USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=19 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 -108:sc= 0.104 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 19 TYR OH : rot 8:sc=-0.00744! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.104 K(o=0.1,f=-1.8) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -150:sc= -0.696 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 180:sc= -0.102 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0685 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 X(o=0,f=-0.00096) 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= -0.311 K(o=-0.31,f=-1.6!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl -160:sc= 0 (180deg=-0.688) 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 -59:sc= 1.1 USER MOD Single : A 124 GLN : amide:sc= -0.327 K(o=-0.33,f=-3.1!) 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 40:sc= 0.958 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.863 1.820 -14.954 1.00 42.32 N ATOM 2 CA GLY A 1 20.762 2.551 -14.354 1.00 4.11 C ATOM 3 C GLY A 1 20.983 4.051 -14.374 1.00 64.12 C ATOM 4 O GLY A 1 21.680 4.594 -13.517 1.00 44.33 O ATOM 0 H1 GLY A 1 21.664 0.800 -14.916 1.00 42.32 H new ATOM 0 H2 GLY A 1 21.976 2.114 -15.945 1.00 42.32 H new ATOM 0 H3 GLY A 1 22.739 2.022 -14.431 1.00 42.32 H new ATOM 0 HA2 GLY A 1 19.840 2.315 -14.886 1.00 4.11 H new ATOM 0 HA3 GLY A 1 20.629 2.220 -13.324 1.00 4.11 H new ATOM 8 N SER A 2 20.388 4.721 -15.356 1.00 11.02 N ATOM 9 CA SER A 2 20.527 6.167 -15.488 1.00 44.11 C ATOM 10 C SER A 2 19.366 6.754 -16.285 1.00 53.52 C ATOM 11 O SER A 2 18.958 6.203 -17.307 1.00 62.24 O ATOM 12 CB SER A 2 21.854 6.513 -16.168 1.00 54.32 C ATOM 13 OG SER A 2 22.613 7.410 -15.377 1.00 41.21 O ATOM 0 H SER A 2 19.805 4.286 -16.071 1.00 11.02 H new ATOM 0 HA SER A 2 20.515 6.601 -14.488 1.00 44.11 H new ATOM 0 HB2 SER A 2 22.426 5.602 -16.341 1.00 54.32 H new ATOM 0 HB3 SER A 2 21.661 6.958 -17.144 1.00 54.32 H new ATOM 0 HG SER A 2 23.457 7.614 -15.832 1.00 41.21 H new ATOM 19 N SER A 3 18.837 7.876 -15.808 1.00 45.43 N ATOM 20 CA SER A 3 17.720 8.538 -16.473 1.00 24.14 C ATOM 21 C SER A 3 17.668 10.018 -16.104 1.00 30.42 C ATOM 22 O SER A 3 18.389 10.474 -15.218 1.00 40.44 O ATOM 23 CB SER A 3 16.402 7.860 -16.096 1.00 72.15 C ATOM 24 OG SER A 3 15.679 7.473 -17.252 1.00 34.13 O ATOM 0 H SER A 3 19.164 8.346 -14.964 1.00 45.43 H new ATOM 0 HA SER A 3 17.868 8.455 -17.550 1.00 24.14 H new ATOM 0 HB2 SER A 3 16.603 6.984 -15.479 1.00 72.15 H new ATOM 0 HB3 SER A 3 15.798 8.541 -15.496 1.00 72.15 H new ATOM 0 HG SER A 3 14.841 7.040 -16.984 1.00 34.13 H new ATOM 30 N GLY A 4 16.807 10.762 -16.791 1.00 55.43 N ATOM 31 CA GLY A 4 16.675 12.183 -16.523 1.00 74.43 C ATOM 32 C GLY A 4 15.338 12.533 -15.902 1.00 74.13 C ATOM 33 O GLY A 4 14.616 13.391 -16.410 1.00 54.33 O ATOM 0 H GLY A 4 16.198 10.407 -17.528 1.00 55.43 H new ATOM 0 HA2 GLY A 4 17.476 12.500 -15.856 1.00 74.43 H new ATOM 0 HA3 GLY A 4 16.797 12.738 -17.453 1.00 74.43 H new ATOM 37 N SER A 5 15.005 11.867 -14.801 1.00 54.20 N ATOM 38 CA SER A 5 13.743 12.109 -14.113 1.00 25.12 C ATOM 39 C SER A 5 13.916 11.986 -12.602 1.00 51.05 C ATOM 40 O SER A 5 14.724 11.191 -12.122 1.00 14.42 O ATOM 41 CB SER A 5 12.677 11.126 -14.599 1.00 33.05 C ATOM 42 OG SER A 5 11.454 11.320 -13.911 1.00 15.02 O ATOM 0 H SER A 5 15.592 11.155 -14.366 1.00 54.20 H new ATOM 0 HA SER A 5 13.421 13.125 -14.342 1.00 25.12 H new ATOM 0 HB2 SER A 5 12.520 11.255 -15.670 1.00 33.05 H new ATOM 0 HB3 SER A 5 13.025 10.104 -14.449 1.00 33.05 H new ATOM 0 HG SER A 5 10.788 10.681 -14.241 1.00 15.02 H new ATOM 48 N SER A 6 13.150 12.778 -11.859 1.00 42.43 N ATOM 49 CA SER A 6 13.219 12.762 -10.403 1.00 22.25 C ATOM 50 C SER A 6 11.835 12.945 -9.790 1.00 54.44 C ATOM 51 O SER A 6 11.191 13.977 -9.981 1.00 3.13 O ATOM 52 CB SER A 6 14.160 13.860 -9.903 1.00 61.31 C ATOM 53 OG SER A 6 15.504 13.580 -10.257 1.00 21.45 O ATOM 0 H SER A 6 12.474 13.439 -12.242 1.00 42.43 H new ATOM 0 HA SER A 6 13.608 11.792 -10.094 1.00 22.25 H new ATOM 0 HB2 SER A 6 13.862 14.819 -10.326 1.00 61.31 H new ATOM 0 HB3 SER A 6 14.077 13.949 -8.820 1.00 61.31 H new ATOM 0 HG SER A 6 16.085 14.297 -9.928 1.00 21.45 H new ATOM 59 N GLY A 7 11.381 11.936 -9.053 1.00 50.31 N ATOM 60 CA GLY A 7 10.075 12.004 -8.423 1.00 51.54 C ATOM 61 C GLY A 7 10.100 12.777 -7.120 1.00 23.24 C ATOM 62 O GLY A 7 11.160 13.206 -6.664 1.00 43.03 O ATOM 0 H GLY A 7 11.895 11.072 -8.881 1.00 50.31 H new ATOM 0 HA2 GLY A 7 9.369 12.474 -9.107 1.00 51.54 H new ATOM 0 HA3 GLY A 7 9.712 10.993 -8.235 1.00 51.54 H new ATOM 66 N MET A 8 8.929 12.956 -6.517 1.00 41.01 N ATOM 67 CA MET A 8 8.821 13.683 -5.257 1.00 40.13 C ATOM 68 C MET A 8 7.671 13.142 -4.414 1.00 31.01 C ATOM 69 O MET A 8 7.840 12.854 -3.230 1.00 25.45 O ATOM 70 CB MET A 8 8.617 15.176 -5.521 1.00 40.22 C ATOM 71 CG MET A 8 8.856 16.047 -4.298 1.00 40.32 C ATOM 72 SD MET A 8 7.471 16.016 -3.143 1.00 2.32 S ATOM 73 CE MET A 8 6.551 17.455 -3.679 1.00 50.13 C ATOM 0 H MET A 8 8.042 12.608 -6.880 1.00 41.01 H new ATOM 0 HA MET A 8 9.750 13.543 -4.705 1.00 40.13 H new ATOM 0 HB2 MET A 8 9.290 15.491 -6.319 1.00 40.22 H new ATOM 0 HB3 MET A 8 7.600 15.338 -5.879 1.00 40.22 H new ATOM 0 HG2 MET A 8 9.758 15.710 -3.787 1.00 40.32 H new ATOM 0 HG3 MET A 8 9.035 17.074 -4.617 1.00 40.32 H new ATOM 0 HE1 MET A 8 5.662 17.570 -3.059 1.00 50.13 H new ATOM 0 HE2 MET A 8 7.177 18.343 -3.585 1.00 50.13 H new ATOM 0 HE3 MET A 8 6.253 17.329 -4.720 1.00 50.13 H new ATOM 83 N GLU A 9 6.503 13.006 -5.033 1.00 14.15 N ATOM 84 CA GLU A 9 5.325 12.501 -4.337 1.00 22.00 C ATOM 85 C GLU A 9 5.596 11.124 -3.738 1.00 20.22 C ATOM 86 O GLU A 9 6.607 10.489 -4.044 1.00 13.24 O ATOM 87 CB GLU A 9 4.133 12.427 -5.293 1.00 72.42 C ATOM 88 CG GLU A 9 3.516 13.780 -5.604 1.00 0.43 C ATOM 89 CD GLU A 9 2.937 14.454 -4.375 1.00 21.33 C ATOM 90 OE1 GLU A 9 2.278 13.757 -3.573 1.00 41.22 O ATOM 91 OE2 GLU A 9 3.142 15.675 -4.213 1.00 74.33 O ATOM 0 H GLU A 9 6.347 13.238 -6.014 1.00 14.15 H new ATOM 0 HA GLU A 9 5.090 13.191 -3.527 1.00 22.00 H new ATOM 0 HB2 GLU A 9 4.454 11.961 -6.225 1.00 72.42 H new ATOM 0 HB3 GLU A 9 3.370 11.780 -4.859 1.00 72.42 H new ATOM 0 HG2 GLU A 9 4.273 14.427 -6.046 1.00 0.43 H new ATOM 0 HG3 GLU A 9 2.730 13.654 -6.349 1.00 0.43 H new ATOM 98 N LEU A 10 4.688 10.668 -2.882 1.00 42.04 N ATOM 99 CA LEU A 10 4.828 9.366 -2.239 1.00 20.41 C ATOM 100 C LEU A 10 4.380 8.246 -3.173 1.00 20.20 C ATOM 101 O LEU A 10 5.128 7.303 -3.432 1.00 41.43 O ATOM 102 CB LEU A 10 4.013 9.324 -0.945 1.00 3.51 C ATOM 103 CG LEU A 10 4.790 9.584 0.346 1.00 23.00 C ATOM 104 CD1 LEU A 10 3.841 9.957 1.474 1.00 73.14 C ATOM 105 CD2 LEU A 10 5.617 8.365 0.724 1.00 25.24 C ATOM 0 H LEU A 10 3.847 11.181 -2.617 1.00 42.04 H new ATOM 0 HA LEU A 10 5.881 9.217 -2.002 1.00 20.41 H new ATOM 0 HB2 LEU A 10 3.213 10.061 -1.019 1.00 3.51 H new ATOM 0 HB3 LEU A 10 3.539 8.345 -0.869 1.00 3.51 H new ATOM 0 HG LEU A 10 5.468 10.421 0.178 1.00 23.00 H new ATOM 0 HD11 LEU A 10 4.412 10.138 2.385 1.00 73.14 H new ATOM 0 HD12 LEU A 10 3.292 10.859 1.204 1.00 73.14 H new ATOM 0 HD13 LEU A 10 3.138 9.141 1.643 1.00 73.14 H new ATOM 0 HD21 LEU A 10 6.164 8.567 1.645 1.00 25.24 H new ATOM 0 HD22 LEU A 10 4.958 7.510 0.874 1.00 25.24 H new ATOM 0 HD23 LEU A 10 6.324 8.142 -0.076 1.00 25.24 H new ATOM 117 N PHE A 11 3.155 8.357 -3.676 1.00 11.31 N ATOM 118 CA PHE A 11 2.607 7.355 -4.581 1.00 64.35 C ATOM 119 C PHE A 11 3.120 7.567 -6.003 1.00 44.04 C ATOM 120 O PHE A 11 2.353 7.879 -6.914 1.00 32.41 O ATOM 121 CB PHE A 11 1.078 7.404 -4.568 1.00 1.04 C ATOM 122 CG PHE A 11 0.477 6.998 -3.252 1.00 25.14 C ATOM 123 CD1 PHE A 11 0.642 7.789 -2.127 1.00 32.15 C ATOM 124 CD2 PHE A 11 -0.251 5.824 -3.141 1.00 60.13 C ATOM 125 CE1 PHE A 11 0.091 7.416 -0.915 1.00 1.12 C ATOM 126 CE2 PHE A 11 -0.804 5.446 -1.932 1.00 53.35 C ATOM 127 CZ PHE A 11 -0.634 6.244 -0.818 1.00 42.10 C ATOM 0 H PHE A 11 2.523 9.131 -3.472 1.00 11.31 H new ATOM 0 HA PHE A 11 2.935 6.374 -4.236 1.00 64.35 H new ATOM 0 HB2 PHE A 11 0.753 8.416 -4.810 1.00 1.04 H new ATOM 0 HB3 PHE A 11 0.695 6.750 -5.351 1.00 1.04 H new ATOM 0 HD1 PHE A 11 1.207 8.707 -2.197 1.00 32.15 H new ATOM 0 HD2 PHE A 11 -0.388 5.197 -4.010 1.00 60.13 H new ATOM 0 HE1 PHE A 11 0.227 8.041 -0.045 1.00 1.12 H new ATOM 0 HE2 PHE A 11 -1.368 4.528 -1.859 1.00 53.35 H new ATOM 0 HZ PHE A 11 -1.067 5.952 0.127 1.00 42.10 H new ATOM 137 N THR A 12 4.427 7.398 -6.186 1.00 32.24 N ATOM 138 CA THR A 12 5.044 7.572 -7.495 1.00 30.23 C ATOM 139 C THR A 12 5.559 6.245 -8.040 1.00 64.04 C ATOM 140 O THR A 12 5.844 5.320 -7.282 1.00 13.52 O ATOM 141 CB THR A 12 6.211 8.577 -7.435 1.00 55.13 C ATOM 142 OG1 THR A 12 7.058 8.279 -6.321 1.00 24.13 O ATOM 143 CG2 THR A 12 5.691 10.002 -7.318 1.00 2.23 C ATOM 0 H THR A 12 5.078 7.141 -5.444 1.00 32.24 H new ATOM 0 HA THR A 12 4.273 7.960 -8.160 1.00 30.23 H new ATOM 0 HB THR A 12 6.784 8.491 -8.358 1.00 55.13 H new ATOM 0 HG1 THR A 12 6.938 8.961 -5.627 1.00 24.13 H new ATOM 0 HG21 THR A 12 6.532 10.694 -7.277 1.00 2.23 H new ATOM 0 HG22 THR A 12 5.071 10.235 -8.184 1.00 2.23 H new ATOM 0 HG23 THR A 12 5.097 10.099 -6.409 1.00 2.23 H new ATOM 151 N GLU A 13 5.677 6.160 -9.362 1.00 0.42 N ATOM 152 CA GLU A 13 6.158 4.945 -10.010 1.00 13.14 C ATOM 153 C GLU A 13 7.379 4.390 -9.283 1.00 45.45 C ATOM 154 O GLU A 13 7.569 3.176 -9.203 1.00 50.53 O ATOM 155 CB GLU A 13 6.503 5.224 -11.474 1.00 73.33 C ATOM 156 CG GLU A 13 6.457 3.987 -12.355 1.00 1.21 C ATOM 157 CD GLU A 13 7.690 3.845 -13.226 1.00 24.13 C ATOM 158 OE1 GLU A 13 8.810 3.851 -12.672 1.00 10.00 O ATOM 159 OE2 GLU A 13 7.536 3.727 -14.459 1.00 72.45 O ATOM 0 H GLU A 13 5.446 6.918 -10.005 1.00 0.42 H new ATOM 0 HA GLU A 13 5.363 4.201 -9.969 1.00 13.14 H new ATOM 0 HB2 GLU A 13 5.808 5.966 -11.867 1.00 73.33 H new ATOM 0 HB3 GLU A 13 7.500 5.661 -11.527 1.00 73.33 H new ATOM 0 HG2 GLU A 13 6.356 3.102 -11.727 1.00 1.21 H new ATOM 0 HG3 GLU A 13 5.572 4.030 -12.989 1.00 1.21 H new ATOM 166 N ALA A 14 8.207 5.288 -8.757 1.00 74.41 N ATOM 167 CA ALA A 14 9.409 4.888 -8.037 1.00 50.11 C ATOM 168 C ALA A 14 9.059 4.149 -6.751 1.00 34.23 C ATOM 169 O ALA A 14 9.484 3.013 -6.541 1.00 33.40 O ATOM 170 CB ALA A 14 10.270 6.104 -7.731 1.00 53.42 C ATOM 0 H ALA A 14 8.067 6.297 -8.816 1.00 74.41 H new ATOM 0 HA ALA A 14 9.974 4.207 -8.674 1.00 50.11 H new ATOM 0 HB1 ALA A 14 11.165 5.790 -7.193 1.00 53.42 H new ATOM 0 HB2 ALA A 14 10.559 6.589 -8.663 1.00 53.42 H new ATOM 0 HB3 ALA A 14 9.704 6.805 -7.117 1.00 53.42 H new ATOM 176 N TRP A 15 8.282 4.800 -5.892 1.00 64.12 N ATOM 177 CA TRP A 15 7.876 4.204 -4.625 1.00 74.05 C ATOM 178 C TRP A 15 7.195 2.858 -4.850 1.00 61.25 C ATOM 179 O TRP A 15 7.330 1.941 -4.041 1.00 72.22 O ATOM 180 CB TRP A 15 6.933 5.146 -3.874 1.00 25.23 C ATOM 181 CG TRP A 15 6.607 4.678 -2.487 1.00 45.34 C ATOM 182 CD1 TRP A 15 7.231 5.049 -1.329 1.00 70.55 C ATOM 183 CD2 TRP A 15 5.581 3.754 -2.114 1.00 11.03 C ATOM 184 NE1 TRP A 15 6.654 4.409 -0.259 1.00 43.05 N ATOM 185 CE2 TRP A 15 5.638 3.610 -0.714 1.00 30.33 C ATOM 186 CE3 TRP A 15 4.617 3.035 -2.826 1.00 71.30 C ATOM 187 CZ2 TRP A 15 4.770 2.776 -0.016 1.00 32.53 C ATOM 188 CZ3 TRP A 15 3.755 2.207 -2.131 1.00 44.11 C ATOM 189 CH2 TRP A 15 3.835 2.083 -0.738 1.00 5.43 C ATOM 0 H TRP A 15 7.921 5.741 -6.050 1.00 64.12 H new ATOM 0 HA TRP A 15 8.771 4.042 -4.025 1.00 74.05 H new ATOM 0 HB2 TRP A 15 7.387 6.135 -3.819 1.00 25.23 H new ATOM 0 HB3 TRP A 15 6.008 5.251 -4.441 1.00 25.23 H new ATOM 0 HD1 TRP A 15 8.056 5.743 -1.265 1.00 70.55 H new ATOM 0 HE1 TRP A 15 6.936 4.512 0.716 1.00 43.05 H new ATOM 0 HE3 TRP A 15 4.547 3.125 -3.900 1.00 71.30 H new ATOM 0 HZ2 TRP A 15 4.831 2.679 1.058 1.00 32.53 H new ATOM 0 HZ3 TRP A 15 3.007 1.646 -2.672 1.00 44.11 H new ATOM 0 HH2 TRP A 15 3.147 1.429 -0.224 1.00 5.43 H new ATOM 200 N ALA A 16 6.463 2.747 -5.954 1.00 43.15 N ATOM 201 CA ALA A 16 5.764 1.512 -6.286 1.00 21.32 C ATOM 202 C ALA A 16 6.747 0.408 -6.661 1.00 43.14 C ATOM 203 O ALA A 16 6.494 -0.771 -6.413 1.00 41.34 O ATOM 204 CB ALA A 16 4.779 1.752 -7.420 1.00 64.42 C ATOM 0 H ALA A 16 6.339 3.498 -6.633 1.00 43.15 H new ATOM 0 HA ALA A 16 5.213 1.187 -5.403 1.00 21.32 H new ATOM 0 HB1 ALA A 16 4.264 0.821 -7.658 1.00 64.42 H new ATOM 0 HB2 ALA A 16 4.050 2.503 -7.116 1.00 64.42 H new ATOM 0 HB3 ALA A 16 5.317 2.104 -8.300 1.00 64.42 H new ATOM 210 N GLN A 17 7.868 0.798 -7.261 1.00 32.21 N ATOM 211 CA GLN A 17 8.888 -0.160 -7.671 1.00 15.10 C ATOM 212 C GLN A 17 9.818 -0.495 -6.510 1.00 60.33 C ATOM 213 O GLN A 17 9.949 -1.656 -6.123 1.00 62.13 O ATOM 214 CB GLN A 17 9.696 0.396 -8.845 1.00 0.14 C ATOM 215 CG GLN A 17 8.880 0.582 -10.113 1.00 1.11 C ATOM 216 CD GLN A 17 9.448 -0.184 -11.291 1.00 64.32 C ATOM 217 OE1 GLN A 17 10.641 -0.099 -11.584 1.00 61.21 O ATOM 218 NE2 GLN A 17 8.596 -0.940 -11.974 1.00 0.33 N ATOM 0 H GLN A 17 8.092 1.770 -7.474 1.00 32.21 H new ATOM 0 HA GLN A 17 8.387 -1.075 -7.986 1.00 15.10 H new ATOM 0 HB2 GLN A 17 10.127 1.355 -8.557 1.00 0.14 H new ATOM 0 HB3 GLN A 17 10.527 -0.277 -9.054 1.00 0.14 H new ATOM 0 HG2 GLN A 17 7.856 0.256 -9.932 1.00 1.11 H new ATOM 0 HG3 GLN A 17 8.838 1.643 -10.361 1.00 1.11 H new ATOM 0 HE21 GLN A 17 7.615 -0.981 -11.697 1.00 0.33 H new ATOM 0 HE22 GLN A 17 8.922 -1.479 -12.776 1.00 0.33 H new ATOM 227 N ALA A 18 10.461 0.528 -5.959 1.00 11.32 N ATOM 228 CA ALA A 18 11.377 0.342 -4.841 1.00 1.43 C ATOM 229 C ALA A 18 10.716 -0.445 -3.714 1.00 63.42 C ATOM 230 O ALA A 18 11.350 -1.289 -3.079 1.00 1.54 O ATOM 231 CB ALA A 18 11.867 1.689 -4.329 1.00 61.22 C ATOM 0 H ALA A 18 10.365 1.495 -6.269 1.00 11.32 H new ATOM 0 HA ALA A 18 12.232 -0.232 -5.197 1.00 1.43 H new ATOM 0 HB1 ALA A 18 12.550 1.534 -3.494 1.00 61.22 H new ATOM 0 HB2 ALA A 18 12.386 2.216 -5.130 1.00 61.22 H new ATOM 0 HB3 ALA A 18 11.016 2.283 -3.996 1.00 61.22 H new ATOM 237 N TYR A 19 9.441 -0.164 -3.472 1.00 43.41 N ATOM 238 CA TYR A 19 8.696 -0.844 -2.420 1.00 21.14 C ATOM 239 C TYR A 19 8.415 -2.295 -2.800 1.00 2.22 C ATOM 240 O TYR A 19 8.316 -3.168 -1.938 1.00 5.43 O ATOM 241 CB TYR A 19 7.380 -0.113 -2.144 1.00 63.52 C ATOM 242 CG TYR A 19 6.537 -0.767 -1.072 1.00 63.24 C ATOM 243 CD1 TYR A 19 7.121 -1.293 0.074 1.00 64.32 C ATOM 244 CD2 TYR A 19 5.157 -0.858 -1.205 1.00 5.24 C ATOM 245 CE1 TYR A 19 6.355 -1.891 1.056 1.00 62.33 C ATOM 246 CE2 TYR A 19 4.383 -1.454 -0.227 1.00 45.34 C ATOM 247 CZ TYR A 19 4.987 -1.969 0.900 1.00 34.23 C ATOM 248 OH TYR A 19 4.220 -2.564 1.876 1.00 41.40 O ATOM 0 H TYR A 19 8.902 0.530 -3.990 1.00 43.41 H new ATOM 0 HA TYR A 19 9.305 -0.836 -1.516 1.00 21.14 H new ATOM 0 HB2 TYR A 19 7.599 0.913 -1.847 1.00 63.52 H new ATOM 0 HB3 TYR A 19 6.803 -0.061 -3.067 1.00 63.52 H new ATOM 0 HD1 TYR A 19 8.192 -1.233 0.199 1.00 64.32 H new ATOM 0 HD2 TYR A 19 4.681 -0.456 -2.087 1.00 5.24 H new ATOM 0 HE1 TYR A 19 6.825 -2.295 1.941 1.00 62.33 