USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 983 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 115 GLN : amide:sc= -8! C(o=-7!,f=-13!) USER MOD Set 1.3: A 117 TYR OH : rot 23:sc= 1.01 USER MOD Set 2.1: A 52 SER OG : rot -66:sc= 0.254 USER MOD Set 2.2: A 57 ASN : amide:sc= -0.147 X(o=0.11,f=-0.33) USER MOD Set 3.1: A 37 LYS NZ :NH3+ 180:sc= -0.097 (180deg=-0.097) USER MOD Set 3.2: A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ -125:sc= 0.624 (180deg=0.0069) USER MOD Single : A 5 THR OG1 : rot -86:sc= -7.65! USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.0425 X(o=-0.043,f=0.22) USER MOD Single : A 13 ASN : amide:sc= -1.1 X(o=-1.1,f=-0.87) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -167:sc= -4.15! (180deg=-4.6!) USER MOD Single : A 20 LYS NZ :NH3+ -151:sc= -0.0471 (180deg=-0.369) USER MOD Single : A 21 MET CE :methyl -144:sc= -8.8! (180deg=-13.8!) USER MOD Single : A 24 ASN :FLIP amide:sc=-0.00413 F(o=-1.4!,f=-0.0041) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= -0.0143 (180deg=-0.0143) USER MOD Single : A 39 THR OG1 : rot 78:sc= -6.28! USER MOD Single : A 41 THR OG1 : rot 89:sc= 0.957 USER MOD Single : A 42 GLN : amide:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.474 X(o=-0.47,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 134:sc= 1.17 USER MOD Single : A 53 SER OG : rot 180:sc= 0.0505 USER MOD Single : A 54 ASN :FLIP amide:sc= -0.721 F(o=-1.7,f=-0.72) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -22:sc= 0.435! USER MOD Single : A 76 THR OG1 : rot 39:sc= 0.368 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 81 THR OG1 : rot 108:sc= -0.828! USER MOD Single : A 83 THR OG1 : rot -87:sc= 0.8 USER MOD Single : A 84 MET CE :methyl -157:sc= -0.669 (180deg=-0.911) USER MOD Single : A 87 ASN : amide:sc= -0.29 X(o=-0.29,f=0.0038) USER MOD Single : A 88 LYS NZ :NH3+ 158:sc= -2.37! (180deg=-3.45!) USER MOD Single : A 92 LYS NZ :NH3+ -137:sc= 1.26 (180deg=0.0642) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.0155 X(o=-0.016,f=-0.043) USER MOD Single : A 100 LYS NZ :NH3+ 148:sc= 0.609 (180deg=-0.171) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot -83:sc= 0.816 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot -88:sc= -0.165 USER MOD Single : A 125 LYS NZ :NH3+ 159:sc= 0.9 (180deg=0.13) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 154:sc= -0.451 (180deg=-1.44!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 2.504 10.393 4.876 1.00 0.00 N ATOM 2 CA ALA A 1 3.481 10.672 3.870 1.00 0.00 C ATOM 3 C ALA A 1 4.774 9.978 4.367 1.00 0.00 C ATOM 4 O ALA A 1 4.604 9.415 5.416 1.00 0.00 O ATOM 5 CB ALA A 1 3.694 12.179 3.868 1.00 0.00 C ATOM 0 H1 ALA A 1 1.674 9.945 4.439 1.00 0.00 H new ATOM 0 H2 ALA A 1 2.910 9.751 5.586 1.00 0.00 H new ATOM 0 H3 ALA A 1 2.216 11.280 5.336 1.00 0.00 H new ATOM 0 HA ALA A 1 3.197 10.334 2.873 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.435 12.441 3.113 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.752 12.679 3.641 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.047 12.498 4.849 1.00 0.00 H new ATOM 13 N PHE A 2 5.890 10.075 3.633 1.00 0.00 N ATOM 14 CA PHE A 2 7.192 9.475 3.988 1.00 0.00 C ATOM 15 C PHE A 2 8.171 9.297 2.808 1.00 0.00 C ATOM 16 O PHE A 2 9.348 9.495 3.013 1.00 0.00 O ATOM 17 CB PHE A 2 7.057 8.079 4.675 1.00 0.00 C ATOM 18 CG PHE A 2 7.867 7.922 5.941 1.00 0.00 C ATOM 19 CD1 PHE A 2 9.013 8.625 6.229 1.00 0.00 C ATOM 20 CD2 PHE A 2 7.409 6.988 6.871 1.00 0.00 C ATOM 21 CE1 PHE A 2 9.709 8.426 7.406 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.099 6.784 8.046 1.00 0.00 C ATOM 23 CZ PHE A 2 9.274 7.497 8.353 1.00 0.00 C ATOM 0 H PHE A 2 5.918 10.586 2.751 1.00 0.00 H new ATOM 0 HA PHE A 2 7.600 10.213 4.679 1.00 0.00 H new ATOM 0 HB2 PHE A 2 6.007 7.902 4.907 1.00 0.00 H new ATOM 0 HB3 PHE A 2 7.361 7.309 3.966 1.00 0.00 H new ATOM 0 HD1 PHE A 2 9.378 9.351 5.518 1.00 0.00 H new ATOM 0 HD2 PHE A 2 6.511 6.423 6.669 1.00 0.00 H new ATOM 0 HE1 PHE A 2 10.605 8.999 7.597 1.00 0.00 H new ATOM 0 HE2 PHE A 2 7.728 6.056 8.752 1.00 0.00 H new ATOM 0 HZ PHE A 2 9.812 7.333 9.275 1.00 0.00 H new ATOM 33 N ASP A 3 7.755 8.951 1.601 1.00 0.00 N ATOM 34 CA ASP A 3 8.726 8.812 0.487 1.00 0.00 C ATOM 35 C ASP A 3 9.116 10.126 -0.135 1.00 0.00 C ATOM 36 O ASP A 3 8.529 11.130 0.315 1.00 0.00 O ATOM 37 CB ASP A 3 8.338 7.779 -0.578 1.00 0.00 C ATOM 38 CG ASP A 3 6.874 7.464 -0.594 1.00 0.00 C ATOM 39 OD1 ASP A 3 6.563 6.555 0.290 1.00 0.00 O ATOM 40 OD2 ASP A 3 6.029 7.973 -1.325 1.00 0.00 O ATOM 0 H ASP A 3 6.784 8.762 1.354 1.00 0.00 H new ATOM 0 HA ASP A 3 9.614 8.411 0.976 1.00 0.00 H new ATOM 0 HB2 ASP A 3 8.633 8.151 -1.559 1.00 0.00 H new ATOM 0 HB3 ASP A 3 8.898 6.860 -0.404 1.00 0.00 H new ATOM 45 N GLY A 4 10.037 10.138 -1.089 1.00 0.00 N ATOM 46 CA GLY A 4 10.414 11.387 -1.675 1.00 0.00 C ATOM 47 C GLY A 4 11.829 11.943 -1.393 1.00 0.00 C ATOM 48 O GLY A 4 12.753 11.448 -1.987 1.00 0.00 O ATOM 0 H GLY A 4 10.517 9.316 -1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.306 11.291 -2.755 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.693 12.136 -1.348 1.00 0.00 H new ATOM 52 N THR A 5 11.772 12.925 -0.529 1.00 0.00 N ATOM 53 CA THR A 5 12.817 13.767 -0.050 1.00 0.00 C ATOM 54 C THR A 5 12.393 14.232 1.312 1.00 0.00 C ATOM 55 O THR A 5 11.207 14.199 1.564 1.00 0.00 O ATOM 56 CB THR A 5 13.066 14.950 -1.018 1.00 