new ATOM 0 HB3 GLU A 135 13.831 -0.458 3.539 1.00 31.44 H new ATOM 0 HG2 GLU A 135 13.838 -0.561 6.245 1.00 63.23 H new ATOM 0 HG3 GLU A 135 12.459 -1.596 5.930 1.00 63.23 H new ATOM 2025 N VAL A 136 12.068 1.863 2.397 1.00 73.23 N ATOM 2026 CA VAL A 136 12.147 2.608 1.146 1.00 4.55 C ATOM 2027 C VAL A 136 12.130 4.112 1.401 1.00 22.52 C ATOM 2028 O VAL A 136 13.029 4.835 0.972 1.00 22.13 O ATOM 2029 CB VAL A 136 10.988 2.246 0.201 1.00 34.40 C ATOM 2030 CG1 VAL A 136 11.175 2.911 -1.154 1.00 50.14 C ATOM 2031 CG2 VAL A 136 10.874 0.736 0.052 1.00 52.41 C ATOM 0 H VAL A 136 11.233 1.285 2.491 1.00 73.23 H new ATOM 0 HA VAL A 136 13.089 2.332 0.673 1.00 4.55 H new ATOM 0 HB VAL A 136 10.059 2.617 0.635 1.00 34.40 H new ATOM 0 HG11 VAL A 136 10.345 2.643 -1.808 1.00 50.14 H new ATOM 0 HG12 VAL A 136 11.202 3.993 -1.027 1.00 50.14 H new ATOM 0 HG13 VAL A 136 12.111 2.574 -1.599 1.00 50.14 H new ATOM 0 HG21 VAL A 136 10.049 0.498 -0.620 1.00 52.41 H new ATOM 0 HG22 VAL A 136 11.803 0.340 -0.359 1.00 52.41 H new ATOM 0 HG23 VAL A 136 10.688 0.287 1.028 1.00 52.41 H new ATOM 2041 N ALA A 137 11.101 4.576 2.102 1.00 11.42 N ATOM 2042 CA ALA A 137 10.968 5.993 2.416 1.00 21.01 C ATOM 2043 C ALA A 137 12.191 6.506 3.169 1.00 11.23 C ATOM 2044 O ALA A 137 12.477 6.065 4.282 1.00 63.44 O ATOM 2045 CB ALA A 137 9.705 6.237 3.229 1.00 25.44 C ATOM 0 H ALA A 137 10.347 3.991 2.463 1.00 11.42 H new ATOM 0 HA ALA A 137 10.895 6.542 1.477 1.00 21.01 H new ATOM 0 HB1 ALA A 137 9.618 7.299 3.456 1.00 25.44 H new ATOM 0 HB2 ALA A 137 8.835 5.917 2.655 1.00 25.44 H new ATOM 0 HB3 ALA A 137 9.755 5.670 4.158 1.00 25.44 H new ATOM 2051 N SER A 138 12.910 7.440 2.554 1.00 70.55 N ATOM 2052 CA SER A 138 14.106 8.009 3.164 1.00 0.31 C ATOM 2053 C SER A 138 14.503 9.309 2.470 1.00 32.44 C ATOM 2054 O SER A 138 14.552 10.368 3.095 1.00 54.14 O ATOM 2055 CB SER A 138 15.263 7.010 3.099 1.00 34.24 C ATOM 2056 OG SER A 138 16.355 7.443 3.892 1.00 72.32 O ATOM 0 H SER A 138 12.685 7.819 1.634 1.00 70.55 H new ATOM 0 HA SER A 138 13.882 8.227 4.208 1.00 0.31 H new ATOM 0 HB2 SER A 138 14.924 6.033 3.444 1.00 34.24 H new ATOM 0 HB3 SER A 138 15.586 6.889 2.065 1.00 34.24 H new ATOM 0 HG SER A 138 17.081 6.787 3.835 1.00 72.32 H new ATOM 2062 N GLY A 139 14.784 9.220 1.174 1.00 32.43 N ATOM 2063 CA GLY A 139 15.173 10.394 0.416 1.00 63.20 C ATOM 2064 C GLY A 139 14.473 10.476 -0.925 1.00 3.41 C ATOM 2065 O GLY A 139 14.201 9.465 -1.572 1.00 22.15 O ATOM 0 H GLY A 139 14.749 8.355 0.635 1.00 32.43 H new ATOM 0 HA2 GLY A 139 14.946 11.289 0.996 