H new ATOM 0 HE2 TYR A 19 3.311 -1.516 -0.345 1.00 45.34 H new ATOM 0 HH TYR A 19 4.780 -2.766 2.654 1.00 41.40 H new ATOM 258 N CYS A 20 8.290 -2.545 -4.099 1.00 41.51 N ATOM 259 CA CYS A 20 8.021 -3.888 -4.597 1.00 51.24 C ATOM 260 C CYS A 20 9.242 -4.787 -4.423 1.00 45.42 C ATOM 261 O CYS A 20 9.114 -5.981 -4.156 1.00 31.02 O ATOM 262 CB CYS A 20 7.618 -3.836 -6.073 1.00 22.23 C ATOM 263 SG CYS A 20 6.887 -5.383 -6.698 1.00 74.41 S ATOM 0 H CYS A 20 8.371 -1.834 -4.826 1.00 41.51 H new ATOM 0 HA CYS A 20 7.198 -4.306 -4.017 1.00 51.24 H new ATOM 0 HB2 CYS A 20 6.903 -3.025 -6.215 1.00 22.23 H new ATOM 0 HB3 CYS A 20 8.497 -3.594 -6.670 1.00 22.23 H new ATOM 268 N ARG A 21 10.426 -4.203 -4.578 1.00 30.11 N ATOM 269 CA ARG A 21 11.670 -4.951 -4.439 1.00 2.34 C ATOM 270 C ARG A 21 12.097 -5.029 -2.976 1.00 30.33 C ATOM 271 O ARG A 21 12.731 -5.997 -2.554 1.00 14.01 O ATOM 272 CB ARG A 21 12.777 -4.298 -5.270 1.00 21.43 C ATOM 273 CG ARG A 21 13.114 -2.883 -4.831 1.00 51.05 C ATOM 274 CD ARG A 21 14.515 -2.482 -5.269 1.00 35.42 C ATOM 275 NE ARG A 21 14.926 -1.208 -4.686 1.00 52.34 N ATOM 276 CZ ARG A 21 16.190 -0.803 -4.623 1.00 15.01 C ATOM 277 NH1 ARG A 21 17.159 -1.568 -5.105 1.00 41.15 N ATOM 278 NH2 ARG A 21 16.485 0.370 -4.078 1.00 44.51 N ATOM 0 H ARG A 21 10.550 -3.215 -4.800 1.00 30.11 H new ATOM 0 HA ARG A 21 11.499 -5.964 -4.804 1.00 2.34 H new ATOM 0 HB2 ARG A 21 13.676 -4.912 -5.209 1.00 21.43 H new ATOM 0 HB3 ARG A 21 12.472 -4.282 -6.316 1.00 21.43 H new ATOM 0 HG2 ARG A 21 12.387 -2.188 -5.251 1.00 51.05 H new ATOM 0 HG3 ARG A 21 13.036 -2.809 -3.746 1.00 51.05 H new ATOM 0 HD2 ARG A 21 15.222 -3.259 -4.978 1.00 35.42 H new ATOM 0 HD3 ARG A 21 14.549 -2.411 -6.356 1.00 35.42 H new ATOM 0 HE ARG A 21 14.204 -0.596 -4.307 1.00 52.34 H new ATOM 0 HH11 ARG A 21 16.935 -2.470 -5.526 1.00 41.15 H new ATOM 0 HH12 ARG A 21 18.128 -1.255 -5.055 1.00 41.15 H new ATOM 0 HH21 ARG A 21 15.741 0.961 -3.707 1.00 44.51 H new ATOM 0 HH22 ARG A 21 17.455 0.680 -4.030 1.00 44.51 H new ATOM 292 N LYS A 22 11.745 -4.005 -2.206 1.00 72.23 N ATOM 293 CA LYS A 22 12.089 -3.958 -0.791 1.00 5.23 C ATOM 294 C LYS A 22 11.322 -5.018 -0.008 1.00 12.30 C ATOM 295 O LYS A 22 11.698 -5.372 1.110 1.00 20.25 O ATOM 296 CB LYS A 22 11.790 -2.570 -0.218 1.00 5.31 C ATOM 297 CG LYS A 22 12.685 -2.187 0.948 1.00 33.35 C ATOM 298 CD LYS A 22 13.875 -1.362 0.491 1.00 50.55 C ATOM 299 CE LYS A 22 13.460 0.050 0.105 1.00 52.44 C ATOM 300 NZ LYS A 22 14.593 0.824 -0.472 1.00 1.32 N ATOM 0 H LYS A 22 11.221 -3.196 -2.539 1.00 72.23 H new ATOM 0 HA LYS A 22 13.155 -4.162 -0.696 1.00 5.23 H new ATOM 0 HB2 LYS A 22 11.901 -1.828 -1.009 1.00 5.31 H new ATOM 0 HB3 LYS A 22 10.750 -2.537 0.107 1.00 5.31 H new ATOM 0 HG2 LYS A 22 12.108 -1.621 1.680 1.00 33.35 H new ATOM 0 HG3 LYS A 22 13.037 -3.089 1.449 1.00 33.35 H new ATOM 0 HD2 LYS A 22 14.617 -1.319 1.288 1.00 50.55 H new ATOM 0 HD3 LYS A 22 14.350 -1.848 -0.361 1.00 50.55 H new ATOM 0 HE2 LYS A 22 12.646 0.004 -0.619 1.00 52.44 H new ATOM 0 HE3 LYS A 22 13.076 0.569 0.984 1.00 52.44 H new ATOM 0 HZ1 LYS A 22 14.269 1.780 -0.722 1.00 1.32 H new ATOM 0 HZ2 LYS A 22 15.360 0.890 0.227 1.00 1.32 H new ATOM 0 HZ3 LYS A 22 14.943 0.343 -1.325 1.00 1.32 H new ATOM 314 N LEU A 23 10.246 -5.522 -0.602 1.00 22.24 N ATOM 315 CA LEU A 23 9.426 -6.544 0.040 1.00 70.42 C ATOM 316 C LEU A 23 9.976 -7.939 -0.241 1.00 72.24 C ATOM 317 O LEU A 23 10.003 -8.796 0.640 1.00 33.45 O ATOM 318 CB LEU A 23 7.980 -6.446 -0.448 1.00 34.23 C ATOM 319 CG LEU A 23 7.192 -5.225 0.028 1.00 2.33 C ATOM 320 CD1 LEU A 23 5.892 -5.092 -0.748 1.00 75.24 C ATOM 321 CD2 LEU A 23 6.917 -5.316 1.522 1.00 24.43 C ATOM 0 H LEU A 23 9.921 -5.240 -1.527 1.00 22.24 H new ATOM 0 HA LEU A 23 9.452 -6.373 1.116 1.00 70.42 H new ATOM 0 HB2 LEU A 23 7.985 -6.448 -1.538 1.00 34.23 H new ATOM 0 HB3 LEU A 23 7.449 -7.343 -0.130 1.00 34.23 H new ATOM 0 HG LEU A 23 7.793 -4.335 -0.157 1.00 2.33 H new ATOM 0 HD11 LEU A 23 5.345 -4.218 -0.395 1.00 75.24 H new ATOM 0 HD12 LEU A 23 6.112 -4.978 -1.810 1.00 75.24 H new ATOM 0 HD13 LEU A 23 5.285 -5.985 -0.597 1.00 75.24 H new ATOM 0 HD21 LEU A 23 6.355 -4.439 1.843 1.00 24.43 H new ATOM 0 HD22 LEU A 23 6.337 -6.215 1.731 1.00 24.43 H new ATOM 0 HD23 LEU A 23 7.862 -5.360 2.064 1.00 24.43 H new ATOM 333 N ASN A 24 10.416 -8.158 -1.476 1.00 61.13 N ATOM 334 CA ASN A 24 10.967 -9.448 -1.874 1.00 23.20 C ATOM 335 C ASN A 24 12.213 -9.783 -1.060 1.00 15.34 C ATOM 336 O ASN A 24 12.594 -10.946 -0.939 1.00 31.14 O ATOM 337 CB ASN A 24 11.305 -9.444 -3.366 1.00 24.11 C ATOM 338 CG ASN A 24 10.075 -9.603 -4.239 1.00 24.42 C ATOM 339 OD1 ASN A 24 9.359 -10.599 -4.145 1.00 64.22 O ATOM 340 ND2 ASN A 24 9.826 -8.619 -5.094 1.00 51.32 N ATOM 0 H ASN A 24 10.402 -7.459 -2.218 1.00 61.13 H new ATOM 0 HA ASN A 24 10.213 -10.211 -1.681 1.00 23.20 H new ATOM 0 HB2 ASN A 24 11.808 -8.511 -3.619 1.00 24.11 H new ATOM 0 HB3 ASN A 24 12.005 -10.252 -3.579 1.00 24.11 H new ATOM 0 HD21 ASN A 24 9.013 -8.670 -5.708 1.00 51.32 H new ATOM 0 HD22 ASN A 24 10.448 -7.812 -5.137 1.00 51.32 H new ATOM 347 N GLU A 25 12.842 -8.752 -0.502 1.00 21.43 N ATOM 348 CA GLU A 25 14.045 -8.937 0.302 1.00 54.32 C ATOM 349 C GLU A 25 13.690 -9.379 1.719 1.00 61.25 C ATOM 350 O GLU A 25 14.394 -10.189 2.321 1.00 32.50 O ATOM 351 CB GLU A 25 14.858 -7.642 0.349 1.00 74.13 C ATOM 352 CG GLU A 25 14.050 -6.433 0.789 1.00 3.34 C ATOM 353 CD GLU A 25 14.926 -5.283 1.252 1.00 62.14 C ATOM 354 OE1 GLU A 25 15.924 -4.985 0.562 1.00 14.41 O ATOM 355 OE2 GLU A 25 14.614 -4.683 2.301 1.00 75.41 O ATOM 0 H GLU A 25 12.539 -7.782 -0.592 1.00 21.43 H new ATOM 0 HA GLU A 25 14.646 -9.718 -0.164 1.00 54.32 H new ATOM 0 HB2 GLU A 25 15.698 -7.775 1.031 1.00 74.13 H new ATOM 0 HB3 GLU A 25 15.276 -7.449 -0.639 1.00 74.13 H new ATOM 0 HG2 GLU A 25 13.424 -6.098 -0.038 1.00 3.34 H new ATOM 0 HG3 GLU A 25 13.380 -6.723 1.598 1.00 3.34 H new ATOM 362 N SER A 26 12.595 -8.841 2.244 1.00 52.24 N ATOM 363 CA SER A 26 12.149 -9.175 3.590 1.00 14.03 C ATOM 364 C SER A 26 11.590 -10.595 3.641 1.00 51.45 C ATOM 365 O SER A 26 10.381 -10.793 3.751 1.00 53.11 O ATOM 366 CB SER A 26 11.085 -8.180 4.061 1.00 3.14 C ATOM 367 OG SER A 26 10.888 -8.269 5.461 1.00 4.03 O ATOM 0 H SER A 26 12.000 -8.171 1.757 1.00 52.24 H new ATOM 0 HA SER A 26 13.011 -9.117 4.255 1.00 14.03 H new ATOM 0 HB2 SER A 26 11.388 -7.167 3.797 1.00 3.14 H new ATOM 0 HB3 SER A 26 10.145 -8.376 3.545 1.00 3.14 H new ATOM 0 HG SER A 26 10.205 -7.623 5.737 1.00 4.03 H new ATOM 373 N GLU A 27 12.482 -11.578 3.560 1.00 53.51 N ATOM 374 CA GLU A 27 12.077 -12.978 3.594 1.00 23.34 C ATOM 375 C GLU A 27 10.894 -13.180 4.535 1.00 14.32 C ATOM 376 O GLU A 27 9.916 -13.842 4.187 1.00 2.40 O ATOM 377 CB GLU A 27 13.249 -13.859 4.036 1.00 43.11 C ATOM 378 CG GLU A 27 13.332 -15.180 3.291 1.00 33.43 C ATOM 379 CD GLU A 27 14.641 -15.349 2.546 1.00 51.35 C ATOM 380 OE1 GLU A 27 15.178 -14.335 2.052 1.00 22.13 O ATOM 381 OE2 GLU A 27 15.127 -16.495 2.454 1.00 24.35 O ATOM 0 H GLU A 27 13.487 -11.431 3.471 1.00 53.51 H new ATOM 0 HA GLU A 27 11.772 -13.266 2.588 1.00 23.34 H new ATOM 0 HB2 GLU A 27 14.180 -13.311 3.891 1.00 43.11 H new ATOM 0 HB3 GLU A 27 13.160 -14.059 5.104 1.00 43.11 H new ATOM 0 HG2 GLU A 27 13.213 -16.000 3.999 1.00 33.43 H new ATOM 0 HG3 GLU A 27 12.505 -15.247 2.584 1.00 33.43 H new ATOM 388 N ALA A 28 10.989 -12.605 5.730 1.00 64.00 N ATOM 389 CA ALA A 28 9.927 -12.719 6.721 1.00 74.02 C ATOM 390 C ALA A 28 8.564 -12.428 6.100 1.00 61.20 C ATOM 391 O ALA A 28 7.629 -13.218 6.233 1.00 10.12 O ATOM 392 CB ALA A 28 10.189 -11.779 7.888 1.00 40.02 C ATOM 0 H ALA A 28 11.792 -12.055 6.035 1.00 64.00 H new ATOM 0 HA ALA A 28 9.918 -13.744 7.091 1.00 74.02 H new ATOM 0 HB1 ALA A 28 9.387 -11.875 8.620 1.00 40.02 H new ATOM 0 HB2 ALA A 28 11.140 -12.035 8.355 1.00 40.02 H new ATOM 0 HB3 ALA A 28 10.228 -10.752 7.526 1.00 40.02 H new ATOM 398 N TYR A 29 8.459 -11.291 5.423 1.00 52.40 N ATOM 399 CA TYR A 29 7.209 -10.895 4.784 1.00 13.55 C ATOM 400 C TYR A 29 6.721 -11.974 3.824 1.00 52.21 C ATOM 401 O TYR A 29 5.635 -12.528 3.995 1.00 54.31 O ATOM 402 CB TYR A 29 7.392 -9.574 4.035 1.00 50.34 C ATOM 403 CG TYR A 29 6.246 -9.241 3.106 1.00 70.05 C ATOM 404 CD1 TYR A 29 4.928 -9.329 3.537 1.00 51.24 C ATOM 405 CD2 TYR A 29 6.482 -8.838 1.797 1.00 64.30 C ATOM 406 CE1 TYR A 29 3.879 -9.028 2.691 1.00 54.12 C ATOM 407 CE2 TYR A 29 5.439 -8.533 0.944 1.00 13.31 C ATOM 408 CZ TYR A 29 4.138 -8.630 1.396 1.00 44.35 C ATOM 409 OH TYR A 29 3.096 -8.327 0.551 1.00 51.32 O ATOM 0 H TYR A 29 9.224 -10.627 5.302 1.00 52.40 H new ATOM 0 HA TYR A 29 6.458 -10.763 5.563 1.00 13.55 H new ATOM 0 HB2 TYR A 29 7.507 -8.768 4.760 1.00 50.34 H new ATOM 0 HB3 TYR A 29 8.316 -9.618 3.458 1.00 50.34 H new ATOM 0 HD1 TYR A 29 4.721 -9.638 4.551 1.00 51.24 H new ATOM 0 HD2 TYR A 29 7.499 -8.762 1.440 1.00 64.30 H new ATOM 0 HE1 TYR A 29 2.860 -9.104 3.042 1.00 54.12 H new ATOM 0 HE2 TYR A 29 5.640 -8.221 -0.070 1.00 13.31 H new ATOM 0 HH TYR A 29 3.354 -8.529 -0.372 1.00 51.32 H new ATOM 419 N ARG A 30 7.534 -12.269 2.814 1.00 55.35 N ATOM 420 CA ARG A 30 7.185 -13.282 1.825 1.00 41.05 C ATOM 421 C ARG A 30 6.686 -14.555 2.503 1.00 55.12 C ATOM 422 O ARG A 30 5.691 -15.146 2.081 1.00 13.31 O ATOM 423 CB ARG A 30 8.395 -13.602 0.945 1.00 75.53 C ATOM 424 CG ARG A 30 8.024 -14.166 -0.417 1.00 65.42 C ATOM 425 CD ARG A 30 9.249 -14.675 -1.161 1.00 61.44 C ATOM 426 NE ARG A 30 8.900 -15.662 -2.181 1.00 12.43 N ATOM 427 CZ ARG A 30 8.375 -16.850 -1.904 1.00 15.35 C ATOM 428 NH1 ARG A 30 8.140 -17.198 -0.646 1.00 51.13 N ATOM 429 NH2 ARG A 30 8.083 -17.693 -2.886 1.00 45.03 N ATOM 0 H ARG A 30 8.437 -11.821 2.659 1.00 55.35 H new ATOM 0 HA ARG A 30 6.384 -12.885 1.201 1.00 41.05 H new ATOM 0 HB2 ARG A 30 8.983 -12.695 0.806 1.00 75.53 H new ATOM 0 HB3 ARG A 30 9.032 -14.318 1.464 1.00 75.53 H new ATOM 0 HG2 ARG A 30 7.308 -14.979 -0.293 1.00 65.42 H new ATOM 0 HG3 ARG A 30 7.531 -13.395 -1.009 1.00 65.42 H new ATOM 0 HD2 ARG A 30 9.763 -13.836 -1.630 1.00 61.44 H new ATOM 0 HD3 ARG A 30 9.946 -15.119 -0.450 1.00 61.44 H new ATOM 0 HE ARG A 30 9.069 -15.425 -3.159 1.00 12.43 H new ATOM 0 HH11 ARG A 30 8.363 -16.553 0.112 1.00 51.13 H new ATOM 0 HH12 ARG A 30 7.737 -18.111 -0.436 1.00 51.13 H new ATOM 0 HH21 ARG A 30 8.262 -17.429 -3.855 1.00 45.03 H new ATOM 0 HH22 ARG A 30 7.680 -18.605 -2.672 1.00 45.03 H new ATOM 443 N LYS A 31 7.382 -14.971 3.555 1.00 73.13 N ATOM 444 CA LYS A 31 7.010 -16.173 4.293 1.00 53.21 C ATOM 445 C LYS A 31 5.638 -16.010 4.941 1.00 52.12 C ATOM 446 O LYS A 31 4.812 -16.921 4.903 1.00 14.14 O ATOM 447 CB LYS A 31 8.057 -16.484 5.364 1.00 43.22 C ATOM 448 CG LYS A 31 9.380 -16.970 4.796 1.00 25.31 C ATOM 449 CD LYS A 31 10.205 -17.693 5.848 1.00 10.43 C ATOM 450 CE LYS A 31 9.908 -19.184 5.862 1.00 34.24 C ATOM 451 NZ LYS A 31 10.392 -19.835 7.111 1.00 15.10 N ATOM 0 H LYS A 31 8.208 -14.493 3.916 1.00 73.13 H new ATOM 0 HA LYS A 31 6.964 -17.003 3.587 1.00 53.21 H new ATOM 0 HB2 LYS A 31 8.234 -15.588 5.959 1.00 43.22 H new ATOM 0 HB3 LYS A 31 7.660 -17.242 6.039 1.00 43.22 H new ATOM 0 HG2 LYS A 31 9.193 -17.639 3.956 1.00 25.31 H new ATOM 0 HG3 LYS A 31 9.945 -16.122 4.409 1.00 25.31 H new ATOM 0 HD2 LYS A 31 11.265 -17.534 5.653 1.00 10.43 H new ATOM 0 HD3 LYS A 31 9.995 -17.270 6.830 1.00 10.43 H new ATOM 0 HE2 LYS A 31 8.834 -19.341 5.763 1.00 34.24 H new ATOM 0 HE3 LYS A 31 10.380 -19.656 5.000 1.00 34.24 H new ATOM 0 HZ1 LYS A 31 10.170 -20.851 7.081 1.00 15.10 H new ATOM 0 HZ2 LYS A 31 11.421 -19.707 7.193 1.00 15.10 H new ATOM 0 HZ3 LYS A 31 9.923 -19.402 7.932 1.00 15.10 H new ATOM 465 N ALA A 32 5.403 -14.843 5.532 1.00 33.24 N ATOM 466 CA ALA A 32 4.130 -14.561 6.185 1.00 71.43 C ATOM 467 C ALA A 32 2.987 -14.552 5.176 1.00 13.11 C ATOM 468 O ALA A 32 1.971 -15.219 5.370 1.00 60.24 O ATOM 469 CB ALA A 32 4.198 -13.231 6.921 1.00 63.44 C ATOM 0 H ALA A 32 6.077 -14.078 5.572 1.00 33.24 H new ATOM 0 HA ALA A 32 3.936 -15.354 6.908 1.00 71.43 H new ATOM 0 HB1 ALA A 32 3.241 -13.033 7.404 1.00 63.44 H new ATOM 0 HB2 ALA A 32 4.983 -13.272 7.676 1.00 63.44 H new ATOM 0 HB3 ALA A 32 4.418 -12.433 6.212 1.00 63.44 H new ATOM 475 N ALA A 33 3.158 -13.790 4.101 1.00 43.01 N ATOM 476 CA ALA A 33 2.141 -13.695 3.062 1.00 13.10 C ATOM 477 C ALA A 33 2.425 -14.669 1.924 1.00 63.34 C ATOM 478 O ALA A 33 2.243 -14.340 0.752 1.00 62.12 O ATOM 479 CB ALA A 33 2.059 -12.271 2.532 1.00 50.21 C ATOM 0 H ALA A 33 3.992 -13.229 3.927 1.00 43.01 H new ATOM 0 HA ALA A 33 1.181 -13.963 3.503 1.00 13.10 H new ATOM 0 HB1 ALA A 33 1.295 -12.215 1.756 1.00 50.21 H new ATOM 0 HB2 ALA A 33 1.800 -11.594 3.346 1.00 50.21 H new ATOM 0 HB3 ALA A 33 3.023 -11.983 2.113 1.00 50.21 H new ATOM 485 N SER A 34 2.873 -15.870 2.277 1.00 22.32 N ATOM 486 CA SER A 34 3.187 -16.892 1.285 1.00 3.43 C ATOM 487 C SER A 34 1.935 -17.667 0.889 1.00 32.10 C ATOM 488 O SER A 34 2.011 -18.826 0.478 1.00 74.41 O ATOM 489 CB SER A 34 4.246 -17.852 1.829 1.00 71.45 C ATOM 490 OG SER A 34 5.217 -18.153 0.842 1.00 41.22 O ATOM 0 H SER A 34 3.027 -16.159 3.243 1.00 22.32 H new ATOM 0 HA SER A 34 3.580 -16.395 0.398 1.00 3.43 H new ATOM 0 HB2 SER A 34 4.732 -17.408 2.698 1.00 71.45 H new ATOM 0 HB3 SER A 34 3.768 -18.772 2.166 1.00 71.45 H new ATOM 0 HG SER A 34 5.883 -18.767 1.215 1.00 41.22 H new ATOM 496 N THR A 35 0.781 -17.021 1.015 1.00 14.35 N ATOM 497 CA THR A 35 -0.490 -17.649 0.673 1.00 51.43 C ATOM 498 C THR A 35 -1.518 -16.609 0.242 1.00 22.30 C ATOM 499 O THR A 35 -2.723 -16.858 0.288 1.00 32.13 O ATOM 500 CB THR A 35 -1.056 -18.453 1.858 1.00 72.14 C ATOM 501 OG1 THR A 35 -0.061 -19.355 2.358 1.00 53.43 O ATOM 502 CG2 THR A 35 -2.292 -19.236 1.440 1.00 44.24 C ATOM 0 H THR A 35 0.700 -16.062 1.352 1.00 14.35 H new ATOM 0 HA THR A 35 -0.294 -18.328 -0.157 1.00 51.43 H new ATOM 0 HB THR A 35 -1.338 -17.751 2.643 1.00 72.14 H new ATOM 0 HG1 THR A 35 -0.428 -19.862 3.112 1.00 53.43 H new ATOM 0 HG21 THR A 35 -2.674 -19.796 2.294 1.00 44.24 H new ATOM 0 HG22 THR A 35 -3.058 -18.546 1.087 1.00 44.24 H new ATOM 0 HG23 THR A 35 -2.031 -19.928 0.640 1.00 44.24 H new ATOM 510 N TRP A 36 -1.036 -15.446 -0.179 1.00 4.34 N ATOM 511 CA TRP A 36 -1.915 -14.368 -0.619 1.00 43.31 C ATOM 512 C TRP A 36 -2.507 -14.675 -1.989 1.00 61.11 C ATOM 513 O TRP A 36 -3.721 -14.821 -2.132 1.00 4.42 O ATOM 514 CB TRP A 36 -1.149 -13.044 -0.665 1.00 74.34 C ATOM 515 CG TRP A 36 -1.940 -11.922 -1.266 1.00 71.44 C ATOM 516 CD1 TRP A 36 -2.031 -11.603 -2.591 1.00 14.52 C ATOM 517 CD2 TRP A 36 -2.748 -10.971 -0.565 1.00 3.22 C ATOM 518 NE1 TRP A 36 -2.848 -10.509 -2.755 1.00 34.11 N ATOM 519 CE2 TRP A 36 -3.301 -10.104 -1.528 1.00 3.43 C ATOM 520 CE3 TRP A 36 -3.060 -10.769 0.781 1.00 14.34 C ATOM 521 CZ2 TRP A 36 -4.146 -9.052 -1.184 1.00 2.31 C ATOM 522 CZ3 TRP A 36 -3.898 -9.724 1.122 1.00 22.02 C ATOM 523 CH2 TRP A 36 -4.434 -8.876 0.142 1.00 24.32 C ATOM 0 H