0.00 C ATOM 57 OG1 THR A 5 11.796 15.596 -0.904 1.00 0.00 O ATOM 58 CG2 THR A 5 13.354 14.434 -2.406 1.00 0.00 C ATOM 0 H THR A 5 10.881 13.175 -0.099 1.00 0.00 H new ATOM 0 HA THR A 5 13.765 13.232 0.009 1.00 0.00 H new ATOM 0 HB THR A 5 13.916 15.598 -0.805 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.166 15.194 -1.538 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.527 15.275 -3.078 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.240 13.800 -2.382 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.503 13.854 -2.763 1.00 0.00 H new ATOM 66 N TRP A 6 13.423 14.604 2.002 1.00 0.00 N ATOM 67 CA TRP A 6 13.340 14.996 3.383 1.00 0.00 C ATOM 68 C TRP A 6 14.717 15.414 3.803 1.00 0.00 C ATOM 69 O TRP A 6 15.606 14.971 3.111 1.00 0.00 O ATOM 70 CB TRP A 6 13.177 13.565 4.003 1.00 0.00 C ATOM 71 CG TRP A 6 11.731 13.243 3.990 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.232 12.012 3.704 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.557 14.060 4.171 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.875 11.998 3.684 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.413 13.230 3.952 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.267 15.382 4.472 1.00 0.00 C ATOM 77 CZ2 TRP A 6 8.105 13.663 4.013 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.953 15.815 4.541 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.895 14.962 4.310 1.00 0.00 C ATOM 0 H TRP A 6 14.367 14.647 1.619 1.00 0.00 H new ATOM 0 HA TRP A 6 12.603 15.762 3.624 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.740 12.830 3.427 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.567 13.540 5.020 1.00 0.00 H new ATOM 0 HD1 TRP A 6 11.845 11.144 3.514 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.296 11.179 3.495 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.071 16.079 4.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.281 12.989 3.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.752 16.848 4.782 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.884 15.339 4.368 1.00 0.00 H new ATOM 90 N LYS A 7 14.858 16.156 4.868 1.00 0.00 N ATOM 91 CA LYS A 7 16.204 16.650 5.199 1.00 0.00 C ATOM 92 C LYS A 7 16.350 16.789 6.683 1.00 0.00 C ATOM 93 O LYS A 7 15.874 15.937 7.423 1.00 0.00 O ATOM 94 CB LYS A 7 16.351 17.967 4.406 1.00 0.00 C ATOM 95 CG LYS A 7 15.698 17.893 3.057 1.00 0.00 C ATOM 96 CD LYS A 7 15.907 18.937 1.968 1.00 0.00 C ATOM 97 CE LYS A 7 17.152 18.700 1.075 1.00 0.00 C ATOM 98 NZ LYS A 7 18.047 19.867 0.905 1.00 0.00 N ATOM 0 H LYS A 7 14.111 16.432 5.505 1.00 0.00 H new ATOM 0 HA LYS A 7 17.008 15.970 4.918 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.910 18.784 4.977 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.409 18.199 4.283 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.990 16.936 2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.624 17.847 3.237 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.021 18.963 1.334 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.993 19.918 2.435 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.731 17.879 1.499 1.00 0.00 H new ATOM 0 HE3 LYS A 7 16.815 18.377 0.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.846 19.605 0.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.518 20.649 0.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.406 20.167 1.834 1.00 0.00 H new ATOM 112 N VAL A 8 16.995 17.874 7.055 1.00 0.00 N ATOM 113 CA VAL A 8 17.143 18.113 8.451 1.00 0.00 C ATOM 114 C VAL A 8 17.289 19.626 8.670 1.00 0.00 C ATOM 115 O VAL A 8 18.265 20.122 9.160 1.00 0.00 O ATOM 116 CB VAL A 8 18.187 17.254 9.147 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.449 17.838 10.548 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.855 15.747 9.233 1.00 0.00 C ATOM 0 H VAL A 8 17.405 18.570 6.432 1.00 0.00 H new ATOM 0 HA VAL A 8 16.239 17.776 8.958 1.00 0.00 H new ATOM 0 HB VAL A 8 19.082 17.292 8.526 1.00 0.00 H new ATOM 0 HG11 VAL A 8 19.196 17.232 11.061 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.813 18.861 10.453 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.523 17.834 11.123 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.662 15.225 9.747 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.925 15.610 9.785 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.743 15.341 8.228 1.00 0.00 H new ATOM 128 N ASP A 9 16.250 20.306 8.256 1.00 0.00 N ATOM 129 CA ASP A 9 16.078 21.735 8.344 1.00 0.00 C ATOM 130 C ASP A 9 16.634 22.342 9.648 1.00 0.00 C ATOM 131 O ASP A 9 17.315 23.344 9.637 1.00 0.00 O ATOM 132 CB ASP A 9 14.555 21.950 8.475 1.00 0.00 C ATOM 133 CG ASP A 9 13.975 23.230 7.984 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.568 24.262 8.052 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.761 23.150 7.475 1.00 0.00 O ATOM 0 H ASP A 9 15.450 19.847 7.820 1.00 0.00 H new ATOM 0 HA ASP A 9 16.578 22.187 7.487 1.00 0.00 H new ATOM 0 HB2 ASP A 9 14.058 21.136 7.946 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.295 21.851 9.529 1.00 0.00 H new ATOM 140 N ARG A 10 16.239 21.662 10.708 1.00 0.00 N ATOM 141 CA ARG A 10 16.608 22.170 11.965 1.00 0.00 C ATOM 142 C ARG A 10 17.198 21.085 12.800 1.00 0.00 C ATOM 143 O ARG A 10 17.204 19.914 12.350 1.00 0.00 O ATOM 144 CB ARG A 10 15.354 22.812 12.572 1.00 0.00 C ATOM 145 CG ARG A 10 14.027 22.470 11.887 1.00 0.00 C ATOM 146 CD ARG A 10 13.490 