1.00 63.20 H new ATOM 0 HA3 GLY A 139 16.252 10.380 0.259 1.00 63.20 H new ATOM 2069 N PRO A 140 14.167 11.708 -1.363 1.00 65.44 N ATOM 2070 CA PRO A 140 13.489 11.948 -2.640 1.00 60.14 C ATOM 2071 C PRO A 140 14.380 11.636 -3.837 1.00 42.15 C ATOM 2072 O PRO A 140 15.546 12.031 -3.875 1.00 63.40 O ATOM 2073 CB PRO A 140 13.161 13.442 -2.592 1.00 61.13 C ATOM 2074 CG PRO A 140 14.175 14.023 -1.668 1.00 54.23 C ATOM 2075 CD PRO A 140 14.461 12.959 -0.646 1.00 31.44 C ATOM 0 HA PRO A 140 12.614 11.309 -2.763 1.00 60.14 H new ATOM 0 HB2 PRO A 140 13.223 13.893 -3.582 1.00 61.13 H new ATOM 0 HB3 PRO A 140 12.148 13.613 -2.227 1.00 61.13 H new ATOM 0 HG2 PRO A 140 15.081 14.300 -2.207 1.00 54.23 H new ATOM 0 HG3 PRO A 140 13.797 14.929 -1.193 1.00 54.23 H new ATOM 0 HD2 PRO A 140 15.497 12.994 -0.308 1.00 31.44 H new ATOM 0 HD3 PRO A 140 13.834 13.072 0.238 1.00 31.44 H new ATOM 2083 N SER A 141 13.825 10.927 -4.814 1.00 50.04 N ATOM 2084 CA SER A 141 14.571 10.560 -6.012 1.00 23.10 C ATOM 2085 C SER A 141 15.137 11.799 -6.701 1.00 70.42 C ATOM 2086 O SER A 141 16.305 11.827 -7.089 1.00 41.35 O ATOM 2087 CB SER A 141 13.673 9.789 -6.983 1.00 1.15 C ATOM 2088 OG SER A 141 14.409 8.800 -7.681 1.00 73.43 O ATOM 0 H SER A 141 12.861 10.595 -4.800 1.00 50.04 H new ATOM 0 HA SER A 141 15.401 9.921 -5.711 1.00 23.10 H new ATOM 0 HB2 SER A 141 12.857 9.320 -6.434 1.00 1.15 H new ATOM 0 HB3 SER A 141 13.222 10.481 -7.694 1.00 1.15 H new ATOM 0 HG SER A 141 13.813 8.320 -8.294 1.00 73.43 H new ATOM 2094 N SER A 142 14.300 12.820 -6.848 1.00 72.11 N ATOM 2095 CA SER A 142 14.714 14.061 -7.493 1.00 1.21 C ATOM 2096 C SER A 142 13.563 15.062 -7.533 1.00 64.13 C ATOM 2097 O SER A 142 13.733 16.234 -7.198 1.00 25.04 O ATOM 2098 CB SER A 142 15.212 13.781 -8.912 1.00 12.52 C ATOM 2099 OG SER A 142 14.218 13.125 -9.681 1.00 31.53 O ATOM 0 H SER A 142 13.331 12.813 -6.529 1.00 72.11 H new ATOM 0 HA SER A 142 15.527 14.492 -6.909 1.00 1.21 H new ATOM 0 HB2 SER A 142 15.490 14.718 -9.395 1.00 12.52 H new ATOM 0 HB3 SER A 142 16.110 13.165 -8.871 1.00 12.52 H new ATOM 0 HG SER A 142 14.560 12.959 -10.584 1.00 31.53 H new ATOM 2105 N GLY A 143 12.391 14.591 -7.946 1.00 61.23 N ATOM 2106 CA GLY A 143 11.229 15.457 -8.024 1.00 12.01 C ATOM 2107 C GLY A 143 10.427 15.240 -9.291 1.00 74.03 C ATOM 2108 O GLY A 143 10.664 14.282 -10.027 1.00 64.20 O ATOM 0 H GLY A 143 12.225 13.625 -8.228 1.00 61.23 H new ATOM 0 HA2 GLY A 143 10.590 15.281 -7.159 1.00 12.01 H new ATOM 0 HA3 GLY A 143 11.551 16.497 -7.976 1.00 12.01 H new TER 2112 GLY A 143