TRP A 36 -0.041 -15.225 -0.225 1.00 4.34 H new ATOM 0 HA TRP A 36 -2.731 -14.282 0.098 1.00 43.31 H new ATOM 0 HB2 TRP A 36 -0.852 -12.769 0.347 1.00 74.34 H new ATOM 0 HB3 TRP A 36 -0.233 -13.182 -1.239 1.00 74.34 H new ATOM 0 HD1 TRP A 36 -1.535 -12.132 -3.391 1.00 14.52 H new ATOM 0 HE1 TRP A 36 -3.079 -10.070 -3.646 1.00 34.11 H new ATOM 0 HE3 TRP A 36 -2.654 -11.418 1.542 1.00 14.34 H new ATOM 0 HZ2 TRP A 36 -4.560 -8.398 -1.937 1.00 2.31 H new ATOM 0 HZ3 TRP A 36 -4.144 -9.558 2.160 1.00 22.02 H new ATOM 0 HH2 TRP A 36 -5.087 -8.069 0.440 1.00 24.32 H new ATOM 534 N GLU A 37 -1.643 -14.773 -2.995 1.00 23.35 N ATOM 535 CA GLU A 37 -2.084 -15.063 -4.354 1.00 63.33 C ATOM 536 C GLU A 37 -3.068 -14.005 -4.844 1.00 60.42 C ATOM 537 O GLU A 37 -4.279 -14.142 -4.674 1.00 5.50 O ATOM 538 CB GLU A 37 -2.731 -16.447 -4.421 1.00 34.24 C ATOM 539 CG GLU A 37 -1.747 -17.565 -4.722 1.00 72.51 C ATOM 540 CD GLU A 37 -2.418 -18.788 -5.318 1.00 34.03 C ATOM 541 OE1 GLU A 37 -3.418 -19.260 -4.737 1.00 3.52 O ATOM 542 OE2 GLU A 37 -1.944 -19.273 -6.367 1.00 11.15 O ATOM 0 H GLU A 37 -0.635 -14.656 -2.894 1.00 23.35 H new ATOM 0 HA GLU A 37 -1.208 -15.049 -5.003 1.00 63.33 H new ATOM 0 HB2 GLU A 37 -3.224 -16.654 -3.471 1.00 34.24 H new ATOM 0 HB3 GLU A 37 -3.506 -16.440 -5.188 1.00 34.24 H new ATOM 0 HG2 GLU A 37 -0.987 -17.199 -5.413 1.00 72.51 H new ATOM 0 HG3 GLU A 37 -1.233 -17.849 -3.804 1.00 72.51 H new ATOM 549 N GLY A 38 -2.538 -12.949 -5.455 1.00 12.32 N ATOM 550 CA GLY A 38 -3.383 -11.883 -5.960 1.00 13.35 C ATOM 551 C GLY A 38 -2.641 -10.568 -6.094 1.00 5.12 C ATOM 552 O GLY A 38 -1.411 -10.536 -6.055 1.00 64.21 O ATOM 0 H GLY A 38 -1.539 -12.813 -5.609 1.00 12.32 H new ATOM 0 HA2 GLY A 38 -3.784 -12.171 -6.932 1.00 13.35 H new ATOM 0 HA3 GLY A 38 -4.233 -11.750 -5.291 1.00 13.35 H new ATOM 556 N SER A 39 -3.388 -9.481 -6.253 1.00 74.32 N ATOM 557 CA SER A 39 -2.792 -8.158 -6.400 1.00 1.25 C ATOM 558 C SER A 39 -3.512 -7.138 -5.523 1.00 13.23 C ATOM 559 O SER A 39 -4.731 -7.200 -5.351 1.00 63.04 O ATOM 560 CB SER A 39 -2.839 -7.713 -7.863 1.00 4.05 C ATOM 561 OG SER A 39 -4.172 -7.670 -8.340 1.00 15.43 O ATOM 0 H SER A 39 -4.408 -9.490 -6.283 1.00 74.32 H new ATOM 0 HA SER A 39 -1.752 -8.218 -6.080 1.00 1.25 H new ATOM 0 HB2 SER A 39 -2.382 -6.728 -7.962 1.00 4.05 H new ATOM 0 HB3 SER A 39 -2.253 -8.399 -8.474 1.00 4.05 H new ATOM 0 HG SER A 39 -4.175 -7.381 -9.276 1.00 15.43 H new ATOM 567 N LEU A 40 -2.751 -6.200 -4.970 1.00 33.32 N ATOM 568 CA LEU A 40 -3.316 -5.166 -4.110 1.00 3.34 C ATOM 569 C LEU A 40 -3.048 -3.777 -4.681 1.00 25.11 C ATOM 570 O LEU A 40 -1.950 -3.494 -5.162 1.00 34.42 O ATOM 571 CB LEU A 40 -2.731 -5.271 -2.700 1.00 25.11 C ATOM 572 CG LEU A 40 -3.102 -4.147 -1.734 1.00 14.03 C ATOM 573 CD1 LEU A 40 -4.599 -4.147 -1.466 1.00 54.32 C ATOM 574 CD2 LEU A 40 -2.326 -4.285 -0.431 1.00 53.45 C ATOM 0 H LEU A 40 -1.742 -6.134 -5.102 1.00 33.32 H new ATOM 0 HA LEU A 40 -4.394 -5.318 -4.062 1.00 3.34 H new ATOM 0 HB2 LEU A 40 -3.052 -6.217 -2.265 1.00 25.11 H new ATOM 0 HB3 LEU A 40 -1.645 -5.309 -2.781 1.00 25.11 H new ATOM 0 HG LEU A 40 -2.835 -3.196 -2.194 1.00 14.03 H new ATOM 0 HD11 LEU A 40 -4.845 -3.340 -0.776 1.00 54.32 H new ATOM 0 HD12 LEU A 40 -5.136 -4.000 -2.403 1.00 54.32 H new ATOM 0 HD13 LEU A 40 -4.890 -5.101 -1.027 1.00 54.32 H new ATOM 0 HD21 LEU A 40 -2.603 -3.476 0.245 1.00 53.45 H new ATOM 0 HD22 LEU A 40 -2.562 -5.243 0.033 1.00 53.45 H new ATOM 0 HD23 LEU A 40 -1.257 -4.235 -0.637 1.00 53.45 H new ATOM 586 N ALA A 41 -4.056 -2.913 -4.624 1.00 22.44 N ATOM 587 CA ALA A 41 -3.927 -1.553 -5.131 1.00 72.20 C ATOM 588 C ALA A 41 -4.269 -0.531 -4.053 1.00 50.11 C ATOM 589 O ALA A 41 -5.246 -0.688 -3.321 1.00 13.04 O ATOM 590 CB ALA A 41 -4.819 -1.358 -6.348 1.00 75.24 C ATOM 0 H ALA A 41 -4.972 -3.131 -4.231 1.00 22.44 H new ATOM 0 HA ALA A 41 -2.889 -1.398 -5.426 1.00 72.20 H new ATOM 0 HB1 ALA A 41 -4.713 -0.338 -6.717 1.00 75.24 H new ATOM 0 HB2 ALA A 41 -4.526 -2.059 -7.130 1.00 75.24 H new ATOM 0 HB3 ALA A 41 -5.858 -1.538 -6.070 1.00 75.24 H new ATOM 596 N LEU A 42 -3.458 0.517 -3.960 1.00 24.31 N ATOM 597 CA LEU A 42 -3.674 1.566 -2.970 1.00 43.42 C ATOM 598 C LEU A 42 -4.048 2.883 -3.644 1.00 31.33 C ATOM 599 O LEU A 42 -3.178 3.643 -4.068 1.00 13.22 O ATOM 600 CB LEU A 42 -2.418 1.756 -2.117 1.00 21.14 C ATOM 601 CG LEU A 42 -1.829 0.488 -1.499 1.00 2.45 C ATOM 602 CD1 LEU A 42 -0.454 0.770 -0.911 1.00 62.40 C ATOM 603 CD2 LEU A 42 -2.762 -0.069 -0.433 1.00 52.42 C ATOM 0 H LEU A 42 -2.645 0.663 -4.558 1.00 24.31 H new ATOM 0 HA LEU A 42 -4.500 1.260 -2.328 1.00 43.42 H new ATOM 0 HB2 LEU A 42 -1.652 2.225 -2.734 1.00 21.14 H new ATOM 0 HB3 LEU A 42 -2.651 2.454 -1.313 1.00 21.14 H new ATOM 0 HG LEU A 42 -1.720 -0.259 -2.285 1.00 2.45 H new ATOM 0 HD11 LEU A 42 -0.050 -0.144 -0.475 1.00 62.40 H new ATOM 0 HD12 LEU A 42 0.213 1.123 -1.698 1.00 62.40 H new ATOM 0 HD13 LEU A 42 -0.539 1.534 -0.138 1.00 62.40 H new ATOM 0 HD21 LEU A 42 -2.327 -0.971 -0.004 1.00 52.42 H new ATOM 0 HD22 LEU A 42 -2.903 0.674 0.352 1.00 52.42 H new ATOM 0 HD23 LEU A 42 -3.726 -0.309 -0.882 1.00 52.42 H new ATOM 615 N ALA A 43 -5.347 3.145 -3.738 1.00 60.00 N ATOM 616 CA ALA A 43 -5.836 4.370 -4.356 1.00 13.42 C ATOM 617 C ALA A 43 -5.899 5.510 -3.343 1.00 74.44 C ATOM 618 O ALA A 43 -5.996 5.277 -2.138 1.00 65.02 O ATOM 619 CB ALA A 43 -7.206 4.138 -4.978 1.00 10.01 C ATOM 0 H ALA A 43 -6.080 2.525 -3.394 1.00 60.00 H new ATOM 0 HA ALA A 43 -5.136 4.655 -5.141 1.00 13.42 H new ATOM 0 HB1 ALA A 43 -7.559 5.062 -5.436 1.00 10.01 H new ATOM 0 HB2 ALA A 43 -7.133 3.361 -5.739 1.00 10.01 H new ATOM 0 HB3 ALA A 43 -7.908 3.825 -4.205 1.00 10.01 H new ATOM 625 N VAL A 44 -5.843 6.741 -3.841 1.00 35.25 N ATOM 626 CA VAL A 44 -5.894 7.916 -2.979 1.00 14.22 C ATOM 627 C VAL A 44 -6.831 8.975 -3.548 1.00 70.34 C ATOM 628 O VAL A 44 -6.691 9.387 -4.700 1.00 33.11 O ATOM 629 CB VAL A 44 -4.496 8.533 -2.787 1.00 62.24 C ATOM 630 CG1 VAL A 44 -4.565 9.732 -1.854 1.00 65.04 C ATOM 631 CG2 VAL A 44 -3.523 7.490 -2.260 1.00 3.23 C ATOM 0 H VAL A 44 -5.762 6.951 -4.836 1.00 35.25 H new ATOM 0 HA VAL A 44 -6.272 7.583 -2.012 1.00 14.22 H new ATOM 0 HB VAL A 44 -4.133 8.878 -3.755 1.00 62.24 H new ATOM 0 HG11 VAL A 44 -3.568 10.155 -1.730 1.00 65.04 H new ATOM 0 HG12 VAL A 44 -5.228 10.486 -2.278 1.00 65.04 H new ATOM 0 HG13 VAL A 44 -4.948 9.416 -0.884 1.00 65.04 H new ATOM 0 HG21 VAL A 44 -2.540 7.942 -2.130 1.00 3.23 H new ATOM 0 HG22 VAL A 44 -3.878 7.112 -1.301 1.00 3.23 H new ATOM 0 HG23 VAL A 44 -3.452 6.666 -2.971 1.00 3.23 H new ATOM 641 N ARG A 45 -7.787 9.411 -2.734 1.00 50.52 N ATOM 642 CA ARG A 45 -8.748 10.423 -3.157 1.00 70.35 C ATOM 643 C ARG A 45 -8.040 11.604 -3.816 1.00 34.01 C ATOM 644 O ARG A 45 -6.952 12.012 -3.410 1.00 12.11 O ATOM 645 CB ARG A 45 -9.569 10.909 -1.962 1.00 34.13 C ATOM 646 CG ARG A 45 -10.760 10.021 -1.640 1.00 55.24 C ATOM 647 CD ARG A 45 -12.066 10.654 -2.095 1.00 40.03 C ATOM 648 NE ARG A 45 -12.677 9.916 -3.198 1.00 13.05 N ATOM 649 CZ ARG A 45 -13.893 10.172 -3.668 1.00 44.31 C ATOM 650 NH1 ARG A 45 -14.623 11.142 -3.136 1.00 2.20 N ATOM 651 NH2 ARG A 45 -14.380 9.457 -4.674 1.00 13.14 N ATOM 0 H ARG A 45 -7.917 9.079 -1.778 1.00 50.52 H new ATOM 0 HA ARG A 45 -9.417 9.969 -3.888 1.00 70.35 H new ATOM 0 HB2 ARG A 45 -8.922 10.966 -1.087 1.00 34.13 H new ATOM 0 HB3 ARG A 45 -9.924 11.920 -2.163 1.00 34.13 H new ATOM 0 HG2 ARG A 45 -10.635 9.053 -2.125 1.00 55.24 H new ATOM 0 HG3 ARG A 45 -10.798 9.837 -0.566 1.00 55.24 H new ATOM 0 HD2 ARG A 45 -12.761 10.694 -1.256 1.00 40.03 H new ATOM 0 HD3 ARG A 45 -11.882 11.683 -2.405 1.00 40.03 H new ATOM 0 HE ARG A 45 -12.141 9.164 -3.631 1.00 13.05 H new ATOM 0 HH11 ARG A 45 -14.252 11.695 -2.363 1.00 2.20 H new ATOM 0 HH12 ARG A 45 -15.556 11.336 -3.499 1.00 2.20 H new ATOM 0 HH21 ARG A 45 -13.821 8.710 -5.087 1.00 13.14 H new ATOM 0 HH22 ARG A 45 -15.314 9.654 -5.035 1.00 13.14 H new ATOM 665 N PRO A 46 -8.671 12.167 -4.858 1.00 34.14 N ATOM 666 CA PRO A 46 -8.121 13.308 -5.594 1.00 73.03 C ATOM 667 C PRO A 46 -8.132 14.591 -4.768 1.00 63.42 C ATOM 668 O PRO A 46 -9.132 14.920 -4.131 1.00 50.24 O ATOM 669 CB PRO A 46 -9.058 13.439 -6.797 1.00 65.52 C ATOM 670 CG PRO A 46 -10.343 12.837 -6.344 1.00 51.41 C ATOM 671 CD PRO A 46 -9.971 11.732 -5.396 1.00 34.24 C ATOM 0 HA PRO A 46 -7.077 13.153 -5.865 1.00 73.03 H new ATOM 0 HB2 PRO A 46 -9.189 14.482 -7.085 1.00 65.52 H new ATOM 0 HB3 PRO A 46 -8.661 12.916 -7.667 1.00 65.52 H new ATOM 0 HG2 PRO A 46 -10.969 13.580 -5.851 1.00 51.41 H new ATOM 0 HG3 PRO A 46 -10.912 12.451 -7.189 1.00 51.41 H new ATOM 0 HD2 PRO A 46 -10.713 11.613 -4.607 1.00 34.24 H new ATOM 0 HD3 PRO A 46 -9.893 10.773 -5.908 1.00 34.24 H new ATOM 679 N ASP A 47 -7.015 15.309 -4.786 1.00 31.11 N ATOM 680 CA ASP A 47 -6.897 16.557 -4.040 1.00 35.51 C ATOM 681 C ASP A 47 -5.685 17.357 -4.506 1.00 70.14 C ATOM 682 O ASP A 47 -4.595 16.820 -4.705 1.00 30.40 O ATOM 683 CB ASP A 47 -6.789 16.271 -2.541 1.00 4.24 C ATOM 684 CG ASP A 47 -7.642 17.210 -1.710 1.00 20.11 C ATOM 685 OD1 ASP A 47 -8.820 16.879 -1.462 1.00 23.42 O ATOM 686 OD2 ASP A 47 -7.130 18.275 -1.306 1.00 55.24 O ATOM 0 H ASP A 47 -6.178 15.049 -5.309 1.00 31.11 H new ATOM 0 HA ASP A 47 -7.793 17.149 -4.226 1.00 35.51 H new ATOM 0 HB2 ASP A 47 -7.092 15.242 -2.348 1.00 4.24 H new ATOM 0 HB3 ASP A 47 -5.748 16.360 -2.231 1.00 4.24 H new ATOM 691 N PRO A 48 -5.878 18.671 -4.688 1.00 11.52 N ATOM 692 CA PRO A 48 -4.812 19.573 -5.135 1.00 32.01 C ATOM 693 C PRO A 48 -3.741 19.777 -4.069 1.00 10.30 C ATOM 694 O PRO A 48 -2.562 19.946 -4.382 1.00 75.33 O ATOM 695 CB PRO A 48 -5.550 20.886 -5.409 1.00 42.30 C ATOM 696 CG PRO A 48 -6.759 20.830 -4.541 1.00 74.32 C ATOM 697 CD PRO A 48 -7.150 19.380 -4.471 1.00 35.54 C ATOM 0 HA PRO A 48 -4.280 19.178 -6.001 1.00 32.01 H new ATOM 0 HB2 PRO A 48 -4.928 21.748 -5.166 1.00 42.30 H new ATOM 0 HB3 PRO A 48 -5.822 20.975 -6.461 1.00 42.30 H new ATOM 0 HG2 PRO A 48 -6.545 21.225 -3.548 1.00 74.32 H new ATOM 0 HG3 PRO A 48 -7.567 21.433 -4.957 1.00 74.32 H new ATOM 0 HD2 PRO A 48 -7.590 19.129 -3.506 1.00 35.54 H new ATOM 0 HD3 PRO A 48 -7.887 19.126 -5.233 1.00 35.54 H new ATOM 705 N LYS A 49 -4.157 19.761 -2.807 1.00 52.32 N ATOM 706 CA LYS A 49 -3.234 19.943 -1.694 1.00 13.34 C ATOM 707 C LYS A 49 -1.971 19.112 -1.894 1.00 3.33 C ATOM 708 O LYS A 49 -0.868 19.556 -1.572 1.00 74.23 O ATOM 709 CB LYS A 49 -3.909 19.554 -0.376 1.00 15.14 C ATOM 710 CG LYS A 49 -3.054 19.828 0.850 1.00 71.53 C ATOM 711 CD LYS A 49 -3.607 20.982 1.669 1.00 21.51 C ATOM 712 CE LYS A 49 -2.495 21.763 2.352 1.00 3.31 C ATOM 713 NZ LYS A 49 -2.238 21.270 3.733 1.00 23.44 N ATOM 0 H LYS A 49 -5.129 19.624 -2.530 1.00 52.32 H new ATOM 0 HA LYS A 49 -2.954 20.996 -1.655 1.00 13.34 H new ATOM 0 HB2 LYS A 49 -4.848 20.100 -0.283 1.00 15.14 H new ATOM 0 HB3 LYS A 49 -4.159 18.493 -0.405 1.00 15.14 H new ATOM 0 HG2 LYS A 49 -3.006 18.932 1.469 1.00 71.53 H new ATOM 0 HG3 LYS A 49 -2.034 20.057 0.540 1.00 71.53 H new ATOM 0 HD2 LYS A 49 -4.177 21.649 1.022 1.00 21.51 H new ATOM 0 HD3 LYS A 49 -4.298 20.599 2.420 1.00 21.51 H new ATOM 0 HE2 LYS A 49 -1.581 21.685 1.763 1.00 3.31 H new ATOM 0 HE3 LYS A 49 -2.762 22.819 2.387 1.00 3.31 H new ATOM 0 HZ1 LYS A 49 -1.474 21.828 4.164 1.00 23.44 H new ATOM 0 HZ2 LYS A 49 -3.102 21.368 4.303 1.00 23.44 H new ATOM 0 HZ3 LYS A 49 -1.958 20.269 3.698 1.00 23.44 H new ATOM 727 N ALA A 50 -2.139 17.907 -2.427 1.00 45.45 N ATOM 728 CA ALA A 50 -1.011 17.018 -2.674 1.00 24.21 C ATOM 729 C ALA A 50 -0.495 17.167 -4.101 1.00 22.42 C ATOM 730 O ALA A 50 0.695 16.996 -4.363 1.00 11.01 O ATOM 731 CB ALA A 50 -1.408 15.574 -2.402 1.00 41.44 C ATOM 0 H ALA A 50 -3.045 17.524 -2.696 1.00 45.45 H new ATOM 0 HA ALA A 50 -0.206 17.297 -1.994 1.00 24.21 H new ATOM 0 HB1 ALA A 50 -0.556 14.921 -2.590 1.00 41.44 H new ATOM 0 HB2 ALA A 50 -1.720 15.472 -1.363 1.00 41.44 H new ATOM 0 HB3 ALA A 50 -2.232 15.294 -3.058 1.00 41.44 H new ATOM 737 N GLY A 51 -1.400 17.485 -5.022 1.00 23.40 N ATOM 738 CA GLY A 51 -1.016 17.651 -6.412 1.00 75.34 C ATOM 739 C GLY A 51 -1.610 16.582 -7.308 1.00 54.01 C ATOM 740 O GLY A 51 -0.973 16.138 -8.264 1.00 25.52 O ATOM 0 H GLY A 51 -2.391 17.630 -4.831 1.00 23.40 H new ATOM 0 HA2 GLY A 51 -1.338 18.633 -6.760 1.00 75.34 H new ATOM 0 HA3 GLY A 51 0.071 17.625 -6.491 1.00 75.34 H new ATOM 744 N PHE A 52 -2.834 16.167 -7.000 1.00 52.13 N ATOM 745 CA PHE A 52 -3.514 15.141 -7.783 1.00 65.14 C ATOM 746 C PHE A 52 -4.994 15.472 -7.944 1.00 55.23 C ATOM 747 O PHE A 52 -5.844 15.029 -7.170 1.00 44.05 O ATOM 748 CB PHE A 52 -3.355 13.773 -7.118 1.00 61.23 C ATOM 749 CG PHE A 52 -1.939 13.272 -7.110 1.00 64.23 C ATOM 750 CD1 PHE A 52 -1.357 12.777 -8.266 1.00 74.03 C ATOM 751 CD2 PHE A 52 -1.188 13.296 -5.946 1.00 13.04 C ATOM 752 CE1 PHE A 52 -0.055 12.314 -8.260 1.00 54.54 C ATOM 753 CE2 PHE A 52 0.115 12.836 -5.934 1.00 1.13 C ATOM 754 CZ PHE A 52 0.683 12.345 -7.093 1.00 61.34 C ATOM 0 H PHE A 52 -3.376 16.525 -6.214 1.00 52.13 H new ATOM 0 HA PHE A 52 -3.057 15.111 -8.772 1.00 65.14 H new ATOM 0 HB2 PHE A 52 -3.717 13.833 -6.092 1.00 61.23 H new ATOM 0 HB3 PHE A 52 -3.985 13.050 -7.637 1.00 61.23 H new ATOM 0 HD1 PHE A 52 -1.928 12.753 -9.183 1.00 74.03 H new ATOM 0 HD2 PHE A 52 -1.627 13.679 -5.036 1.00 13.04 H new ATOM 0 HE1 PHE A 52 0.385 11.928 -9.168 1.00 54.54 H new ATOM 0 HE2 PHE A 52 0.689 12.860 -5.019 1.00 1.13 H new ATOM 0 HZ PHE A 52 1.702 11.986 -7.087 1.00 61.34 H new ATOM 764 N PRO A 53 -5.314 16.269 -8.975 1.00 2.53 N ATOM 765 CA PRO A 53 -6.692 16.678 -9.262 1.00 55.40 C ATOM 766 C PRO A 53 -7.546 15.520 -9.768 1.00 14.43 C ATOM 767 O PRO A 53 -8.745 15.676 -10.001 1.00 65.22 O ATOM 768 CB PRO A 53 -6.528 17.738 -10.354 1.00 61.25 C ATOM 769 CG PRO A 53 -5.236 17.403 -11.016 1.00 25.43 C ATOM 770 CD PRO A 53 -4.354 16.834 -9.938 1.00 41.22 C ATOM 0 HA PRO A 53 -7.204 17.041 -8.371 1.00 55.40 H new ATOM 0 HB2 PRO A 53 -7.356 17.708 -11.063 1.00 61.25 H new ATOM 0 HB3 PRO A 53 -6.507 18.742 -9.931 1.00 61.25 H new ATOM 0 HG2 PRO A 53 -5.385 16.682 -11.820 1.00 25.43 H new ATOM 0 HG3 PRO A 53 -4.785 18.289 -11.462 1.00 25.43 H new ATOM 0 HD2 PRO A 53 -3.682 16.071 -10.330 1.00 41.22 H new ATOM 0 HD3 PRO A 53 -3.731 17.603 -9.481 1.00 41.22 H new ATOM 778 N LYS A 54 -6.922 14.359 -9.933 1.00 14.53 N ATOM 779 CA LYS A 54 -7.625 13.174 -10.409 1.00 62.23 C ATOM 780 C LYS A 54 -7.434 12.005 -9.447 1.00 10.22 C ATOM 781 O LYS A 54 -8.327 11.176 -9.277 1.00 61.10 O ATOM 782 CB LYS A 54 -7.128 12.786 -11.804 1.00 4.52 C ATOM 783 CG LYS A 54 -7.818 11.561 -12.377 1.00 52.54 C ATOM 784 CD LYS A 54 -9.296 11.818 -12.623 1.00 42.04 C ATOM 785 CE LYS A 54 -9.827 10.967 -13.767 1.00 30.34 C ATOM 786 NZ LYS A 54 -10.593 11.778 -14.752 1.00 74.04 N ATOM 0 H LYS A 54 -5.930 14.213 -9.744 1.00 14.53 H new ATOM 0 HA LYS A 54 -8.688 13.410 -10.461 1.00 62.23 H new ATOM 0 HB2 LYS A 54 -7.278 13.627 -12.481 1.00 4.52 H new ATOM 0 HB3 LYS A 54 -6.055 12.600 -11.759 1.00 4.52 H new ATOM 0 HG2 LYS A 54 -7.337 11.275 -13.312 1.00 52.54 H new ATOM 0 HG3 LYS A 54 -7.703 10.723 -11.690 1.00 52.54 H new ATOM 0 HD2 LYS A 54 -9.860 11.602 -11.715 1.00 42.04 H new ATOM 0 HD3 LYS A 54 -9.450 12.873 -12.851 1.00 42.04 H new ATOM 0 HE2 LYS A 54 -8.995 10.475 -14.271 1.00 30.34 H new ATOM 0 HE3 LYS A 54 -10.467 10.181 -13.368 1.00 30.34 H new ATOM 0 HZ1 LYS A 54 -10.938 11.162 -15.516 1.00 74.04 H new ATOM 0 HZ2 LYS A 54 -11.402 12.227 -14.277 1.00 74.04 H new ATOM 0 HZ3 LYS A 54 -9.975 12.513 -15.152 1.00 74.04 H new ATOM 800 N GLY A 55 -6.264 11.947 -8.817 1.00 62.02 N ATOM 801 CA GLY A 55 -5.978 10.878 -7.880 1.00 33.25 C ATOM 802 C GLY A 55 -4.890 9.947 -8.376 1.00 24.22 C ATOM 803 O GLY A 55 -4.546 9.956 -9.557 1.00 50.10 O ATOM 0 H GLY A 55 -5.509 12.622 -8.940 1.00 62.02 H new ATOM 0 HA2 GLY A 55 -5.676 11.308 -6.925 1.00 33.25 H new ATOM 0 HA3 GLY A 55 -6.887 10.305 -7.699 1.00 33.25 H new ATOM 807 N VAL A 56 -4.344 9.141 -7.470 1.00 73.12 N ATOM 808 CA VAL A 56 -3.287 8.200 -7.822 1.00 15.43 C ATOM 809 C VAL A 56 -3.592 6.806 -7.285 1.00 3.33 C ATOM 810 O VAL A 56 -4.077 6.653 -6.164 1.00 53.22 O ATOM 811 CB VAL A 56 -1.922 8.661 -7.277 1.00 45.01 C ATOM 812 CG1 VAL A 56 -1.943 8.713 -5.758 1.00 11.35 C ATOM 813 CG2 VAL A 56 -0.814 7.743 -7.772 1.00 33.23 C ATOM 0 H VAL A 56 -4.616 9.121 -6.487 1.00 73.12 H new ATOM 0 HA VAL A 56 -3.243 8.165 -8.911 1.00 15.43 H new ATOM 0 HB VAL A 56 -1.723 9.667 -7.648 1.00 45.01 H new ATOM 0 HG11 VAL A 56 -0.970 9.041 -5.392 1.00 11.35 H new ATOM 0 HG12 VAL A 56 -2.710 9.414 -5.429 1.00 11.35 H new ATOM 0 HG13 VAL A 56 -2.164 7.721 -5.363 1.00 11.35 H new ATOM 0 HG21 VAL A 56 0.144 8.083 -7.378 1.00 33.23 H new ATOM 0 HG22 VAL A 56 -1.006 6.725 -7.432 1.00 33.23 H new ATOM 0 HG23 VAL A 56 -0.785 7.762 -8.861 1.00 33.23 H new ATOM 823 N ALA A 57 -3.303 5.792 -8.093 1.00 31.52 N ATOM 824 CA ALA A 57 -3.544 4.408 -7.698 1.00 45.42 C ATOM 825 C ALA A 57 -2.296 3.555 -7.899 1.00 41.32 C ATOM 826 O ALA A 57 -1.867 3.321 -9.030 1.00 34.14 O ATOM 827 CB ALA A 57 -4.712 3.832 -8.483 1.00 63.13 C ATOM 0 H ALA A 57 -2.902 5.901 -9.024 1.00 31.52 H new ATOM 0 HA ALA A 57 -3.793 4.396 -6.637 1.00 45.42 H new ATOM 0 HB1 ALA A 57 -4.881 2.799 -8.179 1.00 63.13 H new ATOM 0 HB2 ALA A 57 -5.608 4.420 -8.285 1.00 63.13 H new ATOM 0 HB3 ALA A 57 -4.485 3.864 -9.549 1.00 63.13 H new ATOM 833 N VAL A 58 -1.716 3.093 -6.796 1.00 32.11 N ATOM 834 CA VAL A 58 -0.517 2.266 -6.852 1.00 24.42 C ATOM 835 C VAL A 58 -0.872 0.783 -6.844 1.00 43.04 C ATOM 836 O VAL A 58 -1.733 0.343 -6.082 1.00 2.33 O ATOM 837 CB VAL A 58 0.426 2.562 -5.670 1.00 34.33 C ATOM 838 CG1 VAL A 58 1.486 1.478 -5.547 1.00 54.20 C ATOM 839 CG2 VAL A 58 1.067 3.931 -5.832 1.00 0.44 C ATOM 0 H VAL A 58 -2.057 3.278 -5.853 1.00 32.11 H new ATOM 0 HA VAL A 58 -0.007 2.511 -7.784 1.00 24.42 H new ATOM 0 HB VAL A 58 -0.161 2.567 -4.751 1.00 34.33 H new ATOM 0 HG11 VAL A 58 2.142 1.705 -4.707 1.00 54.20 H new ATOM 0 HG12 VAL A 58 1.004 0.515 -5.381 1.00 54.20 H new ATOM 0 HG13 VAL A 58 2.073 1.437 -6.465 1.00 54.20 H new ATOM 0 HG21 VAL A 58 1.730 4.124 -4.989 1.00 0.44 H new ATOM 0 HG22 VAL A 58 1.641 3.957 -6.758 1.00 0.44 H new ATOM 0 HG23 VAL A 58 0.290 4.695 -5.865 1.00 0.44 H new ATOM 849 N VAL A 59 -0.203 0.016 -7.699 1.00 61.32 N ATOM 850 CA VAL A 59 -0.447 -1.419 -7.791 1.00 5.21 C ATOM 851 C VAL A 59 0.678 -2.210 -7.133 1.00 23.24 C ATOM 852 O VAL A 59 1.807 -1.731 -7.023 1.00 62.22 O ATOM 853 CB VAL A 59 -0.589 -1.872 -9.256 1.00 72.41 C ATOM 854 CG1 VAL A 59 -0.984 -3.340 -9.326 1.00 2.55 C ATOM 855 CG2 VAL A 59 -1.603 -1.004 -9.985 1.00 52.34 C ATOM 0 H VAL A 59 0.512 0.364 -8.338 1.00 61.32 H new ATOM 0 HA VAL A 59 -1.382 -1.615 -7.266 1.00 5.21 H new ATOM 0 HB VAL A 59 0.376 -1.757 -9.749 1.00 72.41 H new ATOM 0 HG11 VAL A 59 -1.080 -3.642 -10.369 1.00 2.55 H new ATOM 0 HG12 VAL A 59 -0.219 -3.946 -8.842 1.00 2.55 H new ATOM 0 HG13 VAL A 59 -1.937 -3.485 -8.818 1.00 2.55 H new ATOM 0 HG21 VAL A 59 -1.691 -1.338 -11.019 1.00 52.34 H new ATOM 0 HG22 VAL A 59 -2.572 -1.086 -9.493 1.00 52.34 H new ATOM 0 HG23 VAL A 59 -1.273 0.035 -9.966 1.00 52.34 H new ATOM 865 N LEU A 60 0.363 -3.424 -6.696 1.00 71.53 N ATOM 866 CA LEU A 60 1.348 -4.284 -6.048 1.00 74.33 C ATOM 867 C LEU A 60 0.991 -5.756 -6.235 1.00 42.12 C ATOM 868 O LEU A 60 0.401 -6.379 -5.353 1.00 53.02 O ATOM 869 CB LEU A 60 1.439 -3.955 -4.557 1.00 62.32 C ATOM 870 CG LEU A 60 1.807 -2.513 -4.210 1.00 24.31 C ATOM 871 CD1 LEU A 60 1.372 -2.178 -2.791 1.00 50.45 C ATOM 872 CD2 LEU A 60 3.303 -2.290 -4.377 1.00 41.35 C ATOM 0 H LEU A 60 -0.567 -3.836 -6.778 1.00 71.53 H new ATOM 0 HA LEU A 60 2.317 -4.101 -6.513 1.00 74.33 H new ATOM 0 HB2 LEU A 60 0.479 -4.185 -4.095 1.00 62.32 H new ATOM 0 HB3 LEU A 60 2.177 -4.616 -4.104 1.00 62.32 H new ATOM 0 HG LEU A 60 1.281 -1.849 -4.896 1.00 24.31 H new ATOM 0 HD11 LEU A 60 1.642 -1.147 -2.561 1.00 50.45 H new ATOM 0 HD12 LEU A 60 0.292 -2.298 -2.704 1.00 50.45 H new ATOM 0 HD13 LEU A 60 1.870 -2.848 -2.090 1.00 50.45 H new ATOM 0 HD21 LEU A 60 3.547 -1.258 -4.126 1.00 41.35 H new ATOM 0 HD22 LEU A 60 3.847 -2.963 -3.715 1.00 41.35 H new ATOM 0 HD23 LEU A 60 3.587 -2.489 -5.410 1.00 41.35 H new ATOM 884 N ASP A 61 1.358 -6.306 -7.387 1.00 74.35 N ATOM 885 CA ASP A 61 1.080 -7.705 -7.689 1.00 24.52 C ATOM 886 C ASP A 61 1.846 -8.627 -6.744 1.00 12.01 C ATOM 887 O ASP A 61 3.056 -8.809 -6.883 1.00 1.31 O ATOM 888 CB ASP A 61 1.450 -8.020 -9.140 1.00 22.53 C ATOM 889 CG ASP A 61 1.485 -9.510 -9.418 1.00 70.13 C ATOM 890 OD1 ASP A 61 1.058 -10.288 -8.539 1.00 74.35 O ATOM 891 OD2 ASP A 61 1.939 -9.898 -10.515 1.00 0.25 O ATOM 0 H ASP A 61 1.849 -5.804 -8.127 1.00 74.35 H new ATOM 0 HA ASP A 61 0.013 -7.876 -7.550 1.00 24.52 H new ATOM 0 HB2 ASP A 61 0.730 -7.546 -9.807 1.00 22.53 H new ATOM 0 HB3 ASP A 61 2.425 -7.588 -9.365 1.00 22.53 H new ATOM 896 N LEU A 62 1.133 -9.205 -5.784 1.00 72.25 N ATOM 897 CA LEU A 62 1.745 -10.108 -4.815 1.00 54.42 C ATOM 898 C LEU A 62 1.448 -11.563 -5.162 1.00 74.04 C ATOM 899 O LEU A 62 0.295 -11.994 -5.140 1.00 12.43 O ATOM 900 CB LEU A 62 1.238 -9.795 -3.406 1.00 44.52 C ATOM 901 CG LEU A 62 1.101 -8.312 -3.056 1.00 42.33 C ATOM 902 CD1 LEU A 62 0.594 -8.145 -1.633 1.00 5.44 C ATOM 903 CD2 LEU A 62 2.432 -7.596 -3.239 1.00 40.22 C ATOM 0 H LEU A 62 0.131 -9.065 -5.655 1.00 72.25 H new ATOM 0 HA LEU A 62 2.824 -9.959 -4.849 1.00 54.42 H new ATOM 0 HB2 LEU A 62 0.265 -10.269 -3.278 1.00 44.52 H new ATOM 0 HB3 LEU A 62 1.915 -10.256 -2.687 1.00 44.52 H new ATOM 0 HG LEU A 62 0.374 -7.863 -3.733 1.00 42.33 H new ATOM 0 HD11 LEU A 62 0.503 -7.084 -1.401 1.00 5.44 H new ATOM 0 HD12 LEU A 62 -0.381 -8.623 -1.536 1.00 5.44 H new ATOM 0 HD13 LEU A 62 1.296 -8.608 -0.940 1.00 5.44 H new ATOM 0 HD21 LEU A 62 2.316 -6.542 -2.986 1.00 40.22 H new ATOM 0 HD22 LEU A 62 3.180 -8.046 -2.586 1.00 40.22 H new ATOM 0 HD23 LEU A 62 2.754 -7.686 -4.276 1.00 40.22 H new ATOM 915 N TRP A 63 2.494 -12.316 -5.481 1.00 0.13 N ATOM 916 CA TRP A 63 2.346 -13.724 -5.831 1.00 0.14 C ATOM 917 C TRP A 63 3.080 -14.613 -4.833 1.00 63.05 C ATOM 918 O TRP A 63 4.306 -14.725 -4.872 1.00 64.45 O ATOM 919 CB TRP A 63 2.873 -13.977 -7.244 1.00 35.31 C ATOM 920 CG TRP A 63 1.818 -13.856 -8.302 1.00 1.10 C ATOM 921 CD1 TRP A 63 1.833 -13.020 -9.383 1.00 32.34 C ATOM 922 CD2 TRP A 63 0.592 -14.592 -8.379 1.00 0.20 C ATOM 923 NE1 TRP A 63 0.691 -13.193 -10.126 1.00 10.42 N ATOM 924 CE2 TRP A 63 -0.086 -14.151 -9.532 1.00 60.01 C ATOM 925 CE3 TRP A 63 0.002 -15.580 -7.587 1.00 61.20 C ATOM 926 CZ2 TRP A 63 -1.323 -14.666 -9.910 1.00 73.20 C ATOM 927 CZ3 TRP A 63 -1.225 -16.090 -7.963 1.00 32.24 C ATOM 928 CH2 TRP A 63 -1.878 -15.634 -9.116 1.00 40.22 C ATOM 0 H TRP A 63 3.455 -11.975 -5.505 1.00 0.13 H new ATOM 0 HA TRP A 63 1.285 -13.972 -5.797 1.00 0.14 H new ATOM 0 HB2 TRP A 63 3.674 -13.269 -7.457 1.00 35.31 H new ATOM 0 HB3 TRP A 63 3.309 -14.975 -7.288 1.00 35.31 H new ATOM 0 HD1 TRP A 63 2.626 -12.326 -9.618 1.00 32.34 H new ATOM 0 HE1 TRP A 63 0.459 -12.689 -10.982 1.00 10.42 H new ATOM 0 HE3 TRP A 63 0.497 -15.939 -6.696 1.00 61.20 H new ATOM 0 HZ2 TRP A 63 -1.827 -14.315 -10.798 1.00 73.20 H new ATOM 0 HZ3 TRP A 63 -1.690 -16.854 -7.358 1.00 32.24 H new ATOM 0 HH2 TRP A 63 -2.837 -16.054 -9.383 1.00 40.22 H new ATOM 939 N HIS A 64 2.325 -15.244 -3.940 1.00 55.34 N ATOM 940 CA HIS A 64 2.904 -16.125 -2.933 1.00 43.24 C ATOM 941 C HIS A 64 3.793 -15.339 -1.972 1.00 74.33 C ATOM 942 O HIS A 64 4.826 -15.833 -1.522 1.00 73.31 O ATOM 943 CB HIS A 64 3.714 -17.236 -3.602 1.00 61.04 C ATOM 944 CG HIS A 64 2.953 -18.514 -3.769 1.00 32.44 C ATOM 945 ND1 HIS A 64 3.178 -19.631 -2.992 1.00 5.43 N ATOM 946 CD2 HIS A 64 1.963 -18.850 -4.629 1.00 32.22 C ATOM 947 CE1 HIS A 64 2.361 -20.598 -3.367 1.00 74.51 C ATOM 948 NE2 HIS A 64 1.613 -20.150 -4.359 1.00 35.31 N ATOM 0 H HIS A 64 1.309 -15.161 -3.893 1.00 55.34 H new ATOM 0 HA HIS A 64 2.089 -16.572 -2.364 1.00 43.24 H new ATOM 0 HB2 HIS A 64 4.049 -16.892 -4.580 1.00 61.04 H new ATOM 0 HB3 HIS A 64 4.608 -17.430 -3.009 1.00 61.04 H new ATOM 0 HD2 HIS A 64 1.529 -18.214 -5.386 1.00 32.22 H new ATOM 0 HE1 HIS A 64 2.313 -21.587 -2.936 1.00 74.51 H new ATOM 0 HE2 HIS A 64 0.892 -20.683 -4.846 1.00 35.31 H new ATOM 957 N GLY A 65 3.383 -14.113 -1.663 1.00 62.34 N ATOM 958 CA GLY A 65 4.153 -13.280 -0.758 1.00 43.34 C ATOM 959 C GLY A 65 5.203 -12.458 -1.480 1.00 30.23 C ATOM 960 O GLY A 65 5.617 -11.406 -0.995 1.00 41.32 O ATOM 0 H GLY A 65 2.532 -13.682 -2.023 1.00 62.34 H new ATOM 0 HA2 GLY A 65 3.479 -12.612 -0.221 1.00 43.34 H new ATOM 0 HA3 GLY A 65 4.638 -13.910 -0.013 1.00 43.34 H new ATOM 964 N ALA A 66 5.636 -12.941 -2.639 1.00 21.10 N ATOM 965 CA ALA A 66 6.644 -12.244 -3.428 1.00 65.04 C ATOM 966 C ALA A 66 6.007 -11.188 -4.323 1.00 52.23 C ATOM 967 O ALA A 66 5.091 -11.482 -5.093 1.00 43.40 O ATOM 968 CB ALA A 66 7.441 -13.236 -4.263 1.00 75.32 C ATOM 0 H ALA A 66 5.305 -13.812 -3.053 1.00 21.10 H new ATOM 0 HA ALA A 66 7.322 -11.739 -2.740 1.00 65.04 H new ATOM 0 HB1 ALA A 66 8.190 -12.701 -4.847 1.00 75.32 H new ATOM 0 HB2 ALA A 66 7.936 -13.950 -3.605 1.00 75.32 H new ATOM 0 HB3 ALA A 66 6.769 -13.768 -4.936 1.00 75.32 H new ATOM 974 N CYS A 67 6.495 -9.957 -4.219 1.00 11.41 N ATOM 975 CA CYS A 67 5.973 -8.855 -5.018 1.00 70.32 C ATOM 976 C CYS A 67 6.369 -9.011 -6.484 1.00 33.31 C ATOM 977 O CYS A 67 7.349 -8.421 -6.939 1.00 61.41 O ATOM 978 CB CYS A 67 6.486 -7.517 -4.480 1.00 75.53 C ATOM 979 SG CYS A 67 5.648 -6.062 -5.184 1.00 41.14 S ATOM 0 H CYS A 67 7.253 -9.697 -3.588 1.00 11.41 H new ATOM 0 HA CYS A 67 4.885 -8.873 -4.949 1.00 70.32 H new ATOM 0 HB2 CYS A 67 6.366 -7.503 -3.397 1.00 75.53 H new ATOM 0 HB3 CYS A 67 7.554 -7.441 -4.683 1.00 75.53 H new ATOM 984 N ARG A 68 5.599 -9.808 -7.217 1.00 51.11 N ATOM 985 CA ARG A 68 5.868 -10.042 -8.631 1.00 63.00 C ATOM 986 C ARG A 68 6.236 -8.741 -9.337 1.00 61.14 C ATOM 987 O ARG A 68 7.316 -8.618 -9.913 1.00 2.24 O ATOM 988 CB ARG A 68 4.651 -10.675 -9.307 1.00 32.42 C ATOM 989 CG ARG A 68 4.904 -11.099 -10.744 1.00 21.13 C ATOM 990 CD ARG A 68 5.767 -12.349 -10.812 1.00 61.24 C ATOM 991 NE ARG A 68 6.551 -12.407 -12.044 1.00 2.34 N ATOM 992 CZ ARG A 68 7.374 -13.404 -12.344 1.00 43.24 C ATOM 993 NH1 ARG A 68 7.521 -14.423 -11.509 1.00 72.32 N ATOM 994 NH2 ARG A 68 8.054 -13.384 -13.485 1.00 72.40 N ATOM 0 H ARG A 68 4.784 -10.303 -6.855 1.00 51.11 H new ATOM 0 HA ARG A 68 6.713 -10.727 -8.705 1.00 63.00 H new ATOM 0 HB2 ARG A 68 4.337 -11.545 -8.730 1.00 32.42 H new ATOM 0 HB3 ARG A 68 3.825 -9.965 -9.287 1.00 32.42 H new ATOM 0 HG2 ARG A 68 3.953 -11.285 -11.243 1.00 21.13 H new ATOM 0 HG3 ARG A 68 5.393 -10.288 -11.283 1.00 21.13 H new ATOM 0 HD2 ARG A 68 6.438 -12.373 -9.954 1.00 61.24 H new ATOM 0 HD3 ARG A 68 5.132 -13.232 -10.745 1.00 61.24 H new ATOM 0 HE ARG A 68 6.461 -11.639 -12.710 1.00 2.34 H new ATOM 0 HH11 ARG A 68 7.001 -14.443 -10.632 1.00 72.32 H new ATOM 0 HH12 ARG A 68 8.155 -15.187 -11.744 1.00 72.32 H new ATOM 0 HH21 ARG A 68 7.944 -12.602 -14.131 1.00 72.40 H new ATOM 0 HH22 ARG A 68 8.686 -14.150 -13.715 1.00 72.40 H new ATOM 1008 N GLY A 69 5.328 -7.770 -9.290 1.00 33.04 N ATOM 1009 CA GLY A 69 5.575 -6.492 -9.929 1.00 11.25 C ATOM 1010 C GLY A 69 4.756 -5.371 -9.319 1.00 24.25 C ATOM 1011 O GLY A 69 3.992 -5.591 -8.380 1.00 70.40 O ATOM 0 H GLY A 69 4.426 -7.847 -8.820 1.00 33.04 H new ATOM 0 HA2 GLY A 69 6.634 -6.248 -9.850 1.00 11.25 H new ATOM 0 HA3 GLY A 69 5.344 -6.570 -10.991 1.00 11.25 H new ATOM 1015 N ALA A 70 4.919 -4.164 -9.852 1.00 15.24 N ATOM 1016 CA ALA A 70 4.188 -3.005 -9.354 1.00 31.11 C ATOM 1017 C ALA A 70 4.190 -1.874 -10.376 1.00 42.14 C ATOM 1018 O ALA A 70 5.111 -1.756 -11.185 1.00 53.35 O ATOM 1019 CB ALA A 70 4.787 -2.529 -8.037 1.00 72.24 C ATOM 0 H ALA A 70 5.550 -3.964 -10.628 1.00 15.24 H new ATOM 0 HA ALA A 70 3.154 -3.305 -9.184 1.00 31.11 H new ATOM 0 HB1 ALA A 70 4.232 -1.663 -7.677 1.00 72.24 H new ATOM 0 HB2 ALA A 70 4.729 -3.330 -7.300 1.00 72.24 H new ATOM 0 HB3 ALA A 70 5.830 -2.253 -8.191 1.00 72.24 H new ATOM 1025 N LYS A 71 3.153 -1.045 -10.337 1.00 14.32 N ATOM 1026 CA LYS A 71 3.033 0.078 -11.259 1.00 44.12 C ATOM 1027 C LYS A 71 2.101 1.146 -10.699 1.00 42.53 C ATOM 1028 O LYS A 71 1.069 0.834 -10.107 1.00 13.04 O ATOM 1029 CB LYS A 71 2.516 -0.404 -12.617 1.00 61.13 C ATOM 1030 CG LYS A 71 1.260 -1.252 -12.523 1.00 72.31 C ATOM 1031 CD LYS A 71 0.729 -1.619 -13.899 1.00 40.14 C ATOM 1032 CE LYS A 71 -0.768 -1.887 -13.867 1.00 10.23 C ATOM 1033 NZ LYS A 71 -1.552 -0.715 -14.347 1.00 23.14 N ATOM 0 H LYS A 71 2.382 -1.130 -9.675 1.00 14.32 H new ATOM 0 HA LYS A 71 4.022 0.517 -11.388 1.00 44.12 H new ATOM 0 HB2 LYS A 71 2.313 0.462 -13.247 1.00 61.13 H new ATOM 0 HB3 LYS A 71 3.298 -0.981 -13.110 1.00 61.13 H new ATOM 0 HG2 LYS A 71 1.475 -2.161 -11.961 1.00 72.31 H new ATOM 0 HG3 LYS A 71 0.494 -0.709 -11.970 1.00 72.31 H new ATOM 0 HD2 LYS A 71 0.940 -0.810 -14.599 1.00 40.14 H new ATOM 0 HD3 LYS A 71 1.250 -2.503 -14.267 1.00 40.14 H new ATOM 0 HE2 LYS A 71 -0.995 -2.754 -14.487 1.00 10.23 H new ATOM 0 HE3 LYS A 71 -1.071 -2.134 -12.850 1.00 10.23 H new ATOM 0 HZ1 LYS A 71 -2.567 -0.938 -14.310 1.00 23.14 H new ATOM 0 HZ2 LYS A 71 -1.355 0.106 -13.740 1.00 23.14 H new ATOM 0 HZ3 LYS A 71 -1.282 -0.494 -15.327 1.00 23.14 H new ATOM 1047 N ALA A 72 2.472 2.409 -10.891 1.00 31.11 N ATOM 1048 CA ALA A 72 1.666 3.523 -10.408 1.00 3.43 C ATOM 1049 C ALA A 72 0.702 4.012 -11.484 1.00 22.31 C ATOM 1050 O ALA A 72 1.051 4.073 -12.662 1.00 44.32 O ATOM 1051 CB ALA A 72 2.565 4.661 -9.945 1.00 54.04 C ATOM 0 H ALA A 72 3.325 2.685 -11.377 1.00 31.11 H new ATOM 0 HA ALA A 72 1.075 3.172 -9.562 1.00 3.43 H new ATOM 0 HB1 ALA A 72 1.951 5.487 -9.587 1.00 54.04 H new ATOM 0 HB2 ALA A 72 3.209 4.311 -9.138 1.00 54.04 H new ATOM 0 HB3 ALA A 72 3.180 5.001 -10.778 1.00 54.04 H new ATOM 1057 N VAL A 73 -0.513 4.357 -11.070 1.00 4.35 N ATOM 1058 CA VAL A 73 -1.528 4.841 -11.998 1.00 45.12 C ATOM 1059 C VAL A 73 -2.019 6.228 -11.602 1.00 2.23 C ATOM 1060 O VAL A 73 -1.970 6.603 -10.431 1.00 63.52 O ATOM 1061 CB VAL A 73 -2.731 3.881 -12.065 1.00 2.32 C ATOM 1062 CG1 VAL A 73 -3.660 4.268 -13.205 1.00 72.01 C ATOM 1063 CG2 VAL A 73 -2.257 2.444 -12.216 1.00 61.54 C ATOM 0 H VAL A 73 -0.818 4.310 -10.098 1.00 4.35 H new ATOM 0 HA VAL A 73 -1.059 4.893 -12.981 1.00 45.12 H new ATOM 0 HB VAL A 73 -3.289 3.959 -11.132 1.00 2.32 H new ATOM 0 HG11 VAL A 73 -4.504 3.579 -13.237 1.00 72.01 H new ATOM 0 HG12 VAL A 73 -4.026 5.283 -13.048 1.00 72.01 H new ATOM 0 HG13 VAL A 73 -3.117 4.220 -14.149 1.00 72.01 H new ATOM 0 HG21 VAL A 73 -3.120 1.779 -12.262 1.00 61.54 H new ATOM 0 HG22 VAL A 73 -1.675 2.347 -13.133 1.00 61.54 H new ATOM 0 HG23 VAL A 73 -1.636 2.174 -11.362 1.00 61.54 H new ATOM 1073 N GLU A 74 -2.494 6.986 -12.586 1.00 60.43 N ATOM 1074 CA GLU A 74 -2.995 8.333 -12.339 1.00 23.34 C ATOM 1075 C GLU A 74 -4.499 8.407 -12.584 1.00 21.22 C ATOM 1076 O GLU A 74 -4.947 8.544 -13.722 1.00 33.34 O ATOM 1077 CB GLU A 74 -2.270 9.342 -13.232 1.00 30.34 C ATOM 1078 CG GLU A 74 -0.842 9.625 -12.797 1.00 61.04 C ATOM 1079 CD GLU A 74 -0.066 10.423 -13.826 1.00 53.33 C ATOM 1080 OE1 GLU A 74 -0.684 11.256 -14.522 1.00 34.23 O ATOM 1081 OE2 GLU A 74 1.160 10.215 -13.936 1.00 4.01 O ATOM 0 H GLU A 74 -2.542 6.690 -13.561 1.00 60.43 H new ATOM 0 HA GLU A 74 -2.803 8.580 -11.295 1.00 23.34 H new ATOM 0 HB2 GLU A 74 -2.261 8.968 -14.256 1.00 30.34 H new ATOM 0 HB3 GLU A 74 -2.831 10.277 -13.239 1.00 30.34 H new ATOM 0 HG2 GLU A 74 -0.855 10.171 -11.854 1.00 61.04 H new ATOM 0 HG3 GLU A 74 -0.329 8.681 -12.612 1.00 61.04 H new ATOM 1088 N GLY A 75 -5.273 8.316 -11.507 1.00 55.41 N ATOM 1089 CA GLY A 75 -6.718 8.374 -11.626 1.00 15.52 C ATOM 1090 C GLY A 75 -7.341 7.005 -11.812 1.00 14.24 C ATOM 1091 O GLY A 75 -8.317 6.664 -11.143 1.00 63.04 O ATOM 0 H GLY A 75 -4.925 8.203 -10.555 1.00 55.41 H new ATOM 0 HA2 GLY A 75 -7.134 8.841 -10.733 1.00 15.52 H new ATOM 0 HA3 GLY A 75 -6.984 9.009 -12.471 1.00 15.52 H new ATOM 1095 N GLU A 76 -6.776 6.219 -12.723 1.00 75.11 N ATOM 1096 CA GLU A 76 -7.285 4.880 -12.996 1.00 33.13 C ATOM 1097 C GLU A 76 -6.753 3.878 -11.976 1.00 23.21 C ATOM 1098 O GLU A 76 -5.985 4.234 -11.082 1.00 74.22 O ATOM 1099 CB GLU A 76 -6.898 4.442 -14.409 1.00 75.45 C ATOM 1100 CG GLU A 76 -8.043 3.817 -15.189 1.00 72.22 C ATOM 1101 CD GLU A 76 -9.339 4.592 -15.043 1.00 62.12 C ATOM 1102 OE1 GLU A 76 -9.277 5.835 -14.944 1.00 71.14 O ATOM 1103 OE2 GLU A 76 -10.413 3.955 -15.030 1.00 24.14 O ATOM 0 H GLU A 76 -5.967 6.486 -13.284 1.00 75.11 H new ATOM 0 HA GLU A 76 -8.372 4.909 -12.918 1.00 33.13 H new ATOM 0 HB2 GLU A 76 -6.525 5.306 -14.958 1.00 75.45 H new ATOM 0 HB3 GLU A 76 -6.079 3.726 -14.346 1.00 75.45 H new ATOM 0 HG2 GLU A 76 -7.773 3.763 -16.244 1.00 72.22 H new ATOM 0 HG3 GLU A 76 -8.195 2.794 -14.846 1.00 72.22 H new ATOM 1110 N ALA A 77 -7.166 2.622 -12.118 1.00 34.04 N ATOM 1111 CA ALA A 77 -6.730 1.568 -11.210 1.00 51.10 C ATOM 1112 C ALA A 77 -7.303 0.216 -11.624 1.00 1.14 C ATOM 1113 O ALA A 77 -8.186 0.142 -12.477 1.00 52.32 O ATOM 1114 CB ALA A 77 -7.135 1.900 -9.781 1.00 54.05 C ATOM 0 H ALA A 77 -7.801 2.310 -12.853 1.00 34.04 H new ATOM 0 HA ALA A 77 -5.643 1.505 -11.262 1.00 51.10 H new ATOM 0 HB1 ALA A 77 -6.803 1.104 -9.114 1.00 54.05 H new ATOM 0 HB2 ALA A 77 -6.673 2.841 -9.481 1.00 54.05 H new ATOM 0 HB3 ALA A 77 -8.219 1.993 -9.723 1.00 54.05 H new ATOM 1120 N GLU A 78 -6.792 -0.849 -11.015 1.00 11.32 N ATOM 1121 CA GLU A 78 -7.253 -2.198 -11.322 1.00 70.34 C ATOM 1122 C GLU A 78 -6.456 -3.236 -10.539 1.00 24.52 C ATOM 1123 O GLU A 78 -5.228 -3.174 -10.474 1.00 11.41 O ATOM 1124 CB GLU A 78 -7.132 -2.472 -12.823 1.00 14.31 C ATOM 1125 CG GLU A 78 -8.312 -3.237 -13.398 1.00 51.25 C ATOM 1126 CD GLU A 78 -7.884 -4.378 -14.301 1.00 24.21 C ATOM 1127 OE1 GLU A 78 -6.814 -4.968 -14.043 1.00 3.14 O ATOM 1128 OE2 GLU A 78 -8.617 -4.681 -15.265 1.00 12.23 O ATOM 0 H GLU A 78 -6.059 -0.804 -10.307 1.00 11.32 H new ATOM 0 HA GLU A 78 -8.300 -2.273 -11.029 1.00 70.34 H new ATOM 0 HB2 GLU A 78 -7.033 -1.523 -13.350 1.00 14.31 H new ATOM 0 HB3 GLU A 78 -6.218 -3.037 -13.008 1.00 14.31 H new ATOM 0 HG2 GLU A 78 -8.917 -3.632 -12.582 1.00 51.25 H new ATOM 0 HG3 GLU A 78 -8.945 -2.551 -13.961 1.00 51.25 H new ATOM 1135 N ALA A 79 -7.163 -4.192 -9.944 1.00 73.15 N ATOM 1136 CA ALA A 79 -6.523 -5.246 -9.167 1.00 1.32 C ATOM 1137 C ALA A 79 -7.547 -6.022 -8.346 1.00 14.52 C ATOM 1138 O ALA A 79 -8.568 -5.473 -7.931 1.00 34.22 O ATOM 1139 CB ALA A 79 -5.454 -4.655 -8.259 1.00 61.12 C ATOM 0 H ALA A 79 -8.180 -4.258 -9.986 1.00 73.15 H new ATOM 0 HA ALA A 79 -6.052 -5.941 -9.862 1.00 1.32 H new ATOM 0 HB1 ALA A 79 -4.983 -5.453 -7.684 1.00 61.12 H new ATOM 0 HB2 ALA A 79 -4.701 -4.151 -8.864 1.00 61.12 H new ATOM 0 HB3 ALA A 79 -5.911 -3.938 -7.578 1.00 61.12 H new ATOM 1145 N ASP A 80 -7.268 -7.300 -8.116 1.00 51.31 N ATOM 1146 CA ASP A 80 -8.166 -8.151 -7.344 1.00 63.52 C ATOM 1147 C ASP A 80 -8.676 -7.421 -6.105 1.00 22.25 C ATOM 1148 O ASP A 80 -9.812 -7.625 -5.675 1.00 64.24 O ATOM 1149 CB ASP A 80 -7.453 -9.441 -6.934 1.00 42.13 C ATOM 1150 CG ASP A 80 -7.357 -10.436 -8.074 1.00 23.32 C ATOM 1151 OD1 ASP A 80 -8.392 -11.043 -8.419 1.00 64.22 O ATOM 1152 OD2 ASP A 80 -6.247 -10.609 -8.619 1.00 44.31 O ATOM 0 H ASP A 80 -6.427 -7.770 -8.453 1.00 51.31 H new ATOM 0 HA ASP A 80 -9.020 -8.401 -7.973 1.00 63.52 H new ATOM 0 HB2 ASP A 80 -6.451 -9.202 -6.579 1.00 42.13 H new ATOM 0 HB3 ASP A 80 -7.986 -9.898 -6.100 1.00 42.13 H new ATOM 1157 N PHE A 81 -7.829 -6.572 -5.535 1.00 3.34 N ATOM 1158 CA PHE A 81 -8.192 -5.813 -4.344 1.00 12.24 C ATOM 1159 C PHE A 81 -7.801 -4.345 -4.493 1.00 33.12 C ATOM 1160 O PHE A 81 -6.649 -4.024 -4.785 1.00 30.34 O ATOM 1161 CB PHE A 81 -7.517 -6.409 -3.107 1.00 63.34 C ATOM 1162 CG PHE A 81 -7.923 -7.827 -2.827 1.00 75.25 C ATOM 1163 CD1 PHE A 81 -9.100 -8.104 -2.152 1.00 11.34 C ATOM 1164 CD2 PHE A 81 -7.127 -8.884 -3.240 1.00 11.04 C ATOM 1165 CE1 PHE A 81 -9.478 -9.408 -1.892 1.00 42.24 C ATOM 1166 CE2 PHE A 81 -7.500 -10.191 -2.984 1.00 44.23 C ATOM 1167 CZ PHE A 81 -8.676 -10.453 -2.308 1.00 62.14 C ATOM 0 H PHE A 81 -6.886 -6.392 -5.878 1.00 3.34 H new ATOM 0 HA PHE A 81 -9.274 -5.872 -4.223 1.00 12.24 H new ATOM 0 HB2 PHE A 81 -6.436 -6.368 -3.238 1.00 63.34 H new ATOM 0 HB3 PHE A 81 -7.756 -5.793 -2.240 1.00 63.34 H new ATOM 0 HD1 PHE A 81 -9.731 -7.291 -1.824 1.00 11.34 H new ATOM 0 HD2 PHE A 81 -6.206 -8.685 -3.767 1.00 11.04 H new ATOM 0 HE1 PHE A 81 -10.399 -9.609 -1.365 1.00 42.24 H new ATOM 0 HE2 PHE A 81 -6.872 -11.006 -3.312 1.00 44.23 H new ATOM 0 HZ PHE A 81 -8.968 -11.473 -2.105 1.00 62.14 H new ATOM 1177 N VAL A 82 -8.769 -3.457 -4.292 1.00 35.01 N ATOM 1178 CA VAL A 82 -8.528 -2.023 -4.403 1.00 21.54 C ATOM 1179 C VAL A 82 -9.085 -1.278 -3.196 1.00 43.50 C ATOM 1180 O VAL A 82 -10.219 -1.512 -2.777 1.00 11.01 O ATOM 1181 CB VAL A 82 -9.157 -1.446 -5.685 1.00 33.55 C ATOM 1182 CG1 VAL A 82 -9.014 0.068 -5.715 1.00 65.14 C ATOM 1183 CG2 VAL A 82 -8.527 -2.076 -6.918 1.00 3.04 C ATOM 0 H VAL A 82 -9.729 -3.705 -4.051 1.00 35.01 H new ATOM 0 HA VAL A 82 -7.448 -1.885 -4.444 1.00 21.54 H new ATOM 0 HB VAL A 82 -10.220 -1.686 -5.687 1.00 33.55 H new ATOM 0 HG11 VAL A 82 -9.464 0.458 -6.628 1.00 65.14 H new ATOM 0 HG12 VAL A 82 -9.518 0.498 -4.850 1.00 65.14 H new ATOM 0 HG13 VAL A 82 -7.957 0.334 -5.689 1.00 65.14 H new ATOM 0 HG21 VAL A 82 -8.984 -1.657 -7.814 1.00 3.04 H new ATOM 0 HG22 VAL A 82 -7.457 -1.870 -6.925 1.00 3.04 H new ATOM 0 HG23 VAL A 82 -8.689 -3.154 -6.899 1.00 3.04 H new ATOM 1193 N ILE A 83 -8.280 -0.378 -2.641 1.00 11.13 N ATOM 1194 CA ILE A 83 -8.693 0.405 -1.483 1.00 24.44 C ATOM 1195 C ILE A 83 -8.445 1.893 -1.707 1.00 61.34 C ATOM 1196 O ILE A 83 -7.328 2.305 -2.018 1.00 12.13 O ATOM 1197 CB ILE A 83 -7.951 -0.041 -0.208 1.00 41.45 C ATOM 1198 CG1 ILE A 83 -8.050 -1.559 -0.039 1.00 43.42 C ATOM 1199 CG2 ILE A 83 -8.516 0.672 1.011 1.00 55.24 C ATOM 1200 CD1 ILE A 83 -6.981 -2.137 0.862 1.00 43.31 C ATOM 0 H ILE A 83 -7.338 -0.173 -2.975 1.00 11.13 H new ATOM 0 HA ILE A 83 -9.761 0.233 -1.352 1.00 24.44 H new ATOM 0 HB ILE A 83 -6.899 0.227 -0.305 1.00 41.45 H new ATOM 0 HG12 ILE A 83 -9.030 -1.808 0.367 1.00 43.42 H new ATOM 0 HG13 ILE A 83 -7.982 -2.031 -1.019 1.00 43.42 H new ATOM 0 HG21 ILE A 83 -7.981 0.346 1.903 1.00 55.24 H new ATOM 0 HG22 ILE A 83 -8.398 1.749 0.890 1.00 55.24 H new ATOM 0 HG23 ILE A 83 -9.574 0.433 1.114 1.00 55.24 H new ATOM 0 HD11 ILE A 83 -7.112 -3.217 0.936 1.00 43.31 H new ATOM 0 HD12 ILE A 83 -5.997 -1.919 0.446 1.00 43.31 H new ATOM 0 HD13 ILE A 83 -7.062 -1.693 1.854 1.00 43.31 H new ATOM 1212 N GLU A 84 -9.494 2.693 -1.545 1.00 42.34 N ATOM 1213 CA GLU A 84 -9.389 4.135 -1.731 1.00 12.05 C ATOM 1214 C GLU A 84 -9.671 4.873 -0.424 1.00 42.33 C ATOM 1215 O GLU A 84 -10.598 4.529 0.307 1.00 31.43 O ATOM 1216 CB GLU A 84 -10.361 4.605 -2.815 1.00 10.22 C ATOM 1217 CG GLU A 84 -10.557 6.112 -2.846 1.00 23.23 C ATOM 1218 CD GLU A 84 -11.039 6.610 -4.194 1.00 63.13 C ATOM 1219 OE1 GLU A 84 -11.817 5.886 -4.849 1.00 13.01 O ATOM 1220 OE2 GLU A 84 -10.638 7.723 -4.594 1.00 22.32 O ATOM 0 H GLU A 84 -10.425 2.367 -1.286 1.00 42.34 H new ATOM 0 HA GLU A 84 -8.370 4.362 -2.045 1.00 12.05 H new ATOM 0 HB2 GLU A 84 -9.995 4.275 -3.787 1.00 10.22 H new ATOM 0 HB3 GLU A 84 -11.327 4.125 -2.658 1.00 10.22 H new ATOM 0 HG2 GLU A 84 -11.277 6.397 -2.079 1.00 23.23 H new ATOM 0 HG3 GLU A 84 -9.616 6.602 -2.597 1.00 23.23 H new ATOM 1227 N ALA A 85 -8.863 5.890 -0.140 1.00 21.53 N ATOM 1228 CA ALA A 85 -9.025 6.676 1.076 1.00 51.42 C ATOM 1229 C ALA A 85 -8.305 8.015 0.963 1.00 4.13 C ATOM 1230 O ALA A 85 -7.505 8.226 0.051 1.00 54.33 O ATOM 1231 CB ALA A 85 -8.515 5.900 2.281 1.00 65.33 C ATOM 0 H ALA A 85 -8.090 6.188 -0.736 1.00 21.53 H new ATOM 0 HA ALA A 85 -10.088 6.874 1.211 1.00 51.42 H new ATOM 0 HB1 ALA A 85 -8.643 6.501 3.181 1.00 65.33 H new ATOM 0 HB2 ALA A 85 -9.078 4.972 2.381 1.00 65.33 H new ATOM 0 HB3 ALA A 85 -7.458 5.670 2.145 1.00 65.33 H new ATOM 1237 N ASP A 86 -8.592 8.917 1.896 1.00 33.33 N ATOM 1238 CA ASP A 86 -7.970 10.236 1.902 1.00 74.13 C ATOM 1239 C ASP A 86 -6.467 10.127 2.140 1.00 13.21 C ATOM 1240 O ASP A 86 -6.023 9.469 3.081 1.00 32.32 O ATOM 1241 CB ASP A 86 -8.607 11.119 2.976 1.00 44.13 C ATOM 1242 CG ASP A 86 -10.066 11.417 2.690 1.00 23.01 C ATOM 1243 OD1 ASP A 86 -10.730 10.574 2.051 1.00 60.13 O ATOM 1244 OD2 ASP A 86 -10.545 12.491 3.108 1.00 50.34 O ATOM 0 H ASP A 86 -9.252 8.758 2.658 1.00 33.33 H new ATOM 0 HA ASP A 86 -8.133 10.692 0.925 1.00 74.13 H new ATOM 0 HB2 ASP A 86 -8.523 10.626 3.944 1.00 44.13 H new ATOM 0 HB3 ASP A 86 -8.055 12.056 3.046 1.00 44.13 H new ATOM 1249 N LEU A 87 -5.688 10.777 1.281 1.00 14.22 N ATOM 1250 CA LEU A 87 -4.235 10.753 1.398 1.00 24.42 C ATOM 1251 C LEU A 87 -3.804 10.845 2.858 1.00 64.22 C ATOM 1252 O LEU A 87 -2.999 10.043 3.330 1.00 71.44 O ATOM 1253 CB LEU A 87 -3.621 11.904 0.599 1.00 10.32 C ATOM 1254 CG LEU A 87 -2.117 12.116 0.777 1.00 10.22 C ATOM 1255 CD1 LEU A 87 -1.344 10.902 0.285 1.00 55.31 C ATOM 1256 CD2 LEU A 87 -1.665 13.371 0.044 1.00 72.25 C ATOM 0 H LEU A 87 -6.039 11.327 0.497 1.00 14.22 H new ATOM 0 HA LEU A 87 -3.878 9.806 0.993 1.00 24.42 H new ATOM 0 HB2 LEU A 87 -3.821 11.733 -0.459 1.00 10.32 H new ATOM 0 HB3 LEU A 87 -4.133 12.826 0.875 1.00 10.32 H new ATOM 0 HG LEU A 87 -1.911 12.245 1.840 1.00 10.22 H new ATOM 0 HD11 LEU A 87 -0.276 11.072 0.420 1.00 55.31 H new ATOM 0 HD12 LEU A 87 -1.646 10.023 0.854 1.00 55.31 H new ATOM 0 HD13 LEU A 87 -1.555 10.740 -0.772 1.00 55.31 H new ATOM 0 HD21 LEU A 87 -0.592 13.506 0.182 1.00 72.25 H new ATOM 0 HD22 LEU A 87 -1.885 13.271 -1.019 1.00 72.25 H new ATOM 0 HD23 LEU A 87 -2.194 14.236 0.444 1.00 72.25 H new ATOM 1268 N ALA A 88 -4.347 11.827 3.570 1.00 42.53 N ATOM 1269 CA ALA A 88 -4.023 12.021 4.977 1.00 3.22 C ATOM 1270 C ALA A 88 -4.046 10.697 5.733 1.00 24.04 C ATOM 1271 O ALA A 88 -3.138 10.396 6.509 1.00 62.11 O ATOM 1272 CB ALA A 88 -4.989 13.011 5.610 1.00 61.40 C ATOM 0 H ALA A 88 -5.014 12.501 3.194 1.00 42.53 H new ATOM 0 HA ALA A 88 -3.013 12.427 5.039 1.00 3.22 H new ATOM 0 HB1 ALA A 88 -4.735 13.146 6.661 1.00 61.40 H new ATOM 0 HB2 ALA A 88 -4.919 13.968 5.094 1.00 61.40 H new ATOM 0 HB3 ALA A 88 -6.007 12.629 5.529 1.00 61.40 H new ATOM 1278 N THR A 89 -5.091 9.908 5.504 1.00 1.11 N ATOM 1279 CA THR A 89 -5.234 8.618 6.166 1.00 61.53 C ATOM 1280 C THR A 89 -4.133 7.655 5.735 1.00 73.53 C ATOM 1281 O THR A 89 -3.495 7.014 6.570 1.00 63.33 O ATOM 1282 CB THR A 89 -6.604 7.980 5.864 1.00 12.42 C ATOM 1283 OG1 THR A 89 -7.649 8.930 6.106 1.00 52.21 O ATOM 1284 CG2 THR A 89 -6.826 6.745 6.723 1.00 31.41 C ATOM 0 H THR A 89 -5.851 10.140 4.865 1.00 1.11 H new ATOM 0 HA THR A 89 -5.155 8.802 7.237 1.00 61.53 H new ATOM 0 HB THR A 89 -6.619 7.681 4.816 1.00 12.42 H new ATOM 0 HG1 THR A 89 -8.517 8.519 5.910 1.00 52.21 H new ATOM 0 HG21 THR A 89 -7.799 6.312 6.493 1.00 31.41 H new ATOM 0 HG22 THR A 89 -6.045 6.013 6.517 1.00 31.41 H new ATOM 0 HG23 THR A 89 -6.793 7.024 7.776 1.00 31.41 H new ATOM 1292 N TRP A 90 -3.916 7.558 4.428 1.00 20.11 N ATOM 1293 CA TRP A 90 -2.891 6.673 3.888 1.00 61.34 C ATOM 1294 C TRP A 90 -1.540 6.943 4.539 1.00 62.00 C ATOM 1295 O TRP A 90 -0.897 6.029 5.056 1.00 45.13 O ATOM 1296 CB TRP A 90 -2.785 6.848 2.372 1.00 43.04 C ATOM 1297 CG TRP A 90 -3.862 6.133 1.614 1.00 13.42 C ATOM 1298 CD1 TRP A 90 -4.746 6.685 0.731 1.00 21.22 C ATOM 1299 CD2 TRP A 90 -4.170 4.737 1.675 1.00 70.12 C ATOM 1300 NE1 TRP A 90 -5.585 5.715 0.239 1.00 73.31 N ATOM 1301 CE2 TRP A 90 -5.252 4.511 0.801 1.00 71.04 C ATOM 1302 CE3 TRP A 90 -3.636 3.655 2.379 1.00 70.31 C ATOM 1303 CZ2 TRP A 90 -5.809 3.247 0.617 1.00 44.42 C ATOM 1304 CZ3 TRP A 90 -4.190 2.402 2.195 1.00 3.21 C ATOM 1305 CH2 TRP A 90 -5.266 2.206 1.320 1.00 71.02 C ATOM 0 H TRP A 90 -4.436 8.081 3.723 1.00 20.11 H new ATOM 0 HA TRP A 90 -3.180 5.646 4.109 1.00 61.34 H new ATOM 0 HB2 TRP A 90 -2.827 7.911 2.133 1.00 43.04 H new ATOM 0 HB3 TRP A 90 -1.813 6.484 2.039 1.00 43.04 H new ATOM 0 HD1 TRP A 90 -4.780 7.730 0.460 1.00 21.22 H new ATOM 0 HE1 TRP A 90 -6.335 5.867 -0.436 1.00 73.31 H new ATOM 0 HE3 TRP A 90 -2.805 3.795 3.055 1.00 70.31 H new ATOM 0 HZ2 TRP A 90 -6.640 3.094 -0.056 1.00 44.42 H new ATOM 0 HZ3 TRP A 90 -3.786 1.559 2.736 1.00 3.21 H new ATOM 0 HH2 TRP A 90 -5.675 1.214 1.198 1.00 71.02 H new ATOM 1316 N GLN A 91 -1.115 8.202 4.512 1.00 0.15 N ATOM 1317 CA GLN A 91 0.160 8.590 5.101 1.00 44.54 C ATOM 1318 C GLN A 91 0.340 7.960 6.477 1.00 31.11 C ATOM 1319 O GLN A 91 1.309 7.240 6.718 1.00 3.43 O ATOM 1320 CB GLN A 91 0.253 10.114 5.209 1.00 24.44 C ATOM 1321 CG GLN A 91 0.156 10.826 3.870 1.00 40.04 C ATOM 