23.536 10.934 1.00 0.00 C ATOM 147 NE ARG A 10 12.879 24.618 11.706 1.00 0.00 N ATOM 148 CZ ARG A 10 12.466 25.802 11.207 1.00 0.00 C ATOM 149 NH1 ARG A 10 12.590 26.073 9.930 1.00 0.00 N ATOM 150 NH2 ARG A 10 11.931 26.709 12.006 1.00 0.00 N ATOM 0 H ARG A 10 15.691 20.802 10.705 1.00 0.00 H new ATOM 0 HA ARG A 10 17.385 22.931 11.896 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.287 22.514 13.618 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.480 23.895 12.556 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.153 21.540 11.332 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.278 22.283 12.656 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.298 23.927 10.316 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.756 23.098 10.258 1.00 0.00 H new ATOM 0 HE ARG A 10 12.755 24.465 12.707 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.003 25.385 9.300 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.274 26.972 9.566 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.830 26.515 13.002 1.00 0.00 H new ATOM 0 HH22 ARG A 10 11.620 27.603 11.626 1.00 0.00 H new ATOM 164 N ASN A 11 17.699 21.394 13.962 1.00 0.00 N ATOM 165 CA ASN A 11 18.272 20.328 14.748 1.00 0.00 C ATOM 166 C ASN A 11 18.267 20.588 16.226 1.00 0.00 C ATOM 167 O ASN A 11 19.065 21.421 16.691 1.00 0.00 O ATOM 168 CB ASN A 11 19.740 20.167 14.272 1.00 0.00 C ATOM 169 CG ASN A 11 20.287 21.412 13.626 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.572 22.376 14.338 1.00 0.00 O ATOM 171 ND2 ASN A 11 20.451 21.443 12.321 1.00 0.00 N ATOM 0 H ASN A 11 17.726 22.326 14.375 1.00 0.00 H new ATOM 0 HA ASN A 11 17.668 19.433 14.600 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.366 19.901 15.124 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.798 19.341 13.564 1.00 0.00 H new ATOM 0 HD21 ASN A 11 20.823 22.281 11.874 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.206 20.629 11.757 1.00 0.00 H new ATOM 178 N GLU A 12 17.392 19.889 16.927 1.00 0.00 N ATOM 179 CA GLU A 12 17.284 20.038 18.381 1.00 0.00 C ATOM 180 C GLU A 12 17.891 18.777 18.997 1.00 0.00 C ATOM 181 O GLU A 12 17.686 17.677 18.476 1.00 0.00 O ATOM 182 CB GLU A 12 15.856 20.285 18.948 1.00 0.00 C ATOM 183 CG GLU A 12 15.074 19.065 19.478 1.00 0.00 C ATOM 184 CD GLU A 12 14.586 19.275 20.907 1.00 0.00 C ATOM 185 OE1 GLU A 12 14.759 20.298 21.527 1.00 0.00 O ATOM 186 OE2 GLU A 12 13.964 18.253 21.420 1.00 0.00 O ATOM 0 H GLU A 12 16.745 19.213 16.522 1.00 0.00 H new ATOM 0 HA GLU A 12 17.816 20.951 18.648 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.938 21.009 19.759 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.260 20.751 18.164 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.220 18.872 18.828 1.00 0.00 H new ATOM 0 HG3 GLU A 12 15.711 18.181 19.439 1.00 0.00 H new ATOM 193 N ASN A 13 18.647 18.881 20.092 1.00 0.00 N ATOM 194 CA ASN A 13 19.275 17.746 20.760 1.00 0.00 C ATOM 195 C ASN A 13 20.091 16.895 19.794 1.00 0.00 C ATOM 196 O ASN A 13 20.354 15.757 20.134 1.00 0.00 O ATOM 197 CB ASN A 13 18.152 16.880 21.369 1.00 0.00 C ATOM 198 CG ASN A 13 17.591 17.377 22.691 1.00 0.00 C ATOM 199 OD1 ASN A 13 18.314 17.675 23.631 1.00 0.00 O ATOM 200 ND2 ASN A 13 16.255 17.442 22.699 1.00 0.00 N ATOM 0 H ASN A 13 18.842 19.774 20.545 1.00 0.00 H new ATOM 0 HA ASN A 13 19.957 18.120 21.523 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.336 16.814 20.649 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.533 15.869 21.512 1.00 0.00 H new ATOM 0 HD21 ASN A 13 15.765 17.760 23.535 1.00 0.00 H new ATOM 0 HD22 ASN A 13 15.726 17.174 21.869 1.00 0.00 H new ATOM 207 N TYR A 14 20.435 17.493 18.656 1.00 0.00 N ATOM 208 CA TYR A 14 21.201 16.863 17.596 1.00 0.00 C ATOM 209 C TYR A 14 22.687 16.740 17.862 1.00 0.00 C ATOM 210 O TYR A 14 23.296 15.708 17.618 1.00 0.00 O ATOM 211 CB TYR A 14 20.771 17.573 16.294 1.00 0.00 C ATOM 212 CG TYR A 14 21.025 16.858 15.036 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.328 16.445 14.777 1.00 0.00 C ATOM 214 CD2 TYR A 14 20.028 16.578 14.093 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.690 15.756 13.612 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.384 15.898 12.925 1.00 0.00 C ATOM 217 CZ TYR A 14 21.690 15.493 12.692 1.00 0.00 C ATOM 218 OH TYR A 14 21.971 14.819 11.516 1.00 0.00 O ATOM 0 H TYR A 14 20.179 18.457 18.445 1.00 0.00 H new ATOM 0 HA TYR A 14 20.972 15.800 17.514 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.703 17.781 16.357 1.00 0.00 H new ATOM 0 HB3 TYR A 14 21.281 18.535 16.247 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.094 16.665 15.506 1.00 0.00 H new ATOM 0 HD2 TYR A 14 19.006 16.881 14.265 1.00 0.00 H new ATOM 0 HE1 TYR A 14 23.709 15.443 13.439 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.625 15.683 12.187 1.00 0.00 H new ATOM 0 HH TYR A 14 21.150 14.722 10.990 1.00 0.00 H new ATOM 228 N GLU A 15 23.260 17.822 18.378 1.00 0.00 N ATOM 229 CA GLU A 15 24.672 17.866 18.695 1.00 0.00 C ATOM 230 C GLU A 15 25.020 16.894 19.856 1.00 0.00 C ATOM 231 O GLU A 15 25.998 16.176 19.773 1.00 0.00 O ATOM 232 CB GLU A 15 25.152 19.258 19.080 1.00 0.00 C ATOM 233 CG GLU A 15 26.468 19.630 18.348 1.00 0.00 C ATOM 234 CD GLU A 15 27.204 20.729 19.036 1.00 0.00 C ATOM 235 OE1 GLU A 15 27.085 20.941 20.224 1.00 0.00 O ATOM 236 OE2 GLU A 15 27.965 21.399 18.207 1.00 0.00 O ATOM 0 H GLU A 15 22.757 18.685 18.585 1.00 0.00 H new ATOM 0 HA GLU A 15 25.182 17.563 17.781 1.00 0.00 H new ATOM 0 HB2 GLU A 15 24.381 19.989 18.838 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.309 19.305 20.158 1.00 0.00 H new ATOM 0 HG2 GLU A 15 27.108 18.750 18.285 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.240 19.932 17.326 1.00 0.00 H new ATOM 243 N LYS A 16 24.188 16.914 20.900 1.00 0.00 N ATOM 244 CA LYS A 16 24.372 16.062 22.062 1.00 0.00 C ATOM 245 C LYS A 16 24.007 14.623 21.782 1.00 0.00 C ATOM 246 O LYS A 16 24.398 13.682 22.468 1.00 0.00 O ATOM 247 CB LYS A 16 23.566 16.637 23.242 1.00 0.00 C ATOM 248 CG LYS A 16 24.028 16.152 24.607 1.00 0.00 C ATOM 249 CD LYS A 16 23.246 16.949 25.643 1.00 0.00 C ATOM 250 CE LYS A 16 21.980 16.319 26.187 1.00 0.00 C ATOM 251 NZ LYS A 16 22.282 15.326 27.238 1.00 0.00 N ATOM 0 H LYS A 16 23.371 17.522 20.957 1.00 0.00 H new ATOM 0 HA LYS A 16 25.430 16.053 22.322 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.629 17.725 23.215 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.516 16.375 23.112 1.00 0.00 H new ATOM 0 HG2 LYS A 16 23.844 15.084 24.721 1.00 0.00 H new ATOM 0 HG3 LYS A 16 25.100 16.305 24.730 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.909 17.154 26.483 1.00 0.00 H new ATOM 0 HD3 LYS A 16 22.983 17.910 25.202 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.331 17.095 26.593 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.433 15.838 25.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.395 14.913 27.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.882 14.574 26.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 22.782 15.792 28.022 1.00 0.00 H new ATOM 265 N PHE A 17 23.198 14.322 20.725 1.00 0.00 N ATOM 266 CA PHE A 17 22.762 12.978 20.343 1.00 0.00 C ATOM 267 C PHE A 17 23.923 12.205 19.663 1.00 0.00 C ATOM 268 O PHE A 17 24.101 10.987 19.758 1.00 0.00 O ATOM 269 CB PHE A 17 21.538 13.024 19.406 1.00 0.00 C ATOM 270 CG PHE A 17 21.544 12.025 18.259 1.00 0.00 C ATOM 271 CD1 PHE A 17 21.023 10.749 18.442 1.00 0.00 C ATOM 272 CD2 PHE A 17 22.071 12.380 17.030 1.00 0.00 C ATOM 273 CE1 PHE A 17 21.033 9.833 17.391 1.00 0.00 C ATOM 274 CE2 PHE A 17 22.086 11.478 15.986 1.00 0.00 C ATOM 275 CZ PHE A 17 21.565 10.195 16.158 1.00 0.00 C ATOM 0 H PHE A 17 22.829 15.044 20.106 1.00 0.00 H new ATOM 0 HA PHE A 17 22.469 12.456 21.254 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.641 12.858 20.003 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.462 14.028 18.988 1.00 0.00 H new ATOM 0 HD1 PHE A 17 20.610 10.467 19.399 1.00 0.00 H new ATOM 0 HD2 PHE A 17 22.474 13.372 16.887 1.00 0.00 H new ATOM 0 HE1 PHE A 17 20.628 8.842 17.534 1.00 0.00 H new ATOM 0 HE2 PHE A 17 22.503 11.766 15.032 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.575 9.489 15.341 1.00 0.00 H new ATOM 285 N MET A 18 24.703 13.010 18.962 1.00 0.00 N ATOM 286 CA MET A 18 25.854 12.599 18.213 1.00 0.00 C ATOM 287 C MET A 18 27.016 12.408 19.177 1.00 0.00 C ATOM 288 O MET A 18 27.688 11.386 19.188 1.00 0.00 O ATOM 289 CB MET A 18 26.266 13.740 17.240 1.00 0.00 C ATOM 290 CG MET A 18 25.731 13.371 15.894 1.00 0.00 C ATOM 291 SD MET A 18 26.373 14.360 14.528 1.00 0.00 S ATOM 292 CE MET A 18 26.768 15.807 15.518 1.00 0.00 C ATOM 0 H MET A 18 24.533 14.014 18.904 1.00 0.00 H new ATOM 0 HA MET A 18 25.623 11.683 17.670 1.00 0.00 H new ATOM 0 HB2 MET A 18 25.858 14.696 17.570 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.350 13.849 17.209 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.958 12.322 15.703 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.645 13.464 15.912 1.00 0.00 H new ATOM 0 HE1 MET A 18 26.971 16.653 14.861 1.00 0.00 H new ATOM 0 HE2 MET A 18 25.925 16.046 16.166 1.00 0.00 H new ATOM 0 HE3 MET A 18 27.648 15.601 16.128 1.00 0.00 H new ATOM 302 N GLU A 19 27.208 13.442 19.967 1.00 0.00 N ATOM 303 CA GLU A 19 28.267 13.540 20.946 1.00 0.00 C ATOM 304 C GLU A 19 28.470 12.302 21.815 1.00 0.00 C ATOM 305 O GLU A 19 29.535 11.723 21.974 1.00 0.00 O ATOM 306 CB GLU A 19 27.888 14.648 21.955 1.00 0.00 C ATOM 307 CG GLU A 19 29.070 15.500 22.482 1.00 0.00 C ATOM 308 CD GLU A 19 29.321 16.753 21.711 1.00 0.00 C ATOM 309 OE1 GLU A 19 29.795 16.762 20.614 1.00 0.00 O ATOM 310 OE2 GLU A 19 28.978 17.837 22.362 1.00 0.00 O ATOM 0 H GLU A 19 26.609 14.267 19.944 1.00 0.00 H new ATOM 0 HA GLU A 19 29.171 13.714 20.363 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.165 15.313 21.483 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.388 14.185 22.806 1.00 0.00 H new ATOM 0 HG2 GLU A 19 28.878 15.761 23.523 1.00 0.00 H new ATOM 0 HG3 GLU A 19 29.975 14.892 22.468 1.00 0.00 H new ATOM 317 N LYS A 20 27.354 11.909 22.441 1.00 0.00 N ATOM 318 CA LYS A 20 27.301 10.786 23.396 1.00 0.00 C ATOM 319 C LYS A 20 27.805 9.463 22.885 1.00 0.00 C ATOM 320 O LYS A 20 28.204 8.604 23.665 1.00 0.00 O ATOM 321 CB LYS A 20 25.891 10.698 23.997 1.00 0.00 C ATOM 322 CG LYS A 20 25.533 11.988 24.675 1.00 0.00 C ATOM 323 CD LYS A 20 26.164 12.015 26.048 1.00 0.00 C ATOM 324 CE LYS A 20 25.669 10.988 27.027 1.00 0.00 C ATOM 325 NZ LYS A 20 26.697 9.961 27.217 1.00 0.00 N ATOM 0 H LYS A 20 26.452 12.363 22.300 1.00 0.00 H new ATOM 0 HA LYS A 20 28.022 11.016 24.180 1.00 0.00 H new ATOM 0 HB2 LYS A 20 25.167 10.478 23.212 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.844 9.878 24.713 1.00 0.00 H new ATOM 0 HG2 LYS A 20 25.883 12.834 24.083 1.00 0.00 H new ATOM 0 HG3 LYS A 20 24.450 12.082 24.757 1.00 0.00 H new ATOM 0 HD2 LYS A 20 27.240 11.887 25.933 1.00 0.00 H new ATOM 0 HD3 LYS A 20 26.005 13.004 26.479 1.00 0.00 H new ATOM 0 HE2 LYS A 20 25.432 11.462 27.980 1.00 0.00 H new ATOM 0 HE3 LYS A 20 24.749 10.534 26.