1322 CD GLN A 91 0.639 12.261 3.935 1.00 45.40 C ATOM 1323 OE1 GLN A 91 1.127 12.718 4.969 1.00 31.44 O ATOM 1324 NE2 GLN A 91 0.506 12.983 2.828 1.00 72.51 N ATOM 0 H GLN A 91 -1.635 8.970 4.088 1.00 0.15 H new ATOM 0 HA GLN A 91 0.956 8.229 4.450 1.00 44.54 H new ATOM 0 HB2 GLN A 91 -0.544 10.473 5.860 1.00 24.44 H new ATOM 0 HB3 GLN A 91 1.197 10.379 5.684 1.00 24.44 H new ATOM 0 HG2 GLN A 91 0.744 10.282 3.130 1.00 40.04 H new ATOM 0 HG3 GLN A 91 -0.879 10.810 3.529 1.00 40.04 H new ATOM 0 HE21 GLN A 91 0.096 12.565 1.993 1.00 72.51 H new ATOM 0 HE22 GLN A 91 0.814 13.955 2.813 1.00 72.51 H new ATOM 1333 N GLU A 92 -0.600 8.234 7.376 1.00 71.43 N ATOM 1334 CA GLU A 92 -0.544 7.693 8.729 1.00 73.15 C ATOM 1335 C GLU A 92 -0.049 6.249 8.718 1.00 42.21 C ATOM 1336 O GLU A 92 0.923 5.909 9.392 1.00 50.12 O ATOM 1337 CB GLU A 92 -1.923 7.766 9.389 1.00 21.32 C ATOM 1338 CG GLU A 92 -2.657 9.068 9.122 1.00 15.31 C ATOM 1339 CD GLU A 92 -3.355 9.608 10.356 1.00 1.31 C ATOM 1340 OE1 GLU A 92 -2.667 9.849 11.370 1.00 21.31 O ATOM 1341 OE2 GLU A 92 -4.590 9.790 10.307 1.00 44.14 O ATOM 0 H GLU A 92 -1.409 8.827 7.192 1.00 71.43 H new ATOM 0 HA GLU A 92 0.159 8.295 9.305 1.00 73.15 H new ATOM 0 HB2 GLU A 92 -2.532 6.936 9.032 1.00 21.32 H new ATOM 0 HB3 GLU A 92 -1.809 7.637 10.465 1.00 21.32 H new ATOM 0 HG2 GLU A 92 -1.949 9.811 8.755 1.00 15.31 H new ATOM 0 HG3 GLU A 92 -3.392 8.911 8.333 1.00 15.31 H new ATOM 1348 N VAL A 93 -0.726 5.404 7.947 1.00 63.45 N ATOM 1349 CA VAL A 93 -0.355 3.997 7.846 1.00 12.12 C ATOM 1350 C VAL A 93 1.118 3.841 7.486 1.00 61.02 C ATOM 1351 O VAL A 93 1.859 3.120 8.154 1.00 1.04 O ATOM 1352 CB VAL A 93 -1.210 3.266 6.794 1.00 22.40 C ATOM 1353 CG1 VAL A 93 -0.796 1.806 6.692 1.00 62.24 C ATOM 1354 CG2 VAL A 93 -2.688 3.387 7.131 1.00 22.32 C ATOM 0 H VAL A 93 -1.534 5.669 7.383 1.00 63.45 H new ATOM 0 HA VAL A 93 -0.535 3.551 8.824 1.00 12.12 H new ATOM 0 HB VAL A 93 -1.043 3.736 5.825 1.00 22.40 H new ATOM 0 HG11 VAL A 93 -1.411 1.305 5.944 1.00 62.24 H new ATOM 0 HG12 VAL A 93 0.252 1.745 6.400 1.00 62.24 H new ATOM 0 HG13 VAL A 93 -0.933 1.321 7.658 1.00 62.24 H new ATOM 0 HG21 VAL A 93 -3.277 2.865 6.377 1.00 22.32 H new ATOM 0 HG22 VAL A 93 -2.876 2.944 8.109 1.00 22.32 H new ATOM 0 HG23 VAL A 93 -2.972 4.439 7.149 1.00 22.32 H new ATOM 1364 N LEU A 94 1.537 4.522 6.424 1.00 32.21 N ATOM 1365 CA LEU A 94 2.923 4.459 5.974 1.00 12.34 C ATOM 1366 C LEU A 94 3.878 4.862 7.093 1.00 32.24 C ATOM 1367 O LEU A 94 4.957 4.289 7.237 1.00 34.25 O ATOM 1368 CB LEU A 94 3.128 5.370 4.762 1.00 41.53 C ATOM 1369 CG LEU A 94 3.596 4.684 3.478 1.00 10.21 C ATOM 1370 CD1 LEU A 94 4.955 4.034 3.687 1.00 44.15 C ATOM 1371 CD2 LEU A 94 2.574 3.653 3.021 1.00 4.42 C ATOM 0 H LEU A 94 0.937 5.123 5.859 1.00 32.21 H new ATOM 0 HA LEU A 94 3.140 3.430 5.689 1.00 12.34 H new ATOM 0 HB2 LEU A 94 2.188 5.882 4.555 1.00 41.53 H new ATOM 0 HB3 LEU A 94 3.857 6.136 5.027 1.00 41.53 H new ATOM 0 HG LEU A 94 3.693 5.440 2.699 1.00 10.21 H new ATOM 0 HD11 LEU A 94 5.273 3.550 2.763 1.00 44.15 H new ATOM 0 HD12 LEU A 94 5.683 4.795 3.967 1.00 44.15 H new ATOM 0 HD13 LEU A 94 4.884 3.290 4.480 1.00 44.15 H new ATOM 0 HD21 LEU A 94 2.924 3.175 2.106 1.00 4.42 H new ATOM 0 HD22 LEU A 94 2.445 2.899 3.798 1.00 4.42 H new ATOM 0 HD23 LEU A 94 1.620 4.145 2.831 1.00 4.42 H new ATOM 1383 N GLU A 95 3.471 5.850 7.885 1.00 71.32 N ATOM 1384 CA GLU A 95 4.291 6.327 8.993 1.00 54.42 C ATOM 1385 C GLU A 95 4.410 5.262 10.079 1.00 1.41 C ATOM 1386 O GLU A 95 5.341 5.283 10.883 1.00 61.52 O ATOM 1387 CB GLU A 95 3.695 7.608 9.581 1.00 24.14 C ATOM 1388 CG GLU A 95 4.028 8.857 8.782 1.00 74.15 C ATOM 1389 CD GLU A 95 4.267 10.067 9.664 1.00 43.15 C ATOM 1390 OE1 GLU A 95 3.381 10.392 10.481 1.00 42.14 O ATOM 1391 OE2 GLU A 95 5.344 10.689 9.536 1.00 72.23 O ATOM 0 H GLU A 95 2.580 6.335 7.780 1.00 71.32 H new ATOM 0 HA GLU A 95 5.288 6.542 8.609 1.00 54.42 H new ATOM 0 HB2 GLU A 95 2.612 7.502 9.638 1.00 24.14 H new ATOM 0 HB3 GLU A 95 4.058 7.732 10.601 1.00 24.14 H new ATOM 0 HG2 GLU A 95 4.916 8.671 8.178 1.00 74.15 H new ATOM 0 HG3 GLU A 95 3.212 9.071 8.092 1.00 74.15 H new ATOM 1398 N GLY A 96 3.460 4.332 10.096 1.00 55.21 N ATOM 1399 CA GLY A 96 3.476 3.273 11.087 1.00 13.21 C ATOM 1400 C GLY A 96 2.523 3.538 12.235 1.00 54.41 C ATOM 1401 O GLY A 96 2.079 2.609 12.910 1.00 71.44 O ATOM 0 H GLY A 96 2.679 4.294 9.441 1.00 55.21 H new ATOM 0 HA2 GLY A 96 3.211 2.329 10.610 1.00 13.21 H new ATOM 0 HA3 GLY A 96 4.487 3.160 11.477 1.00 13.21 H new ATOM 1405 N ARG A 97 2.206 4.810 12.458 1.00 43.23 N ATOM 1406 CA ARG A 97 1.301 5.195 13.534 1.00 40.32 C ATOM 1407 C ARG A 97 -0.059 4.524 13.367 1.00 42.22 C ATOM 1408 O ARG A 97 -0.658 4.060 14.338 1.00 54.03 O ATOM 1409 CB ARG A 97 1.132 6.715 13.567 1.00 12.40 C ATOM 1410 CG ARG A 97 2.429 7.468 13.813 1.00 71.31 C ATOM 1411 CD ARG A 97 2.308 8.416 14.995 1.00 51.42 C ATOM 1412 NE ARG A 97 2.984 9.687 14.748 1.00 15.25 N ATOM 1413 CZ ARG A 97 2.835 10.760 15.518 1.00 34.20 C ATOM 1414 NH1 ARG A 97 2.039 10.715 16.578 1.00 61.44 N ATOM 1415 NH2 ARG A 97 3.484 11.881 15.228 1.00 73.44 N ATOM 0 H ARG A 97 2.563 5.591 11.907 1.00 43.23 H new ATOM 0 HA ARG A 97 1.736 4.864 14.477 1.00 40.32 H new ATOM 0 HB2 ARG A 97 0.704 7.045 12.620 1.00 12.40 H new ATOM 0 HB3 ARG A 97 0.417 6.976 14.348 1.00 12.40 H new ATOM 0 HG2 ARG A 97 3.234 6.757 13.997 1.00 71.31 H new ATOM 0 HG3 ARG A 97 2.699 8.031 12.920 1.00 71.31 H new ATOM 0 HD2 ARG A 97 1.255 8.601 15.205 1.00 51.42 H new ATOM 0 HD3 ARG A 97 2.733 7.946 15.882 1.00 51.42 H new ATOM 0 HE ARG A 97 3.604 9.755 13.941 1.00 15.25 H new ATOM 0 HH11 ARG A 97 1.539 9.855 16.804 1.00 61.44 H new ATOM 0 HH12 ARG A 97 1.927 11.540 17.167 1.00 61.44 H new ATOM 0 HH21 ARG A 97 4.097 11.919 14.414 1.00 73.44 H new ATOM 0 HH22 ARG A 97 3.369 12.704 15.819 1.00 73.44 H new ATOM 1429 N LEU A 98 -0.541 4.477 12.129 1.00 11.11 N ATOM 1430 CA LEU A 98 -1.831 3.864 11.834 1.00 51.14 C ATOM 1431 C LEU A 98 -1.649 2.460 11.267 1.00 34.34 C ATOM 1432 O LEU A 98 -0.528 2.028 11.000 1.00 12.40 O ATOM 1433 CB LEU A 98 -2.614 4.728 10.844 1.00 73.10 C ATOM 1434 CG LEU A 98 -3.716 5.603 11.443 1.00 12.22 C ATOM 1435 CD1 LEU A 98 -4.911 4.755 11.848 1.00 34.23 C ATOM 1436 CD2 LEU A 98 -3.186 6.387 12.636 1.00 61.44 C ATOM 0 H LEU A 98 -0.058 4.856 11.315 1.00 11.11 H new ATOM 0 HA LEU A 98 -2.392 3.790 12.766 1.00 51.14 H new ATOM 0 HB2 LEU A 98 -1.910 5.374 10.320 1.00 73.10 H new ATOM 0 HB3 LEU A 98 -3.063 4.073 10.097 1.00 73.10 H new ATOM 0 HG LEU A 98 -4.042 6.313 10.683 1.00 12.22 H new ATOM 0 HD11 LEU A 98 -5.685 5.395 12.272 1.00 34.23 H new ATOM 0 HD12 LEU A 98 -5.306 4.241 10.972 1.00 34.23 H new ATOM 0 HD13 LEU A 98 -4.601 4.020 12.591 1.00 34.23 H new ATOM 0 HD21 LEU A 98 -3.984 7.004 13.049 1.00 61.44 H new ATOM 0 HD22 LEU A 98 -2.831 5.694 13.399 1.00 61.44 H new ATOM 0 HD23 LEU A 98 -2.363 7.025 12.315 1.00 61.44 H new ATOM 1448 N GLU A 99 -2.760 1.752 11.084 1.00 30.14 N ATOM 1449 CA GLU A 99 -2.722 0.397 10.547 1.00 20.45 C ATOM 1450 C GLU A 99 -3.653 0.261 9.345 1.00 13.14 C ATOM 1451 O GLU A 99 -4.725 0.865 9.288 1.00 2.00 O ATOM 1452 CB GLU A 99 -3.114 -0.614 11.626 1.00 25.33 C ATOM 1453 CG GLU A 99 -1.935 -1.385 12.196 1.00 4.45 C ATOM 1454 CD GLU A 99 -2.200 -1.909 13.594 1.00 11.21 C ATOM 1455 OE1 GLU A 99 -2.034 -1.136 14.560 1.00 64.12 O ATOM 1456 OE2 GLU A 99 -2.575 -3.093 13.720 1.00 32.33 O ATOM 0 H GLU A 99 -3.696 2.094 11.300 1.00 30.14 H new ATOM 0 HA GLU A 99 -1.703 0.192 10.220 1.00 20.45 H new ATOM 0 HB2 GLU A 99 -3.620 -0.090 12.436 1.00 25.33 H new ATOM 0 HB3 GLU A 99 -3.831 -1.320 11.207 1.00 25.33 H new ATOM 0 HG2 GLU A 99 -1.700 -2.221 11.537 1.00 4.45 H new ATOM 0 HG3 GLU A 99 -1.058 -0.738 12.215 1.00 4.45 H new ATOM 1463 N PRO A 100 -3.236 -0.550 8.363 1.00 54.02 N ATOM 1464 CA PRO A 100 -4.017 -0.785 7.145 1.00 14.43 C ATOM 1465 C PRO A 100 -5.279 -1.597 7.413 1.00 75.42 C ATOM 1466 O PRO A 100 -6.351 -1.289 6.890 1.00 52.03 O ATOM 1467 CB PRO A 100 -3.054 -1.572 6.252 1.00 42.12 C ATOM 1468 CG PRO A 100 -2.120 -2.241 7.200 1.00 3.13 C ATOM 1469 CD PRO A 100 -1.970 -1.302 8.365 1.00 14.23 C ATOM 0 HA PRO A 100 -4.368 0.146 6.700 1.00 14.43 H new ATOM 0 HB2 PRO A 100 -3.587 -2.300 5.641 1.00 42.12 H new ATOM 0 HB3 PRO A 100 -2.519 -0.912 5.568 1.00 42.12 H new ATOM 0 HG2 PRO A 100 -2.515 -3.204 7.523 1.00 3.13 H new ATOM 0 HG3 PRO A 100 -1.157 -2.434 6.728 1.00 3.13 H new ATOM 0 HD2 PRO A 100 -1.825 -1.842 9.300 1.00 14.23 H new ATOM 0 HD3 PRO A 100 -1.111 -0.643 8.242 1.00 14.23 H new ATOM 1477 N LEU A 101 -5.147 -2.636 8.231 1.00 41.22 N ATOM 1478 CA LEU A 101 -6.277 -3.492 8.569 1.00 31.33 C ATOM 1479 C LEU A 101 -7.191 -2.813 9.584 1.00 61.21 C ATOM 1480 O LEU A 101 -8.405 -2.747 9.394 1.00 12.31 O ATOM 1481 CB LEU A 101 -5.782 -4.829 9.126 1.00 40.44 C ATOM 1482 CG LEU A 101 -5.508 -5.925 8.096 1.00 2.32 C ATOM 1483 CD1 LEU A 101 -6.810 -6.550 7.622 1.00 72.32 C ATOM 1484 CD2 LEU A 101 -4.723 -5.365 6.917 1.00 4.15 C ATOM 0 H LEU A 101 -4.268 -2.905 8.672 1.00 41.22 H new ATOM 0 HA LEU A 101 -6.848 -3.674 7.658 1.00 31.33 H new ATOM 0 HB2 LEU A 101 -4.865 -4.649 9.688 1.00 40.44 H new ATOM 0 HB3 LEU A 101 -6.522 -5.201 9.835 1.00 40.44 H new ATOM 0 HG LEU A 101 -4.908 -6.701 8.571 1.00 2.32 H new ATOM 0 HD11 LEU A 101 -6.595 -7.328 6.889 1.00 72.32 H new ATOM 0 HD12 LEU A 101 -7.334 -6.987 8.472 1.00 72.32 H new ATOM 0 HD13 LEU A 101 -7.436 -5.784 7.164 1.00 72.32 H new ATOM 0 HD21 LEU A 101 -4.537 -6.159 6.194 1.00 4.15 H new ATOM 0 HD22 LEU A 101 -5.297 -4.569 6.443 1.00 4.15 H new ATOM 0 HD23 LEU A 101 -3.772 -4.965 7.270 1.00 4.15 H new ATOM 1496 N SER A 102 -6.599 -2.308 10.662 1.00 65.02 N ATOM 1497 CA SER A 102 -7.359 -1.635 11.708 1.00 44.31 C ATOM 1498 C SER A 102 -8.072 -0.405 11.154 1.00 10.32 C ATOM 1499 O SER A 102 -9.192 -0.091 11.556 1.00 3.24 O ATOM 1500 CB SER A 102 -6.436 -1.228 12.857 1.00 5.14 C ATOM 1501 OG SER A 102 -7.073 -1.405 14.111 1.00 72.30 O ATOM 0 H SER A 102 -5.594 -2.353 10.833 1.00 65.02 H new ATOM 0 HA SER A 102 -8.109 -2.331 12.083 1.00 44.31 H new ATOM 0 HB2 SER A 102 -5.523 -1.823 12.822 1.00 5.14 H new ATOM 0 HB3 SER A 102 -6.142 -0.185 12.739 1.00 5.14 H new ATOM 0 HG SER A 102 -6.461 -1.139 14.829 1.00 72.30 H new ATOM 1507 N ALA A 103 -7.415 0.286 10.229 1.00 11.44 N ATOM 1508 CA ALA A 103 -7.987 1.481 9.618 1.00 24.53 C ATOM 1509 C ALA A 103 -9.250 1.145 8.833 1.00 45.02 C ATOM 1510 O ALA A 103 -10.311 1.723 9.067 1.00 3.31 O ATOM 1511 CB ALA A 103 -6.963 2.152 8.714 1.00 24.44 C ATOM 0 H ALA A 103 -6.487 0.040 9.886 1.00 11.44 H new ATOM 0 HA ALA A 103 -8.260 2.172 10.415 1.00 24.53 H new ATOM 0 HB1 ALA A 103 -7.403 3.042 8.264 1.00 24.44 H new ATOM 0 HB2 ALA A 103 -6.090 2.436 9.301 1.00 24.44 H new ATOM 0 HB3 ALA A 103 -6.662 1.459 7.928 1.00 24.44 H new ATOM 1517 N LEU A 104 -9.128 0.207 7.899 1.00 3.32 N ATOM 1518 CA LEU A 104 -10.260 -0.206 7.078 1.00 40.12 C ATOM 1519 C LEU A 104 -11.404 -0.721 7.946 1.00 21.22 C ATOM 1520 O LEU A 104 -12.568 -0.672 7.550 1.00 0.04 O ATOM 1521 CB LEU A 104 -9.829 -1.288 6.087 1.00 63.24 C ATOM 1522 CG LEU A 104 -10.115 -2.732 6.503 1.00 14.11 C ATOM 1523 CD1 LEU A 104 -11.548 -3.111 6.163 1.00 22.05 C ATOM 1524 CD2 LEU A 104 -9.136 -3.684 5.832 1.00 23.01 C ATOM 0 H LEU A 104 -8.257 -0.281 7.692 1.00 3.32 H new ATOM 0 HA LEU A 104 -10.612 0.665 6.525 1.00 40.12 H new ATOM 0 HB2 LEU A 104 -10.326 -1.100 5.135 1.00 63.24 H new ATOM 0 HB3 LEU A 104 -8.758 -1.187 5.912 1.00 63.24 H new ATOM 0 HG LEU A 104 -9.986 -2.812 7.582 1.00 14.11 H new ATOM 0 HD11 LEU A 104 -11.733 -4.141 6.466 1.00 22.05 H new ATOM 0 HD12 LEU A 104 -12.234 -2.449 6.690 1.00 22.05 H new ATOM 0 HD13 LEU A 104 -11.705 -3.015 5.089 1.00 22.05 H new ATOM 0 HD21 LEU A 104 -9.354 -4.707 6.139 1.00 23.01 H new ATOM 0 HD22 LEU A 104 -9.233 -3.602 4.749 1.00 23.01 H new ATOM 0 HD23 LEU A 104 -8.118 -3.426 6.126 1.00 23.01 H new ATOM 1536 N MET A 105 -11.063 -1.215 9.132 1.00 11.51 N ATOM 1537 CA MET A 105 -12.062 -1.736 10.058 1.00 65.31 C ATOM 1538 C MET A 105 -12.623 -0.623 10.937 1.00 3.33 C ATOM 1539 O MET A 105 -13.778 -0.675 11.359 1.00 21.05 O ATOM 1540 CB MET A 105 -11.454 -2.835 10.932 1.00 72.11 C ATOM 1541 CG MET A 105 -11.560 -4.224 10.323 1.00 31.13 C ATOM 1542 SD MET A 105 -12.533 -5.354 11.337 1.00 1.22 S ATOM 1543 CE MET A 105 -14.033 -5.473 10.366 1.00 72.50 C ATOM 0 H MET A 105 -10.103 -1.265 9.474 1.00 11.51 H new ATOM 0 HA MET A 105 -12.879 -2.158 9.472 1.00 65.31 H new ATOM 0 HB2 MET A 105 -10.404 -2.605 11.112 1.00 72.11 H new ATOM 0 HB3 MET A 105 -11.951 -2.833 11.902 1.00 72.11 H new ATOM 0 HG2 MET A 105 -12.011 -4.149 9.334 1.00 31.13 H new ATOM 0 HG3 MET A 105 -10.559 -4.634 10.187 1.00 31.13 H new ATOM 0 HE1 MET A 105 -14.848 -5.828 10.997 1.00 72.50 H new ATOM 0 HE2 MET A 105 -14.286 -4.491 9.965 1.00 72.50 H new ATOM 0 HE3 MET A 105 -13.880 -6.172 9.544 1.00 72.50 H new ATOM 1553 N ARG A 106 -11.797 0.383 11.209 1.00 52.24 N ATOM 1554 CA ARG A 106 -12.211 1.508 12.039 1.00 64.23 C ATOM 1555 C ARG A 106 -13.197 2.401 11.293 1.00 71.13 C ATOM 1556 O ARG A 106 -13.908 3.200 11.899 1.00 13.24 O ATOM 1557 CB ARG A 106 -10.991 2.326 12.471 1.00 71.41 C ATOM 1558 CG ARG A 106 -10.312 1.791 13.721 1.00 63.02 C ATOM 1559 CD ARG A 106 -9.304 2.786 14.275 1.00 64.32 C ATOM 1560 NE ARG A 106 -9.827 3.509 15.430 1.00 2.35 N ATOM 1561 CZ ARG A 106 -9.058 4.122 16.324 1.00 4.12 C ATOM 1562 NH1 ARG A 106 -7.739 4.100 16.195 1.00 44.05 N ATOM 1563 NH2 ARG A 106 -9.609 4.760 17.349 1.00 23.02 N ATOM 0 H ARG A 106 -10.838 0.442 10.867 1.00 52.24 H new ATOM 0 HA ARG A 106 -12.707 1.111 12.925 1.00 64.23 H new ATOM 0 HB2 ARG A 106 -10.269 2.344 11.655 1.00 71.41 H new ATOM 0 HB3 ARG A 106 -11.299 3.357 12.648 1.00 71.41 H new ATOM 0 HG2 ARG A 106 -11.064 1.572 14.479 1.00 63.02 H new ATOM 0 HG3 ARG A 106 -9.809 0.852 13.490 1.00 63.02 H new ATOM 0 HD2 ARG A 106 -8.393 2.259 14.559 1.00 64.32 H new ATOM 0 HD3 ARG A 106 -9.031 3.497 13.496 1.00 64.32 H new ATOM 0 HE ARG A 106 -10.838 3.546 15.558 1.00 2.35 H new ATOM 0 HH11 ARG A 106 -7.312 3.612 15.408 1.00 44.05 H new ATOM 0 HH12 ARG A 106 -7.151 4.571 16.883 1.00 44.05 H new ATOM 0 HH21 ARG A 106 -10.624 4.780 17.451 1.00 23.02 H new ATOM 0 HH22 ARG A 106 -9.018 5.230 18.035 1.00 23.02 H new ATOM 1577 N GLY A 107 -13.232 2.259 9.971 1.00 51.42 N ATOM 1578 CA GLY A 107 -14.134 3.060 9.163 1.00 24.34 C ATOM 1579 C GLY A 107 -13.426 4.204 8.465 1.00 21.34 C ATOM 1580 O GLY A 107 -14.009 5.269 8.256 1.00 64.44 O ATOM 0 H GLY A 107 -12.653 1.604 9.446 1.00 51.42 H new ATOM 0 HA2 GLY A 107 -14.612 2.424 8.418 1.00 24.34 H new ATOM 0 HA3 GLY A 107 -14.926 3.459 9.796 1.00 24.34 H new ATOM 1584 N LEU A 108 -12.166 3.987 8.106 1.00 41.02 N ATOM 1585 CA LEU A 108 -11.376 5.010 7.429 1.00 74.11 C ATOM 1586 C LEU A 108 -11.236 4.694 5.943 1.00 11.10 C ATOM 1587 O LEU A 108 -11.452 5.557 5.092 1.00 44.53 O ATOM 1588 