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 26.244 9.056 27.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 27.245 9.852 26.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 27.333 10.245 27.989 1.00 0.00 H new ATOM 339 N MET A 21 27.804 9.268 21.566 1.00 0.00 N ATOM 340 CA MET A 21 28.259 8.043 20.962 1.00 0.00 C ATOM 341 C MET A 21 29.774 8.030 20.634 1.00 0.00 C ATOM 342 O MET A 21 30.260 6.956 20.319 1.00 0.00 O ATOM 343 CB MET A 21 27.516 7.666 19.662 1.00 0.00 C ATOM 344 CG MET A 21 26.155 8.316 19.534 1.00 0.00 C ATOM 345 SD MET A 21 24.858 7.071 19.322 1.00 0.00 S ATOM 346 CE MET A 21 23.735 7.741 20.589 1.00 0.00 C ATOM 0 H MET A 21 27.484 9.966 20.895 1.00 0.00 H new ATOM 0 HA MET A 21 28.039 7.310 21.738 1.00 0.00 H new ATOM 0 HB2 MET A 21 28.128 7.952 18.807 1.00 0.00 H new ATOM 0 HB3 MET A 21 27.398 6.583 19.621 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.949 8.914 20.422 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.152 8.998 18.683 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.232 6.920 21.100 1.00 0.00 H new ATOM 0 HE2 MET A 21 24.308 8.322 21.312 1.00 0.00 H new ATOM 0 HE3 MET A 21 22.993 8.383 20.115 1.00 0.00 H new ATOM 356 N GLY A 22 30.336 9.228 20.749 1.00 0.00 N ATOM 357 CA GLY A 22 31.770 9.417 20.483 1.00 0.00 C ATOM 358 C GLY A 22 32.094 10.524 19.479 1.00 0.00 C ATOM 359 O GLY A 22 33.225 10.709 19.014 1.00 0.00 O ATOM 0 H GLY A 22 29.836 10.075 21.020 1.00 0.00 H new ATOM 0 HA2 GLY A 22 32.274 9.640 21.424 1.00 0.00 H new ATOM 0 HA3 GLY A 22 32.184 8.478 20.114 1.00 0.00 H new ATOM 363 N ILE A 23 31.096 11.312 19.101 1.00 0.00 N ATOM 364 CA ILE A 23 31.202 12.399 18.168 1.00 0.00 C ATOM 365 C ILE A 23 31.940 13.549 18.806 1.00 0.00 C ATOM 366 O ILE A 23 31.380 14.331 19.581 1.00 0.00 O ATOM 367 CB ILE A 23 29.814 12.888 17.745 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.149 11.935 16.801 1.00 0.00 C ATOM 369 CG2 ILE A 23 29.852 14.331 17.184 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.627 10.498 16.942 1.00 0.00 C ATOM 0 H ILE A 23 30.149 11.195 19.461 1.00 0.00 H new ATOM 0 HA ILE A 23 31.742 12.041 17.292 1.00 0.00 H new ATOM 0 HB ILE A 23 29.202 12.918 18.646 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.072 11.968 16.965 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.326 12.268 15.778 1.00 0.00 H new ATOM 0 HG21 ILE A 23 28.846 14.636 16.897 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.232 15.009 17.948 1.00 0.00 H new ATOM 0 HG23 ILE A 23 30.505 14.365 16.312 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.100 9.867 16.226 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.699 10.450 16.748 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.425 10.145 17.953 1.00 0.00 H new ATOM 382 N ASN A 24 33.228 13.699 18.508 1.00 0.00 N ATOM 383 CA ASN A 24 33.953 14.790 19.108 1.00 0.00 C ATOM 384 C ASN A 24 33.614 16.134 18.508 1.00 0.00 C ATOM 385 O ASN A 24 32.745 16.249 17.648 1.00 0.00 O ATOM 386 CB ASN A 24 35.472 14.497 19.166 1.00 0.00 C ATOM 387 CG ASN A 24 35.829 13.593 20.316 1.00 0.00 C ATOM 388 OD1 ASN A 24 34.999 12.608 20.570 1.00 0.00 O flip ATOM 389 ND2 ASN A 24 36.860 13.796 20.963 1.00 0.00 N flip ATOM 0 H ASN A 24 33.764 13.101 17.880 1.00 0.00 H new ATOM 0 HA ASN A 24 33.615 14.865 20.142 1.00 0.00 H new ATOM 0 HB2 ASN A 24 35.788 14.035 18.231 1.00 0.00 H new ATOM 0 HB3 ASN A 24 36.019 15.435 19.259 1.00 0.00 H new ATOM 0 HD21 ASN A 24 37.469 14.578 20.721 1.00 0.00 H new ATOM 0 HD22 ASN A 24 37.104 13.182 21.740 1.00 0.00 H new ATOM 396 N VAL A 25 34.284 17.175 18.944 1.00 0.00 N ATOM 397 CA VAL A 25 34.113 18.547 18.487 1.00 0.00 C ATOM 398 C VAL A 25 34.381 18.862 17.029 1.00 0.00 C ATOM 399 O VAL A 25 33.907 19.899 16.558 1.00 0.00 O ATOM 400 CB VAL A 25 34.539 19.638 19.475 1.00 0.00 C ATOM 401 CG1 VAL A 25 33.822 19.425 20.810 1.00 0.00 C ATOM 402 CG2 VAL A 25 36.033 19.674 19.693 1.00 0.00 C ATOM 0 H VAL A 25 35.001 17.090 19.664 1.00 0.00 H new ATOM 0 HA VAL A 25 33.024 18.590 18.494 1.00 0.00 H new ATOM 0 HB VAL A 25 34.257 20.598 19.043 1.00 0.00 H new ATOM 0 HG11 VAL A 25 34.125 20.201 21.513 1.00 0.00 H new ATOM 0 HG12 VAL A 25 32.744 19.475 20.656 1.00 0.00 H new ATOM 0 HG13 VAL A 25 34.086 18.447 21.213 1.00 0.00 H new ATOM 0 HG21 VAL A 25 36.278 20.465 20.401 1.00 0.00 H new ATOM 0 HG22 VAL A 25 36.366 18.715 20.090 1.00 0.00 H new ATOM 0 HG23 VAL A 25 36.534 19.868 18.745 1.00 0.00 H new ATOM 412 N VAL A 26 35.112 18.072 16.270 1.00 0.00 N ATOM 413 CA VAL A 26 35.437 18.254 14.876 1.00 0.00 C ATOM 414 C VAL A 26 34.227 18.544 14.008 1.00 0.00 C ATOM 415 O VAL A 26 34.356 19.131 12.930 1.00 0.00 O ATOM 416 CB VAL A 26 36.260 17.103 14.339 1.00 0.00 C ATOM 417 CG1 VAL A 26 37.634 17.073 15.005 1.00 0.00 C ATOM 418 CG2 VAL A 26 35.512 15.856 14.716 1.00 0.00 C ATOM 0 H VAL A 26 35.526 17.219 16.645 1.00 0.00 H new ATOM 0 HA VAL A 26 36.055 19.151 14.826 1.00 0.00 H new ATOM 0 HB VAL A 26 36.407 17.195 13.263 1.00 0.00 H new ATOM 0 HG11 VAL A 26 38.213 16.239 14.607 1.00 0.00 H new ATOM 0 HG12 VAL A 26 38.157 18.007 