CB LEU A 108 -9.992 5.121 8.071 1.00 41.02 C ATOM 1589 CG LEU A 108 -9.970 5.371 9.579 1.00 3.14 C ATOM 1590 CD1 LEU A 108 -8.552 5.259 10.118 1.00 73.10 C ATOM 1591 CD2 LEU A 108 -10.560 6.736 9.903 1.00 44.22 C ATOM 0 H LEU A 108 -11.669 3.112 8.272 1.00 41.02 H new ATOM 0 HA LEU A 108 -11.895 5.963 7.532 1.00 74.11 H new ATOM 0 HB2 LEU A 108 -9.444 4.201 7.867 1.00 41.02 H new ATOM 0 HB3 LEU A 108 -9.450 5.930 7.581 1.00 41.02 H new ATOM 0 HG LEU A 108 -10.582 4.610 10.063 1.00 3.14 H new ATOM 0 HD11 LEU A 108 -8.556 5.440 11.193 1.00 73.10 H new ATOM 0 HD12 LEU A 108 -8.165 4.259 9.920 1.00 73.10 H new ATOM 0 HD13 LEU A 108 -7.917 5.997 9.628 1.00 73.10 H new ATOM 0 HD21 LEU A 108 -10.536 6.896 10.981 1.00 44.22 H new ATOM 0 HD22 LEU A 108 -9.976 7.512 9.408 1.00 44.22 H new ATOM 0 HD23 LEU A 108 -11.591 6.779 9.553 1.00 44.22 H new ATOM 1603 N LEU A 109 -10.875 3.453 5.638 1.00 33.45 N ATOM 1604 CA LEU A 109 -10.709 3.022 4.255 1.00 44.24 C ATOM 1605 C LEU A 109 -11.988 2.380 3.727 1.00 42.45 C ATOM 1606 O LEU A 109 -13.006 2.345 4.417 1.00 60.10 O ATOM 1607 CB LEU A 109 -9.546 2.035 4.144 1.00 21.24 C ATOM 1608 CG LEU A 109 -8.346 2.306 5.052 1.00 52.22 C ATOM 1609 CD1 LEU A 109 -7.444 1.084 5.123 1.00 33.44 C ATOM 1610 CD2 LEU A 109 -7.568 3.517 4.559 1.00 4.11 C ATOM 0 H LEU A 109 -10.691 2.727 6.330 1.00 33.45 H new ATOM 0 HA LEU A 109 -10.490 3.902 3.650 1.00 44.24 H new ATOM 0 HB2 LEU A 109 -9.922 1.035 4.362 1.00 21.24 H new ATOM 0 HB3 LEU A 109 -9.200 2.027 3.111 1.00 21.24 H new ATOM 0 HG LEU A 109 -8.714 2.519 6.056 1.00 52.22 H new ATOM 0 HD11 LEU A 109 -6.595 1.295 5.774 1.00 33.44 H new ATOM 0 HD12 LEU A 109 -8.006 0.240 5.522 1.00 33.44 H new ATOM 0 HD13 LEU A 109 -7.083 0.840 4.124 1.00 33.44 H new ATOM 0 HD21 LEU A 109 -6.717 3.695 5.217 1.00 4.11 H new ATOM 0 HD22 LEU A 109 -7.211 3.332 3.546 1.00 4.11 H new ATOM 0 HD23 LEU A 109 -8.218 4.392 4.561 1.00 4.11 H new ATOM 1622 N GLU A 110 -11.927 1.875 2.498 1.00 24.55 N ATOM 1623 CA GLU A 110 -13.080 1.233 1.879 1.00 20.34 C ATOM 1624 C GLU A 110 -12.660 0.420 0.658 1.00 33.21 C ATOM 1625 O GLU A 110 -12.449 0.969 -0.425 1.00 12.10 O ATOM 1626 CB GLU A 110 -14.119 2.282 1.475 1.00 33.44 C ATOM 1627 CG GLU A 110 -15.538 1.743 1.421 1.00 70.15 C ATOM 1628 CD GLU A 110 -16.572 2.839 1.249 1.00 54.33 C ATOM 1629 OE1 GLU A 110 -16.582 3.482 0.177 1.00 23.20 O ATOM 1630 OE2 GLU A 110 -17.371 3.054 2.184 1.00 42.30 O ATOM 0 H GLU A 110 -11.092 1.898 1.913 1.00 24.55 H new ATOM 0 HA GLU A 110 -13.523 0.556 2.609 1.00 20.34 H new ATOM 0 HB2 GLU A 110 -14.081 3.110 2.182 1.00 33.44 H new ATOM 0 HB3 GLU A 110 -13.855 2.685 0.497 1.00 33.44 H new ATOM 0 HG2 GLU A 110 -15.623 1.036 0.596 1.00 70.15 H new ATOM 0 HG3 GLU A 110 -15.748 1.191 2.337 1.00 70.15 H new ATOM 1637 N LEU A 111 -12.541 -0.890 0.839 1.00 23.45 N ATOM 1638 CA LEU A 111 -12.145 -1.781 -0.247 1.00 1.41 C ATOM 1639 C LEU A 111 -13.255 -1.897 -1.287 1.00 23.34 C ATOM 1640 O LEU A 111 -14.278 -2.538 -1.048 1.00 53.23 O ATOM 1641 CB LEU A 111 -11.798 -3.165 0.304 1.00 44.24 C ATOM 1642 CG LEU A 111 -11.312 -4.191 -0.721 1.00 75.24 C ATOM 1643 CD1 LEU A 111 -9.798 -4.142 -0.850 1.00 30.01 C ATOM 1644 CD2 LEU A 111 -11.771 -5.590 -0.334 1.00 34.01 C ATOM 0 H LEU A 111 -12.713 -1.360 1.728 1.00 23.45 H new ATOM 0 HA LEU A 111 -11.264 -1.358 -0.729 1.00 1.41 H new ATOM 0 HB2 LEU A 111 -11.027 -3.048 1.066 1.00 44.24 H new ATOM 0 HB3 LEU A 111 -12.680 -3.568 0.802 1.00 44.24 H new ATOM 0 HG LEU A 111 -11.746 -3.942 -1.689 1.00 75.24 H new ATOM 0 HD11 LEU A 111 -9.471 -4.879 -1.584 1.00 30.01 H new ATOM 0 HD12 LEU A 111 -9.492 -3.147 -1.174 1.00 30.01 H new ATOM 0 HD13 LEU A 111 -9.343 -4.365 0.115 1.00 30.01 H new ATOM 0 HD21 LEU A 111 -11.416 -6.307 -1.074 1.00 34.01 H new ATOM 0 HD22 LEU A 111 -11.366 -5.848 0.644 1.00 34.01 H new ATOM 0 HD23 LEU A 111 -12.860 -5.618 -0.295 1.00 34.01 H new ATOM 1656 N LYS A 112 -13.044 -1.275 -2.442 1.00 1.14 N ATOM 1657 CA LYS A 112 -14.024 -1.311 -3.520 1.00 1.52 C ATOM 1658 C LYS A 112 -14.015 -2.667 -4.219 1.00 11.31 C ATOM 1659 O LYS A 112 -15.068 -3.232 -4.514 1.00 63.22 O ATOM 1660 CB LYS A 112 -13.738 -0.201 -4.534 1.00 31.02 C ATOM 1661 CG LYS A 112 -14.474 1.096 -4.241 1.00 31.52 C ATOM 1662 CD LYS A 112 -14.999 1.738 -5.514 1.00 51.21 C ATOM 1663 CE LYS A 112 -13.875 2.359 -6.329 1.00 40.42 C ATOM 1664 NZ LYS A 112 -14.347 3.523 -7.128 1.00 64.12 N ATOM 0 H LYS A 112 -12.202 -0.740 -2.655 1.00 1.14 H new ATOM 0 HA LYS A 112 -15.011 -1.153 -3.085 1.00 1.52 H new ATOM 0 HB2 LYS A 112 -12.666 -0.004 -4.552 1.00 31.02 H new ATOM 0 HB3 LYS A 112 -14.015 -0.549 -5.529 1.00 31.02 H new ATOM 0 HG2 LYS A 112 -15.304 0.899 -3.562 1.00 31.52 H new ATOM 0 HG3 LYS A 112 -13.804 1.789 -3.732 1.00 31.52 H new ATOM 0 HD2 LYS A 112 -15.515 0.989 -6.115 1.00 51.21 H new ATOM 0 HD3 LYS A 112 -15.732 2.504 -5.261 1.00 51.21 H new ATOM 0 HE2 LYS A 112 -13.075 2.678 -5.661 1.00 40.42 H new ATOM 0 HE3 LYS A 112 -13.452 1.608 -6.996 1.00 40.42 H new ATOM 0 HZ1 LYS A 112 -13.552 3.918 -7.669 1.00 64.12 H new ATOM 0 HZ2 LYS A 112 -15.093 3.214 -7.784 1.00 64.12 H new ATOM 0 HZ3 LYS A 112 -14.727 4.251 -6.490 1.00 64.12 H new ATOM 1678 N LYS A 113 -12.819 -3.184 -4.479 1.00 1.01 N ATOM 1679 CA LYS A 113 -12.672 -4.475 -5.140 1.00 61.31 C ATOM 1680 C LYS A 113 -12.667 -5.611 -4.122 1.00 63.10 C ATOM 1681 O LYS A 113 -12.885 -5.391 -2.931 1.00 65.34 O ATOM 1682 CB LYS A 113 -11.380 -4.507 -5.961 1.00 73.12 C ATOM 1683 CG LYS A 113 -11.613 -4.517 -7.461 1.00 54.14 C ATOM 1684 CD LYS A 113 -11.735 -3.108 -8.016 1.00 1.40 C ATOM 1685 CE LYS A 113 -13.186 -2.652 -8.068 1.00 63.20 C ATOM 1686 NZ LYS A 113 -13.314 -1.269 -8.603 1.00 2.24 N ATOM 0 H LYS A 113 -11.938 -2.729 -4.242 1.00 1.01 H new ATOM 0 HA LYS A 113 -13.523 -4.612 -5.807 1.00 61.31 H new ATOM 0 HB2 LYS A 113 -10.773 -3.639 -5.702 1.00 73.12 H new ATOM 0 HB3 LYS A 113 -10.806 -5.391 -5.685 1.00 73.12 H new ATOM 0 HG2 LYS A 113 -10.790 -5.033 -7.955 1.00 54.14 H new ATOM 0 HG3 LYS A 113 -12.521 -5.077 -7.685 1.00 54.14 H new ATOM 0 HD2 LYS A 113 -11.159 -2.421 -7.397 1.00 1.40 H new ATOM 0 HD3 LYS A 113 -11.305 -3.072 -9.017 1.00 1.40 H new ATOM 0 HE2 LYS A 113 -13.760 -3.337 -8.692 1.00 63.20 H new ATOM 0 HE3 LYS A 113 -13.616 -2.696 -7.068 1.00 63.20 H new ATOM 0 HZ1 LYS A 113 -14.317 -0.996 -8.622 1.00 2.24 H new ATOM 0 HZ2 LYS A 113 -12.788 -0.611 -7.994 1.00 2.24 H new ATOM 0 HZ3 LYS A 113 -12.927 -1.233 -9.567 1.00 2.24 H new ATOM 1700 N GLY A 114 -12.416 -6.826 -4.598 1.00 72.53 N ATOM 1701 CA GLY A 114 -12.386 -7.978 -3.715 1.00 54.03 C ATOM 1702 C GLY A 114 -13.425 -7.891 -2.615 1.00 63.34 C ATOM 1703 O GLY A 114 -14.603 -7.647 -2.880 1.00 11.01 O ATOM 0 H GLY A 114 -12.233 -7.034 -5.580 1.00 72.53 H new ATOM 0 HA2 GLY A 114 -12.553 -8.884 -4.298 1.00 54.03 H new ATOM 0 HA3 GLY A 114 -11.395 -8.065 -3.269 1.00 54.03 H new ATOM 1707 N THR A 115 -12.990 -8.096 -1.375 1.00 40.44 N ATOM 1708 CA THR A 115 -13.891 -8.042 -0.231 1.00 32.31 C ATOM 1709 C THR A 115 -13.119 -8.122 1.081 1.00 42.01 C ATOM 1710 O THR A 115 -12.082 -8.781 1.162 1.00 3.44 O ATOM 1711 CB THR A 115 -14.924 -9.183 -0.276 1.00 61.31 C ATOM 1712 OG1 THR A 115 -16.099 -8.810 0.454 1.00 51.24 O ATOM 1713 CG2 THR A 115 -14.344 -10.462 0.309 1.00 62.52 C ATOM 0 H THR A 115 -12.019 -8.301 -1.138 1.00 40.44 H new ATOM 0 HA THR A 115 -14.413 -7.087 -0.284 1.00 32.31 H new ATOM 0 HB THR A 115 -15.186 -9.364 -1.318 1.00 61.31 H new ATOM 0 HG1 THR A 115 -16.751 -9.540 0.419 1.00 51.24 H new ATOM 0 HG21 THR A 115 -15.092 -11.254 0.266 1.00 62.52 H new ATOM 0 HG22 THR A 115 -13.467 -10.760 -0.266 1.00 62.52 H new ATOM 0 HG23 THR A 115 -14.057 -10.290 1.346 1.00 62.52 H new ATOM 1721 N ILE A 116 -13.630 -7.448 2.105 1.00 33.40 N ATOM 1722 CA ILE A 116 -12.989 -7.445 3.414 1.00 33.41 C ATOM 1723 C ILE A 116 -12.825 -8.864 3.949 1.00 32.35 C ATOM 1724 O ILE A 116 -11.879 -9.158 4.679 1.00 52.14 O ATOM 1725 CB ILE A 116 -13.792 -6.614 4.433 1.00 64.24 C ATOM 1726 CG1 ILE A 116 -12.975 -6.405 5.709 1.00 25.11 C ATOM 1727 CG2 ILE A 116 -15.114 -7.296 4.749 1.00 32.42 C ATOM 1728 CD1 ILE A 116 -13.609 -5.436 6.681 1.00 13.45 C ATOM 0 H ILE A 116 -14.487 -6.897 2.054 1.00 33.40 H new ATOM 0 HA ILE A 116 -12.006 -6.992 3.283 1.00 33.41 H new ATOM 0 HB ILE A 116 -14.005 -5.638 3.997 1.00 64.24 H new ATOM 0 HG12 ILE A 116 -12.838 -7.366 6.204 1.00 25.11 H new ATOM 0 HG13 ILE A 116 -11.983 -6.041 5.440 1.00 25.11 H new ATOM 0 HG21 ILE A 116 -15.669 -6.697 5.470 1.00 32.42 H new ATOM 0 HG22 ILE A 116 -15.699 -7.398 3.835 1.00 32.42 H new ATOM 0 HG23 ILE A 116 -14.923 -8.284 5.169 1.00 32.42 H new ATOM 0 HD11 ILE A 116 -12.975 -5.337 7.562 1.00 13.45 H new ATOM 0 HD12 ILE A 116 -13.721 -4.463 6.203 1.00 13.45 H new ATOM 0 HD13 ILE A 116 -14.589 -5.809 6.979 1.00 13.45 H new ATOM 1740 N ALA A 117 -13.754 -9.740 3.581 1.00 62.34 N ATOM 1741 CA ALA A 117 -13.711 -11.130 4.020 1.00 61.01 C ATOM 1742 C ALA A 117 -12.422 -11.808 3.568 1.00 32.23 C ATOM 1743 O ALA A 117 -12.070 -12.882 4.058 1.00 14.03 O ATOM 1744 CB ALA A 117 -14.921 -11.887 3.494 1.00 31.14 C ATOM 0 H ALA A 117 -14.546 -9.512 2.980 1.00 62.34 H new ATOM 0 HA ALA A 117 -13.734 -11.143 5.110 1.00 61.01 H new ATOM 0 HB1 ALA A 117 -14.876 -12.923 3.829 1.00 31.14 H new ATOM 0 HB2 ALA A 117 -15.832 -11.423 3.871 1.00 31.14 H new ATOM 0 HB3 ALA A 117 -14.923 -11.858 2.404 1.00 31.14 H new ATOM 1750 N ALA A 118 -11.723 -11.176 2.632 1.00 71.20 N ATOM 1751 CA ALA A 118 -10.472 -11.719 2.115 1.00 20.44 C ATOM 1752 C ALA A 118 -9.279 -11.193 2.905 1.00 44.03 C ATOM 1753 O ALA A 118 -8.131 -11.538 2.617 1.00 53.41 O ATOM 1754 CB ALA A 118 -10.321 -11.384 0.639 1.00 31.13 C ATOM 0 H ALA A 118 -12.001 -10.287 2.216 1.00 71.20 H new ATOM 0 HA ALA A 118 -10.500 -12.803 2.228 1.00 20.44 H new ATOM 0 HB1 ALA A 118 -9.383 -11.796 0.267 1.00 31.13 H new ATOM 0 HB2 ALA A 118 -11.153 -11.814 0.081 1.00 31.13 H new ATOM 0 HB3 ALA A 118 -10.319 -10.302 0.510 1.00 31.13 H new ATOM 1760 N LEU A 119 -9.555 -10.358 3.900 1.00 64.11 N ATOM 1761 CA LEU A 119 -8.502 -9.783 4.731 1.00 75.55 C ATOM 1762 C LEU A 119 -8.553 -10.353 6.145 1.00 54.42 C ATOM 1763 O LEU A 119 -7.733 -10.005 6.994 1.00 24.32 O ATOM 1764 CB LEU A 119 -8.636 -8.260 4.777 1.00 0.30 C ATOM 1765 CG LEU A 119 -9.012 -7.579 3.461 1.00 54.22 C ATOM 1766 CD1 LEU A 119 -9.525 -6.170 3.716 1.00 51.23 C ATOM 1767 CD2 LEU A 119 -7.822 -7.553 2.514 1.00 12.32 C ATOM 0 H LEU A 119 -10.499 -10.064 4.152 1.00 64.11 H new ATOM 0 HA LEU A 119 -7.540 -10.043 4.289 1.00 75.55 H new ATOM 0 HB2 LEU A 119 -9.388 -8.004 5.523 1.00 0.30 H new ATOM 0 HB3 LEU A 119 -7.690 -7.842 5.122 1.00 0.30 H new ATOM 0 HG LEU A 119 -9.810 -8.154 2.992 1.00 54.22 H new ATOM 0 HD11 LEU A 119 -9.788 -5.701 2.768 1.00 51.23 H new ATOM 0 HD12 LEU A 119 -10.407 -6.214 4.355 1.00 51.23 H new ATOM 0 HD13 LEU A 119 -8.749 -5.584 4.208 1.00 51.23 H new ATOM 0 HD21 LEU A 119 -8.109 -7.065 1.583 1.00 12.32 H new ATOM 0 HD22 LEU A 119 -7.002 -7.002 2.975 1.00 12.32 H new ATOM 0 HD23 LEU A 119 -7.501 -8.573 2.305 1.00 12.32 H new ATOM 1779 N ALA A 120 -9.520 -11.231 6.389 1.00 15.32 N ATOM 1780 CA ALA A 120 -9.676 -11.851 7.699 1.00 23.21 C ATOM 1781 C ALA A 120 -8.404 -12.585 8.113 1.00 14.32 C ATOM 1782 O ALA A 120 -7.783 -12.274 9.130 1.00 52.04 O ATOM 1783 CB ALA A 120 -10.860 -12.807 7.693 1.00 40.42 C ATOM 0 H ALA A 120 -10.207 -11.529 5.697 1.00 15.32 H new ATOM 0 HA ALA A 120 -9.864 -11.062 8.427 1.00 23.21 H new ATOM 0 HB1 ALA A 120 -10.965 -13.263 8.678 1.00 40.42 H new ATOM 0 HB2 ALA A 120 -11.770 -12.258 7.449 1.00 40.42 H new ATOM 0 HB3 ALA A 120 -10.695 -13.586 6.948 1.00 40.42 H new ATOM 1789 N PRO A 121 -8.007 -13.582 7.309 1.00 1.22 N ATOM 1790 CA PRO A 121 -6.805 -14.380 7.572 1.00 11.25 C ATOM 1791 C PRO A 121 -5.523 -13.579 7.375 1.00 12.43 C ATOM 1792 O PRO A 121 -4.596 -13.664 8.182 1.00 71.24 O ATOM 1793 CB PRO A 121 -6.895 -15.507 6.541 1.00 73.43 C ATOM 1794 CG PRO A 121 -7.716 -14.942 5.433 1.00 71.31 C ATOM 1795 CD PRO A 121 -8.699 -14.006 6.081 1.00 71.54 C ATOM 0 HA PRO A 121 -6.766 -14.730 8.604 1.00 11.25 H new ATOM 0 HB2 PRO A 121 -5.906 -15.803 6.190 1.00 73.43 H new ATOM 0 HB3 PRO A 121 -7.361 -16.396 6.966 1.00 73.43 H new ATOM 0 HG2 PRO A 121 -7.090 -14.414 4.714 1.00 71.31 H new ATOM 0 HG3 PRO A 121 -8.231 -15.732 4.887 1.00 71.31 H new ATOM 0 HD2 PRO A 121 -8.931 -13.158 5.437 1.00 71.54 H new ATOM 0 HD3 PRO A 121 -9.642 -14.505 6.303 1.00 71.54 H new ATOM 1803 N TYR A 122 -5.476 -12.800 6.300 1.00 71.44 N ATOM 1804 CA TYR A 122 -4.306 -11.986 5.996 1.00 25.14 C ATOM 1805 C TYR A 122 -4.379 -10.641 6.711 1.00 11.52 C ATOM 1806 O TYR A 122 -4.057 -9.601 6.136 1.00 25.11 O ATOM 1807 CB TYR A 122 -4.186 -11.769 4.487 1.00 74.23 C ATOM 1808 CG TYR A 122 -4.373 -13.031 3.677 1.00 64.32 C ATOM 1809 CD1 TYR A 122 -3.296 -13.861 3.389 1.00 35.40 C ATOM 1810 CD2 TYR A 122 -5.627 -13.395 3.201 1.00 64.52 C ATOM 1811 CE1 TYR A 122 -3.463 -15.016 2.648 1.00 2.12 C ATOM 1812 CE2 TYR A 122 -5.803 -14.549 2.461 1.00 64.12 C ATOM 1813 CZ TYR A 122 -4.717 -15.355 2.187 1.00 62.34 C ATOM 1814 OH TYR A 122 -4.887 -16.505 1.450 1.00 32.54 O ATOM 0 H TYR A 122 -6.235 -12.715 5.624 1.00 71.44 H new ATOM 0 HA TYR A 122 -3.423 -12.518 6.350 1.00 25.14 H new ATOM 0 HB2 TYR A 122 -4.927 -11.033 4.174 1.00 74.23 H new ATOM 0 HB3 TYR A 122 -3.205 -11.347 4.266 1.00 74.23 H new ATOM 0 HD1 TYR A 122 -2.312 -13.599 3.750 1.00 35.40 H new ATOM 0 HD2 TYR A 122 -6.478 -12.765 3.413 1.00 64.52 H new ATOM 0 HE1 TYR A 122 -2.615 -15.649 2.431 1.00 2.12 H new ATOM 0 HE2 TYR A 122 -6.784 -14.818 2.099 1.00 64.12 H new ATOM 0 HH TYR A 122 -4.329 -16.463 0.645 1.00 32.54 H new ATOM 1824 N ALA A 123 -4.804 -10.668 7.970 1.00 75.31 N ATOM 1825 CA ALA A 123 -4.919 -9.452 8.765 1.00 41.11 C ATOM 1826 C ALA A 123 -3.588 -9.098 9.420 1.00 32.51 C ATOM 1827 O ALA A 123 -3.290 -7.926 9.647 1.00 31.11 O ATOM 1828 CB ALA A 123 -6.003 -9.611 9.820 1.00 31.25 C ATOM 0 H ALA A 123 -5.075 -11.520 8.461 1.00 75.31 H new ATOM 0 HA ALA A 123 -5.195 -8.635 8.098 1.00 41.11 H new ATOM 0 HB1 ALA A 123 -6.077 -8.695 10.406 1.00 31.25 H new ATOM 0 HB2 ALA A 123 -6.958 -9.809 9.333 1.00 31.25 H new ATOM 0 HB3 ALA A 123 -5.751 -10.443 10.478 1.00 31.25 H new ATOM 1834 N GLN A 124 -2.792 -10.119 9.723 1.00 33.22 N ATOM 1835 CA GLN A 124 -1.494 -9.915 10.354 1.00 63.14 C ATOM 1836 C GLN A 124 -0.425 -9.607 9.311 1.00 22.21 C ATOM 1837 O GLN A 124 0.411 -8.724 9.507 1.00 31.44 O ATOM 1838 CB GLN A 124 -1.095 -11.151 11.161 1.00 74.14 C ATOM 1839 CG GLN A 124 -1.857 -11.296 12.469 1.00 5.23 C ATOM 1840 CD GLN A 124 -2.472 -12.671 12.638 1.00 32.11 C ATOM 1841 OE1 GLN A 124 -2.480 -13.478 11.708 1.00 53.01 O ATOM 1842 NE2 GLN A 124 -2.992 -12.945 13.828 1.00 53.12 N ATOM 0 H GLN A 124 -3.024 -11.096 9.541 1.00 33.22 H new ATOM 0 HA GLN A 124 -1.576 -9.062 11.027 1.00 63.14 H new ATOM 0 HB2 GLN A 124 -1.261 -12.041 10.553 1.00 74.14 H new ATOM 0 HB3 GLN A 124 -0.027 -11.106 11.375 1.00 74.14 H new ATOM 0 HG2 GLN A 124 -1.182 -11.100 13.302 1.00 5.23 H new ATOM 0 HG3 GLN A 124 -2.644 -10.543 12.512 1.00 5.23 H new ATOM 0 HE21 GLN A 124 -2.963 -12.246 14.570 1.00 53.12 H new ATOM 0 HE22 GLN A 124 -3.420 -13.855 14.000 1.00 53.12 H new ATOM 1851 N ALA A 125 -0.457 -10.340 8.204 1.00 41.33 N ATOM 1852 CA ALA A 125 0.509 -10.144 7.129 1.00 54.22 C ATOM 1853 C ALA A 125 0.786 -8.662 6.905 1.00 4.11 C ATOM 1854 O ALA A 125 1.932 -8.259 6.703 1.00 13.45 O ATOM 1855 CB ALA A 125 0.008 -10.790 5.845 1.00 0.23 C ATOM 0 H ALA A 125 -1.141 -11.075 8.027 1.00 41.33 H new ATOM 0 HA ALA A 125 1.444 -10.622 7.422 1.00 54.22 H new ATOM 0 HB1 ALA A 125 0.739 -10.636 5.051 1.00 0.23 H new ATOM 0 HB2 ALA A 125 -0.133 -11.859 6.006 1.00 0.23 H new ATOM 0 HB3 ALA A 125 -0.941 -10.338 5.557 1.00 0.23 H new ATOM 1861 N ALA A 126 -0.269 -7.855 6.940 1.00 4.43 N ATOM 1862 CA ALA A 126 -0.138 -6.416 6.742 1.00 22.01 C ATOM 1863 C ALA A 126 1.069 -5.866 7.495 1.00 62.32 C ATOM 1864 O ALA A 126 1.915 -5.185 6.916 1.00 71.41 O ATOM 1865 CB ALA A 126 -1.407 -5.705 7.184 1.00 54.43 C ATOM 0 H ALA A 126 -1.224 -8.173 7.104 1.00 4.43 H new ATOM 0 HA ALA A 126 0.016 -6.233 5.679 1.00 22.01 H new ATOM 0 HB1 ALA A 126 -1.295 -4.632 7.031 1.00 54.43 H new ATOM 0 HB2 ALA A 126 -2.251 -6.069 6.598 1.00 54.43 H new ATOM 0 HB3 ALA A 126 -1.586 -5.904 8.241 1.00 54.43 H new ATOM 1871 N GLN A 127 1.140 -6.165 8.788 1.00 20.12 N ATOM 1872 CA GLN A 127 2.243 -5.698 9.619 1.00 20.34 C ATOM 1873 C GLN A 127 3.555 -5.710 8.841 1.00 30.12 C ATOM 1874 O GLN A 127 4.355 -4.781 8.941 1.00 10.14 O ATOM 1875 CB GLN A 127 2.371 -6.570 10.871 1.00 3.30 C ATOM 1876 CG GLN A 127 1.855 -5.900 12.134 1.00 50.31 C ATOM 1877 CD GLN A 127 2.893 -5.007 12.786 1.00 35.40 C ATOM 1878 OE1 GLN A 127 3.734 -5.474 13.555 1.00 44.43 O ATOM 1879 NE2 GLN A 127 2.838 -3.715 12.483 1.00 63.33 N ATOM 0 H GLN A 127 0.448 -6.728 9.282 1.00 20.12 H new ATOM 0 HA GLN A 127 2.029 -4.672 9.919 1.00 20.34 H new ATOM 0 HB2 GLN A 127 1.824 -7.500 10.714 1.00 3.30 H new ATOM 0 HB3 GLN A 127 3.418 -6.836 11.013 1.00 3.30 H new ATOM 0 HG2 GLN A 127 0.972 -5.308 11.892 1.00 50.31 H new ATOM 0 HG3 GLN A 127 1.541 -6.665 12.844 1.00 50.31 H new ATOM 0 HE21 GLN A 127 2.124 -3.372 11.841 1.00 63.33 H new ATOM 0 HE22 GLN A 127 3.510 -3.066 12.893 1.00 63.33 H new ATOM 1888 N GLU A 128 3.768 -6.770 8.067 1.00 31.22 N ATOM 1889 CA GLU A 128 4.984 -6.902 7.273 1.00 74.14 C ATOM 1890 C GLU A 128 5.061 -5.811 6.209 1.00 14.23 C ATOM 1891 O GLU A 128 5.957 -4.966 6.233 1.00 23.51 O ATOM 1892 CB GLU A 128 5.039 -8.280 6.610 1.00 32.35 C ATOM 1893 CG GLU A 128 5.325 -9.413 7.582 1.00 0.23 C ATOM 1894 CD GLU A 128 6.743 -9.376 8.119 1.00 42.02 C ATOM 1895 OE1 GLU A 128 7.647 -8.944 7.374 1.00 64.45 O ATOM 1896 OE2 GLU A 128 6.948 -9.780 9.282 1.00 22.24 O ATOM 0 H GLU A 128 3.115 -7.548 7.973 1.00 31.22 H new ATOM 0 HA GLU A 128 5.837 -6.793 7.942 1.00 74.14 H new ATOM 0 HB2 GLU A 128 4.089 -8.472 6.111 1.00 32.35 H new ATOM 0 HB3 GLU A 128 5.809 -8.272 5.838 1.00 32.35 H new ATOM 0 HG2 GLU A 128 4.624 -9.358 8.414 1.00 0.23 H new ATOM 0 HG3 GLU A 128 5.154 -10.367 7.083 1.00 0.23 H new ATOM 1903 N LEU A 129 4.116 -5.835 5.277 1.00 54.54 N ATOM 1904 CA LEU A 129 4.075 -4.848 4.203 1.00 55.24 C ATOM 1905 C LEU A 129 4.364 -3.449 4.737 1.00 31.35 C ATOM 1906 O LEU A 129 5.138 -2.695 4.147 1.00 11.23 O ATOM 1907 CB LEU A 129 2.709 -4.871 3.514 1.00 41.44 C ATOM 1908 CG LEU A 129 2.509 -5.957 2.457 1.00 43.24 C ATOM 1909 CD1 LEU A 129 1.322 -6.838 2.814 1.00 2.24 C ATOM 1910 CD2 LEU A 129 2.318 -5.334 1.082 1.00 52.25 C ATOM 0 H LEU A 129 3.367 -6.527 5.243 1.00 54.54 H new ATOM 0 HA LEU A 129 4.846 -5.106 3.477 1.00 55.24 H new ATOM 0 HB2 LEU A 129 1.941 -4.990 4.278 1.00 41.44 H new ATOM 0 HB3 LEU A 129 2.545 -3.901 3.045 1.00 41.44 H new ATOM 0 HG LEU A 129 3.403 -6.580 2.431 1.00 43.24 H new ATOM 0 HD11 LEU A 129 1.195 -7.605 2.050 1.00 2.24 H new ATOM 0 HD12 LEU A 129 1.499 -7.313 3.779 1.00 2.24 H new ATOM 0 HD13 LEU A 129 0.420 -6.228 2.869 1.00 2.24 H new ATOM 0 HD21 LEU A 129 2.177 -6.122 0.342 1.00 52.25 H new ATOM 0 HD22 LEU A 129 1.441 -4.687 1.094 1.00 52.25 H new ATOM 0 HD23 LEU A 129 3.199 -4.747 0.823 1.00 52.25 H new ATOM 1922 N VAL A 130 3.738 -3.109 5.860 1.00 31.52 N ATOM 1923 CA VAL A 130 3.931 -1.802 6.477 1.00 71.50 C ATOM 1924 C VAL A 130 5.398 -1.564 6.815 1.00 65.52 C ATOM 1925 O VAL A 130 6.005 -0.599 6.353 1.00 2.31 O ATOM 1926 CB VAL A 130 3.090 -1.658 7.760 1.00 54.34 C ATOM 1927 CG1 VAL A 130 3.328 -0.300 8.403 1.00 22.43 C ATOM 1928 CG2 VAL A 130 1.613 -1.860 7.454 1.00 41.05 C ATOM 0 H VAL A 130 3.093 -3.721 6.361 1.00 31.52 H new ATOM 0 HA VAL A 130 3.604 -1.058 5.751 1.00 71.50 H new ATOM 0 HB VAL A 130 3.400 -2.428 8.466 1.00 54.34 H new ATOM 0 HG11 VAL A 130 2.726 -0.215 9.308 1.00 22.43 H new ATOM 0 HG12 VAL A 130 4.383 -0.198 8.658 1.00 22.43 H new ATOM 0 HG13 VAL A 130 3.046 0.488 7.705 1.00 22.43 H new ATOM 0 HG21 VAL A 130 1.034 -1.755 8.371 1.00 41.05 H new ATOM 0 HG22 VAL A 130 1.286 -1.113 6.731 1.00 41.05 H new ATOM 0 HG23 VAL A 130 1.460 -2.857 7.041 1.00 41.05 H new ATOM 1938 N LYS A 131 5.964 -2.453 7.624 1.00 24.43 N ATOM 1939 CA LYS A 131 7.362 -2.344 8.025 1.00 51.43 C ATOM 1940 C LYS A 131 8.233 -1.916 6.847 1.00 72.41 C ATOM 1941 O LYS A 131 8.928 -0.902 6.911 1.00 34.41 O ATOM 1942 CB LYS A 131 7.860 -3.678 8.584 1.00 4.41 C ATOM 1943 CG LYS A 131 8.631 -3.542 9.887 1.00 54.04 C ATOM 1944 CD LYS A 131 8.461 -4.769 10.765 1.00 63.13 C ATOM 1945 CE LYS A 131 7.639 -4.458 12.007 1.00 50.15 C ATOM 1946 NZ LYS A 131 7.372 -5.678 12.815 1.00 31.24 N ATOM 0 H LYS A 131 5.475 -3.258 8.015 1.00 24.43 H new ATOM 0 HA LYS A 131 7.433 -1.583 8.803 1.00 51.43 H new ATOM 0 HB2 LYS A 131 7.006 -4.337 8.744 1.00 4.41 H new ATOM 0 HB3 LYS A 131 8.498 -4.158 7.842 1.00 4.41 H new ATOM 0 HG2 LYS A 131 9.689 -3.392 9.671 1.00 54.04 H new ATOM 0 HG3 LYS A 131 8.287 -2.658 10.424 1.00 54.04 H new ATOM 0 HD2 LYS A 131 7.975 -5.561 10.195 1.00 63.13 H new ATOM 0 HD3 LYS A 131 9.441 -5.144 11.061 1.00 63.13 H new ATOM 0 HE2 LYS A 131 8.167 -3.726 12.618 1.00 50.15 H new ATOM 0 HE3 LYS A 131 6.693 -4.004 11.712 1.00 50.15 H new ATOM 0 HZ1 LYS A 131 6.810 -5.424 13.652 1.00 31.24 H new ATOM 0 HZ2 LYS A 131 6.846 -6.367 12.240 1.00 31.24 H new ATOM 0 HZ3 LYS A 131 8.274 -6.098 13.118 1.00 31.24 H new ATOM 1960 N VAL A 132 8.190 -2.697 5.772 1.00 41.21 N ATOM 1961 CA VAL A 132 8.973 -2.398 4.579 1.00 31.12 C ATOM 1962 C VAL A 132 8.562 -1.062 3.972 1.00 51.53 C ATOM 1963 O VAL A 132 9.405 -0.214 3.683 1.00 42.25 O ATOM 1964 CB VAL A 132 8.820 -3.502 3.516 1.00 72.44 C ATOM 1965 CG1 VAL A 132 9.480 -3.083 2.211 1.00 14.15 C ATOM 1966 CG2 VAL A 132 9.402 -4.813 4.021 1.00 64.22 C ATOM 0 H VAL A 132 7.621 -3.541 5.703 1.00 41.21 H new ATOM 0 HA VAL A 132 10.016 -2.346 4.890 1.00 31.12 H new ATOM 0 HB VAL A 132 7.757 -3.653 3.325 1.00 72.44 H new ATOM 0 HG11 VAL A 132 9.361 -3.876 1.472 1.00 14.15 H new ATOM 0 HG12 VAL A 132 9.011 -2.171 1.843 1.00 14.15 H new ATOM 0 HG13 VAL A 132 10.541 -2.902 2.382 1.00 14.15 H new ATOM 0 HG21 VAL A 132 9.285 -5.581 3.257 1.00 64.22 H new ATOM 0 HG22 VAL A 132 10.461 -4.680 4.242 1.00 64.22 H new ATOM 0 HG23 VAL A 132 8.878 -5.119 4.926 1.00 64.22 H new ATOM 1976 N ALA A 133 7.259 -0.881 3.781 1.00 42.24 N ATOM 1977 CA ALA A 133 6.735 0.354 3.210 1.00 72.35 C ATOM 1978 C ALA A 133 7.480 1.569 3.751 1.00 64.25 C ATOM 1979 O ALA A 133 7.606 2.585 3.069 1.00 42.42 O ATOM 1980 CB ALA A 133 5.245 0.476 3.495 1.00 30.44 C ATOM 0 H ALA A 133 6.547 -1.574 4.013 1.00 42.24 H new ATOM 0 HA ALA A 133 6.886 0.319 2.131 1.00 72.35 H new ATOM 0 HB1 ALA A 133 4.867 1.403 3.063 1.00 30.44 H new ATOM 0 HB2 ALA A 133 4.720 -0.371 3.054 1.00 30.44 H new ATOM 0 HB3 ALA A 133 5.080 0.484 4.572 1.00 30.44 H new ATOM 1986 N ARG A 134 7.973 1.456 4.980 1.00 23.43 N ATOM 1987 CA ARG A 134 8.705 2.547 5.612 1.00 25.43 C ATOM 1988 C ARG A 134 10.156 2.573 5.140 1.00 11.10 C ATOM 1989 O ARG A 134 10.660 3.612 4.713 1.00 21.53 O ATOM 1990 CB ARG A 134 8.656 2.406 7.135 1.00 43.21 C ATOM 1991 CG ARG A 134 7.285 2.681 7.728 1.00 34.24 C ATOM 1992 CD ARG A 134 7.191 2.195 9.167 1.00 63.15 C ATOM 1993 NE ARG A 134 7.631 3.213 10.117 1.00 13.12 N ATOM 1994 CZ ARG A 134 8.901 3.400 10.458 1.00 2.01 C ATOM 1995 NH1 ARG A 134 9.852 2.644 9.929 1.00 70.50 N ATOM 1996 NH2 ARG A 134 9.223 4.348 11.330 1.00 74.31 N ATOM 0 H ARG A 134 7.879 0.621 5.558 1.00 23.43 H new ATOM 0 HA ARG A 134 8.230 3.485 5.324 1.00 25.43 H new ATOM 0 HB2 ARG A 134 8.965 1.397 7.408 1.00 43.21 H new ATOM 0 HB3 ARG A 134 9.378 3.091 7.578 1.00 43.21 H new ATOM 0 HG2 ARG A 134 7.079 3.751 7.690 1.00 34.24 H new ATOM 0 HG3 ARG A 134 6.522 2.188 7.126 1.00 34.24 H new ATOM 0 HD2 ARG A 134 6.162 1.913 9.388 1.00 63.15 H new ATOM 0 HD3 ARG A 134 7.800 1.299 9.288 1.00 63.15 H new ATOM 0 HE ARG A 134 6.924 3.813 10.542 1.00 13.12 H new ATOM 0 HH11 ARG A 134 9.610 1.915 9.257 1.00 70.50 H new ATOM 0 HH12 ARG A 134 10.826 2.791 10.193 1.00 70.50 H new ATOM 0 HH21 ARG A 134 8.495 4.934 11.739 1.00 74.31 H new ATOM 0 HH22 ARG A 134 10.199 4.491 11.591 1.00 74.31 H new ATOM 2010 N GLU A 135 10.821 1.425 5.220 1.00 22.33 N ATOM 2011 CA GLU A 135 12.214 1.319 4.801 1.00 11.05 C ATOM 2012 C GLU A 135 12.469 2.146 3.545 1.00 0.51 C ATOM 2013 O GLU A 135 13.525 2.762 3.398 1.00 13.31 O ATOM 2014 CB GLU A 135 12.583 -0.144 4.545 1.00 14.15 C ATOM 2015 CG GLU A 135 12.603 -0.995 5.804 1.00 3.14 C ATOM 2016 CD GLU A 135 14.011 -1.345 6.249 1.00 73.13 C ATOM 2017 OE1 GLU A 135 14.752 -0.425 6.652 1.00 11.34 O ATOM 2018 OE2 GLU A 135 14.370 -2.540 6.192 1.00 70.12 O ATOM 0 H GLU A 135 10.418 0.556 5.571 1.00 22.33 H new ATOM 0 HA GLU A 135 12.839 1.709 5.605 1.00 11.05 H new ATOM 0 HB2 GLU A 135 11.871 -0.571 3.839 1.00 14.15 H new ATOM 0 HB3 GLU A 135 13.565 -0.185 4.073 1.00 14.15 H new ATOM 0 HG2 GLU A 135 12.094 -0.462 6.607 1.00 3.14 H new ATOM 0 HG3 GLU A 135 12.043 -1.913 5.626 1.00 3.14 H new ATOM 2025 N VAL A 136 11.494 2.155 2.641 1.00 23.10 N ATOM 2026 CA VAL A 136 11.613 2.906 1.397 1.00 34.32 C ATOM 2027 C VAL A 136 11.685 4.405 1.665 1.00 13.04 C ATOM 2028 O VAL A 136 12.657 5.065 1.301 1.00 3.02 O ATOM 2029 CB VAL A 136 10.428 2.620 0.455 1.00 53.30 C ATOM 2030 CG1 VAL A 136 10.736 3.108 -0.953 1.00 62.23 C ATOM 2031 CG2 VAL A 136 10.095 1.136 0.454 1.00 12.30 C ATOM 0 H VAL A 136 10.614 1.651 2.747 1.00 23.10 H new ATOM 0 HA VAL A 136 12.536 2.581 0.917 1.00 34.32 H new ATOM 0 HB VAL A 136 9.556 3.164 0.819 1.00 53.30 H new ATOM 0 HG11 VAL A 136 9.888 2.898 -1.605 1.00 62.23 H new ATOM 0 HG12 VAL A 136 10.921 4.182 -0.934 1.00 62.23 H new ATOM 0 HG13 VAL A 136 11.620 2.594 -1.331 1.00 62.23 H new ATOM 0 HG21 VAL A 136 9.256 0.952 -0.217 1.00 12.30 H new ATOM 0 HG22 VAL A 136 10.962 0.569 0.115 1.00 12.30 H new ATOM 0 HG23 VAL A 136 9.829 0.822 1.463 1.00 12.30 H new ATOM 2041 N ALA A 137 10.647 4.937 2.305 1.00 23.44 N ATOM 2042 CA ALA A 137 10.594 6.358 2.625 1.00 44.33 C ATOM 2043 C ALA A 137 11.441 6.677 3.852 1.00 24.00 C ATOM 2044 O ALA A 137 11.021 6.445 4.985 1.00 14.53 O ATOM 2045 CB ALA A 137 9.155 6.795 2.847 1.00 75.32 C ATOM 0 H ALA A 137 9.833 4.405 2.611 1.00 23.44 H new ATOM 0 HA ALA A 137 11.004 6.911 1.780 1.00 44.33 H new ATOM 0 HB1 ALA A 137 9.130 7.858 3.085 1.00 75.32 H new ATOM 0 HB2 ALA A 137 8.576 6.612 1.942 1.00 75.32 H new ATOM 0 HB3 ALA A 137 8.726 6.228 3.673 1.00 75.32 H new ATOM 2051 N SER A 138 12.637 7.207 3.618 1.00 11.33 N ATOM 2052 CA SER A 138 13.546 7.554 4.705 1.00 32.33 C ATOM 2053 C SER A 138 13.543 9.058 4.958 1.00 14.02 C ATOM 2054 O SER A 138 14.032 9.837 4.141 1.00 42.02 O ATOM 2055 CB SER A 138 14.965 7.083 4.382 1.00 61.40 C ATOM 2056 OG SER A 138 15.522 7.837 3.320 1.00 62.32 O ATOM 0 H SER A 138 13.000 7.406 2.686 1.00 11.33 H new ATOM 0 HA SER A 138 13.200 7.051 5.608 1.00 32.33 H new ATOM 0 HB2 SER A 138 15.593 7.177 5.268 1.00 61.40 H new ATOM 0 HB3 SER A 138 14.949 6.027 4.113 1.00 61.40 H new ATOM 0 HG SER A 138 15.269 8.779 3.420 1.00 62.32 H new ATOM 2062 N GLY A 139 12.985 9.460 6.097 1.00 13.21 N ATOM 2063 CA GLY A 139 12.927 10.870 6.438 1.00 60.40 C ATOM 2064 C GLY A 139 12.256 11.700 5.361 1.00 35.42 C ATOM 2065 O GLY A 139 12.911 12.288 4.501 1.00 30.32 O ATOM 0 H GLY A 139 12.572 8.834 6.789 1.00 13.21 H new ATOM 0 HA2 GLY A 139 12.386 10.992 7.376 1.00 60.40 H new ATOM 0 HA3 GLY A 139 13.938 11.243 6.603 1.00 60.40 H new ATOM 2069 N PRO A 140 10.916 11.753 5.400 1.00 11.10 N ATOM 2070 CA PRO A 140 10.126 12.512 4.427 1.00 11.15 C ATOM 2071 C PRO A 140 10.289 14.019 4.598 1.00 72.13 C ATOM 2072 O PRO A 140 10.752 14.489 5.637 1.00 31.34 O ATOM 2073 CB PRO A 140 8.686 12.093 4.734 1.00 63.31 C ATOM 2074 CG PRO A 140 8.709 11.674 6.163 1.00 44.21 C ATOM 2075 CD PRO A 140 10.070 11.076 6.397 1.00 53.32 C ATOM 0 HA PRO A 140 10.435 12.306 3.402 1.00 11.15 H new ATOM 0 HB2 PRO A 140 7.991 12.918 4.575 1.00 63.31 H new ATOM 0 HB3 PRO A 140 8.365 11.276 4.087 1.00 63.31 H new ATOM 0 HG2 PRO A 140 8.538 12.525 6.822 1.00 44.21 H new ATOM 0 HG3 PRO A 140 7.923 10.948 6.370 1.00 44.21 H new ATOM 0 HD2 PRO A 140 10.420 11.260 7.413 1.00 53.32 H new ATOM 0 HD3 PRO A 140 10.065 9.996 6.252 1.00 53.32 H new ATOM 2083 N SER A 141 9.904 14.772 3.572 1.00 74.42 N ATOM 2084 CA SER A 141 10.010 16.226 3.608 1.00 20.22 C ATOM 2085 C SER A 141 8.811 16.875 2.924 1.00 10.34 C ATOM 2086 O SER A 141 8.831 17.128 1.721 1.00 40.32 O ATOM 2087 CB SER A 141 11.304 16.680 2.932 1.00 44.34 C ATOM 2088 OG SER A 141 12.313 16.947 3.890 1.00 4.21 O ATOM 0 H SER A 141 9.516 14.399 2.706 1.00 74.42 H new ATOM 0 HA SER A 141 10.024 16.539 4.652 1.00 20.22 H new ATOM 0 HB2 SER A 141 11.648 15.909 2.242 1.00 44.34 H new ATOM 0 HB3 SER A 141 11.114 17.575 2.340 1.00 44.34 H new ATOM 0 HG SER A 141 13.131 17.234 3.432 1.00 4.21 H new ATOM 2094 N SER A 142 7.766 17.142 3.703 1.00 23.11 N ATOM 2095 CA SER A 142 6.556 17.759 3.173 1.00 24.41 C ATOM 2096 C SER A 142 6.818 19.205 2.763 1.00 74.32 C ATOM 2097 O SER A 142 7.490 19.951 3.472 1.00 2.25 O ATOM 2098 CB SER A 142 5.435 17.707 4.213 1.00 23.42 C ATOM 2099 OG SER A 142 4.191 17.402 3.607 1.00 53.42 O ATOM 0 H SER A 142 7.734 16.941 4.702 1.00 23.11 H new ATOM 0 HA SER A 142 6.249 17.199 2.289 1.00 24.41 H new ATOM 0 HB2 SER A 142 5.669 16.956 4.968 1.00 23.42 H new ATOM 0 HB3 SER A 142 5.367 18.666 4.727 1.00 23.42 H new ATOM 0 HG SER A 142 3.491 17.373 4.293 1.00 53.42 H new ATOM 2105 N GLY A 143 6.280 19.593 1.611 1.00 31.01 N ATOM 2106 CA GLY A 143 6.466 20.947 1.124 1.00 33.14 C ATOM 2107 C GLY A 143 5.834 21.982 2.035 1.00 74.44 C ATOM 2108 O GLY A 143 5.545 23.100 1.608 1.00 63.22 O ATOM 0 H GLY A 143 5.719 18.994 1.006 1.00 31.01 H new ATOM 0 HA2 GLY A 143 7.532 21.153 1.030 1.00 33.14 H new ATOM 0 HA3 GLY A 143 6.035 21.034 0.127 1.00 33.14 H new TER 2112 GLY A 143