14.802 1.00 0.00 H new ATOM 0 HG13 VAL A 26 37.514 16.951 16.081 1.00 0.00 H new ATOM 0 HG21 VAL A 26 36.056 14.983 14.356 1.00 0.00 H new ATOM 0 HG22 VAL A 26 35.417 15.802 15.801 1.00 0.00 H new ATOM 0 HG23 VAL A 26 34.520 15.877 14.266 1.00 0.00 H new ATOM 428 N LYS A 27 33.098 18.107 14.565 1.00 0.00 N ATOM 429 CA LYS A 27 31.789 18.265 13.994 1.00 0.00 C ATOM 430 C LYS A 27 31.329 19.716 14.302 1.00 0.00 C ATOM 431 O LYS A 27 30.625 20.372 13.537 1.00 0.00 O ATOM 432 CB LYS A 27 30.818 17.217 14.487 1.00 0.00 C ATOM 433 CG LYS A 27 31.409 15.793 14.595 1.00 0.00 C ATOM 434 CD LYS A 27 32.251 15.324 13.430 1.00 0.00 C ATOM 435 CE LYS A 27 31.411 14.693 12.319 1.00 0.00 C ATOM 436 NZ LYS A 27 31.176 15.507 11.102 1.00 0.00 N ATOM 0 H LYS A 27 33.085 17.617 15.459 1.00 0.00 H new ATOM 0 HA LYS A 27 31.821 18.112 12.915 1.00 0.00 H new ATOM 0 HB2 LYS A 27 30.446 17.517 15.467 1.00 0.00 H new ATOM 0 HB3 LYS A 27 29.960 17.190 13.815 1.00 0.00 H new ATOM 0 HG2 LYS A 27 32.017 15.743 15.498 1.00 0.00 H new ATOM 0 HG3 LYS A 27 30.586 15.091 14.726 1.00 0.00 H new ATOM 0 HD2 LYS A 27 32.808 16.169 13.025 1.00 0.00 H new ATOM 0 HD3 LYS A 27 32.984 14.599 13.784 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.894 13.764 12.016 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.441 14.426 12.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.595 14.966 10.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.680 16.384 11.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 32.088 15.743 10.661 1.00 0.00 H new ATOM 595 N LYS A 37 19.271 16.136 3.134 1.00 0.00 N ATOM 596 CA LYS A 37 18.320 15.222 2.593 1.00 0.00 C ATOM 597 C LYS A 37 18.483 13.795 3.017 1.00 0.00 C ATOM 598 O LYS A 37 19.068 13.013 2.286 1.00 0.00 O ATOM 599 CB LYS A 37 18.169 15.343 1.065 1.00 0.00 C ATOM 600 CG LYS A 37 16.724 15.399 0.566 1.00 0.00 C ATOM 601 CD LYS A 37 16.661 15.082 -0.912 1.00 0.00 C ATOM 602 CE LYS A 37 17.598 15.963 -1.728 1.00 0.00 C ATOM 603 NZ LYS A 37 17.584 15.630 -3.156 1.00 0.00 N ATOM 0 HA LYS A 37 17.383 15.544 3.048 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.688 16.242 0.733 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.668 14.495 0.596 1.00 0.00 H new ATOM 0 HG2 LYS A 37 16.113 14.688 1.123 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.308 16.390 0.750 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.920 14.035 -1.069 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.639 15.214 -1.267 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.313 17.007 -1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.613 15.860 -1.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.238 16.258 -3.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.882 14.642 -3.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.622 15.753 -3.532 1.00 0.00 H new ATOM 617 N LEU A 38 17.920 13.523 4.206 1.00 0.00 N ATOM 618 CA LEU A 38 17.873 12.166 4.742 1.00 0.00 C ATOM 619 C LEU A 38 17.290 11.460 3.520 1.00 0.00 C ATOM 620 O LEU A 38 17.848 10.427 3.168 1.00 0.00 O ATOM 621 CB LEU A 38 16.733 11.911 5.742 1.00 0.00 C ATOM 622 CG LEU A 38 16.615 10.581 6.463 1.00 0.00 C ATOM 623 CD1 LEU A 38 16.401 9.428 5.514 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.913 10.253 7.200 1.00 0.00 C ATOM 0 H LEU A 38 17.494 14.228 4.808 1.00 0.00 H new ATOM 0 HA LEU A 38 18.829 11.902 5.195 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.799 12.685 6.507 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.796 12.070 5.207 1.00 0.00 H new ATOM 0 HG LEU A 38 15.765 10.692 7.136 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.323 8.500 6.081 1.00 0.00 H new ATOM 0 HD12 LEU A 38 15.482 9.587 4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.243 9.363 4.825 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.809 9.296 7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.733 10.195 6.484 1.00 0.00 H new ATOM 0 HD23 LEU A 38 18.124 11.034 7.931 1.00 0.00 H new ATOM 636 N THR A 39 16.278 12.118 3.008 1.00 0.00 N ATOM 637 CA THR A 39 15.482 11.778 1.833 1.00 0.00 C ATOM 638 C THR A 39 14.874 10.420 2.014 1.00 0.00 C ATOM 639 O THR A 39 15.524 9.590 2.625 1.00 0.00 O ATOM 640 CB THR A 39 16.328 11.730 0.517 1.00 0.00 C ATOM 641 OG1 THR A 39 17.321 12.689 0.668 1.00 0.00 O ATOM 642 CG2 THR A 39 15.476 11.939 -0.748 1.00 0.00 C ATOM 0 H THR A 39 15.954 12.985 3.436 1.00 0.00 H new ATOM 0 HA THR A 39 14.727 12.559 1.739 1.00 0.00 H new ATOM 0 HB THR A 39 16.765 10.742 0.370 1.00 0.00 H new ATOM 0 HG1 THR A 39 18.024 12.342 1.256 1.00 0.00 H new ATOM 0 HG21 THR A 39 16.116 11.896 -1.629 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.719 11.157 -0.810 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.988 12.913 -0.701 1.00 0.00 H new ATOM 650 N ILE A 40 13.712 10.081 1.515 1.00 0.00 N ATOM 651 CA ILE A 40 13.205 8.718 1.678 1.00 0.00 C ATOM 652 C ILE A 40 12.649 8.104 0.406 1.00 0.00 C ATOM 653 O ILE A 40 11.976 8.782 -0.330 1.00 0.00 O ATOM 654 CB ILE A 40 12.228 8.682 2.858 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.895 9.092 4.201 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.442 7.357 2.999 1.00 0.00 C ATOM 657 CD1 ILE A 40 11.836 9.448 5.274 1.00 0.00 C ATOM 0 H ILE A 40 13.098 10.710 0.998 1.00 0.00 H new ATOM 0 HA ILE A 40 14.051 8.070 1.909 1.00 0.00 H new ATOM 0 HB ILE A 40 11.484 9.440 2.612 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.521 8.276 4.562 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.550 9.947 4.037 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.775 7.419 3.859 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.856 7.184 2.097 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.141 6.533 3.141 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.337 9.730 6.200 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.228 10.281 4.922 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.197 8.584 5.456 1.00 0.00 H new ATOM 669 N THR A 41 12.948 6.846 0.193 1.00 0.00 N ATOM 670 CA THR A 41 12.433 6.201 -1.014 1.00 0.00 C ATOM 671 C THR A 41 11.861 4.876 -0.520 1.00 0.00 C ATOM 672 O THR A 41 12.608 4.138 0.093 1.00 0.00 O ATOM 673 CB THR A 41 13.420 6.014 -2.147 1.00 0.00 C ATOM 674 OG1 THR A 41 14.299 7.095 -2.197 1.00 0.00 O ATOM 675 CG2 THR A 41 12.614 5.957 -3.436 1.00 0.00 C ATOM 0 H THR A 41 13.519 6.260 0.803 1.00 0.00 H new ATOM 0 HA THR A 41 11.694 6.849 -1.485 1.00 0.00 H new ATOM 0 HB THR A 41 14.002 5.104 -2.004 1.00 0.00 H new ATOM 0 HG1 THR A 41 15.071 6.916 -1.621 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.289 5.822 -4.281 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.916 5.121 -3.392 1.00 0.00 H new ATOM 0 HG23 THR A 41 12.059 6.887 -3.559 1.00 0.00 H new ATOM 683 N GLN A 42 10.610 4.678 -0.812 1.00 0.00 N ATOM 684 CA GLN A 42 9.856 3.512 -0.454 1.00 0.00 C ATOM 685 C GLN A 42 10.207 2.378 -1.363 1.00 0.00 C ATOM 686 O GLN A 42 10.173 2.556 -2.571 1.00 0.00 O ATOM 687 CB GLN A 42 8.377 3.939 -0.694 1.00 0.00 C ATOM 688 CG GLN A 42 7.318 2.848 -0.598 1.00 0.00 C ATOM 689 CD GLN A 42 5.965 3.283 -1.131 1.00 0.00 C ATOM 690 OE1 GLN A 42 5.696 3.360 -2.361 1.00 0.00 O ATOM 691 NE2 GLN A 42 5.101 3.575 -0.171 1.00 0.00 N ATOM 0 H GLN A 42 10.059 5.360 -1.333 1.00 0.00 H new ATOM 0 HA GLN A 42 10.046 3.180 0.567 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.128 4.717 0.027 1.00 0.00 H new ATOM 0 HB3 GLN A 42 8.311 4.389 -1.684 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.656 1.972 -1.152 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.211 2.544 0.443 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.378 3.493 0.807 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.158 3.882 -0.410 1.00 0.00 H new ATOM 700 N GLU A 43 10.535 1.249 -0.804 1.00 0.00 N ATOM 701 CA GLU A 43 10.889 0.118 -1.657 1.00 0.00 C ATOM 702 C GLU A 43 10.136 -1.056 -1.092 1.00 0.00 C ATOM 703 O GLU A 43 9.484 -0.892 -0.082 1.00 0.00 O ATOM 704 CB GLU A 43 12.399 -0.064 -1.611 1.00 0.00 C ATOM 705 CG GLU A 43 13.081 -0.123 -2.972 1.00 0.00 C ATOM 706 CD GLU A 43 13.877 1.132 -3.049 1.00 0.00 C ATOM 707 OE1 GLU A 43 13.507 2.228 -2.650 1.00 0.00 O ATOM 708 OE2 GLU A 43 15.039 0.985 -3.589 1.00 0.00 O ATOM 0 H GLU A 43 10.569 1.075 0.200 1.00 0.00 H new ATOM 0 HA GLU A 43 10.625 0.251 -2.706 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.832 0.757 -1.040 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.623 -0.983 -1.069 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.719 -1.003 -3.058 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.351 -0.179 -3.779 1.00 0.00 H new ATOM 715 N GLY A 44 10.241 -2.204 -1.755 1.00 0.00 N ATOM 716 CA GLY A 44 9.618 -3.464 -1.416 1.00 0.00 C ATOM 717 C GLY A 44 10.337 -3.991 -0.205 1.00 0.00 C ATOM 718 O GLY A 44 11.306 -4.754 -0.256 1.00 0.00 O ATOM 0 H GLY A 44 10.805 -2.275 -2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.557 -3.327 -1.207 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.691 -4.167 -2.246 1.00 0.00 H new ATOM 722 N ASN A 45 9.835 -3.559 0.960 1.00 0.00 N ATOM 723 CA ASN A 45 10.271 -3.864 2.274 1.00 0.00 C ATOM 724 C ASN A 45 11.606 -3.214 2.635 1.00 0.00 C ATOM 725 O ASN A 45 12.315 -3.586 3.544 1.00 0.00 O ATOM 726 CB ASN A 45 10.415 -5.413 2.487 1.00 0.00 C ATOM 727 CG ASN A 45 9.184 -6.220 2.089 1.00 0.00 C ATOM 728 OD1 ASN A 45 9.275 -7.374 1.593 1.00 0.00 O ATOM 729 ND2 ASN A 45 8.024 -5.636 2.302 1.00 0.00 N ATOM 0 H ASN A 45 9.035 -2.926 0.975 1.00 0.00 H new ATOM 0 HA ASN A 45 9.498 -3.457 2.926 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.270 -5.769 1.911 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.636 -5.604 3.537 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.158 -6.120 2.063 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.991 -4.700 2.706 1.00 0.00 H new ATOM 736 N LYS A 46 11.993 -2.196 1.912 1.00 0.00 N ATOM 737 CA LYS A 46 13.237 -1.487 2.151 1.00 0.00 C ATOM 738 C LYS A 46 12.939 -0.023 1.806 1.00 0.00 C ATOM 739 O LYS A 46 11.935 0.247 1.163 1.00 0.00 O ATOM 740 CB LYS A 46 14.348 -1.795 1.127 1.00 0.00 C ATOM 741 CG LYS A 46 14.981 -0.630 0.393 1.00 0.00 C ATOM 742 CD LYS A 46 15.880 -1.152 -0.751 1.00 0.00 C ATOM 743 CE LYS A 46 16.370 -2.568 -0.601 1.00 0.00 C ATOM 744 NZ LYS A 46 16.886 -3.130 -1.874 1.00 0.00 N ATOM 0 H LYS A 46 11.452 -1.826 1.130 1.00 0.00 H new ATOM 0 HA LYS A 46 13.554 -1.743 3.162 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.141 -2.333 1.646 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.936 -2.475 0.382 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.205 0.021 -0.011 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.571 -0.030 1.086 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.327 -1.076 -1.687 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.745 -0.495 -0.837 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.158 -2.598 0.151 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.556 -3.194 -0.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.210 -4.105 -1.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.129 -3.128 -2.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.681 -2.551 -2.212 1.00 0.00 H new ATOM 758 N PHE A 47 13.888 0.782 2.222 1.00 0.00 N ATOM 759 CA PHE A 47 13.823 2.174 1.886 1.00 0.00 C ATOM 760 C PHE A 47 15.261 2.687 1.580 1.00 0.00 C ATOM 761 O PHE A 47 16.126 2.767 2.451 1.00 0.00 O ATOM 762 CB PHE A 47 13.301 3.201 2.906 1.00 0.00 C ATOM 763 CG PHE A 47 11.928 3.008 3.471 1.00 0.00 C ATOM 764 CD1 PHE A 47 10.915 2.488 2.709 1.00 0.00 C ATOM 765 CD2 PHE A 47 11.617 3.362 4.790 1.00 0.00 C ATOM 766 CE1 PHE A 47 9.627 2.290 3.157 1.00 0.00 C ATOM 767 CE2 PHE A 47 10.308 3.175 5.281 1.00 0.00 C ATOM 768 CZ PHE A 47 9.318 2.642 4.470 1.00 0.00 C ATOM 0 H PHE A 47 14.694 0.501 2.780 1.00 0.00 H new ATOM 0 HA PHE A 47 13.095 2.144 1.075 1.00 0.00 H new ATOM 0 HB2 PHE A 47 14.003 3.227 3.740 1.00 0.00 H new ATOM 0 HB3 PHE A 47 13.331 4.183 2.434 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.141 2.215 1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 47 12.380 3.778 5.431 1.00 0.00 H new ATOM 0 HE1 PHE A 47 8.874 1.872 2.506 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.075 3.450 6.299 1.00 0.00 H new ATOM 0 HZ PHE A 47 8.318 2.501 4.852 1.00 0.00 H new ATOM 778 N THR A 48 15.408 3.012 0.323 1.00 0.00 N ATOM 779 CA THR A 48 16.677 3.530 -0.135 1.00 0.00 C ATOM 780 C THR A 48 16.506 4.957 0.295 1.00 0.00 C ATOM 781 O THR A 48 15.962 5.778 -0.452 1.00 0.00 O ATOM 782 CB THR A 48 16.942 3.426 -1.644 1.00 0.00 C ATOM 783 OG1 THR A 48 16.696 2.084 -1.996 1.00 0.00 O ATOM 784 CG2 THR A 48 18.379 3.812 -2.027 1.00 0.00 C ATOM 0 H THR A 48 14.684 2.931 -0.391 1.00 0.00 H new ATOM 0 HA THR A 48 17.532 2.982 0.261 1.00 0.00 H new ATOM 0 HB THR A 48 16.295 4.123 -2.176 1.00 0.00 H new ATOM 0 HG1 THR A 48 16.149 2.054 -2.809 1.00 0.00 H new ATOM 0 HG21 THR A 48 18.506 3.719 -3.106 1.00 0.00 H new ATOM 0 HG22 THR A 48 18.571 4.842 -1.727 1.00 0.00 H new ATOM 0 HG23 THR A 48 19.081 3.149 -1.521 1.00 0.00 H new ATOM 792 N VAL A 49 16.965 5.207 1.480 1.00 0.00 N ATOM 793 CA VAL A 49 16.850 6.588 2.030 1.00 0.00 C ATOM 794 C VAL A 49 18.168 7.180 1.585 1.00 0.00 C ATOM 795 O VAL A 49 19.144 6.441 1.483 1.00 0.00 O ATOM 796 CB VAL A 49 16.615 6.673 3.504 1.00 0.00 C ATOM 797 CG1 VAL A 49 15.185 6.289 3.929 1.00 0.00 C ATOM 798 CG2 VAL A 49 17.519 5.761 4.350 1.00 0.00 C ATOM 0 H VAL A 49 17.413 4.525 2.093 1.00 0.00 H new ATOM 0 HA VAL A 49 15.969 7.120 1.671 1.00 0.00 H new ATOM 0 HB VAL A 49 16.829 7.725 3.691 1.00 0.00 H new ATOM 0 HG11 VAL A 49 15.092 6.375 5.012 1.00 0.00 H new ATOM 0 HG12 VAL A 49 14.471 6.958 3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 49 14.979 5.262 3.628 1.00 0.00 H new ATOM 0 HG21 VAL A 49 17.279 5.888 5.406 1.00 0.00 H new ATOM 0 HG22 VAL A 49 17.357 4.722 4.064 1.00 0.00 H new ATOM 0 HG23 VAL A 49 18.563 6.025 4.181 1.00 0.00 H new ATOM 808 N LYS A 50 18.168 8.452 1.333 1.00 0.00 N ATOM 809 CA LYS A 50 19.429 9.062 0.898 1.00 0.00 C ATOM 810 C LYS A 50 20.143 9.335 2.184 1.00 0.00 C ATOM 811 O LYS A 50 20.298 8.373 2.929 1.00 0.00 O ATOM 812 CB LYS A 50 19.124 10.343 0.193 1.00 0.00 C ATOM 813 CG LYS A 50 20.253 10.876 -0.660 1.00 0.00 C ATOM 814 CD LYS A 50 19.813 12.075 -1.463 1.00 0.00 C ATOM 815 CE LYS A 50 20.561 11.975 -2.748 1.00 0.00 C ATOM 816 NZ LYS A 50 20.650 13.336 -3.303 1.00 0.00 N ATOM 0 H LYS A 50 17.366 9.078 1.409 1.00 0.00 H new ATOM 0 HA LYS A 50 20.012 8.441 0.218 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.248 10.195 -0.438 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.859 11.097 0.935 1.00 0.00 H new ATOM 0 HG2 LYS A 50 21.094 11.150 -0.024 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.604 10.094 -1.333 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.736 12.063 -1.631 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.044 13.005 -0.943 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.555 11.560 -2.584 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.048 11.309 -3.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.168 13.310 -4.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.692 13.709 -3.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.153 13.952 -2.633 1.00 0.00 H new ATOM 830 N GLU A 51 20.477 10.584 2.326 1.00 0.00 N ATOM 831 CA GLU A 51 21.108 11.187 3.485 1.00 0.00 C ATOM 832 C GLU A 51 22.402 11.763 2.940 1.00 0.00 C ATOM 833 O GLU A 51 23.495 11.417 3.370 1.00 0.00 O ATOM 834 CB GLU A 51 21.492 10.199 4.538 1.00 0.00 C ATOM 835 CG GLU A 51 22.069 10.805 5.809 1.00 0.00 C ATOM 836 CD GLU A 51 23.317 10.146 6.262 1.00 0.00 C ATOM 837 OE1 GLU A 51 24.135 9.491 5.375 1.00 0.00 O ATOM 838 OE2 GLU A 51 23.553 10.230 7.438 1.00 0.00 O ATOM 0 H GLU A 51 20.307 11.265 1.586 1.00 0.00 H new ATOM 0 HA GLU A 51 20.421 11.897 3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.613 9.611 4.801 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.224 9.509 4.118 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.267 11.864 5.641 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.325 10.742 6.603 1.00 0.00 H new ATOM 845 N SER A 52 22.219 12.637 1.983 1.00 0.00 N ATOM 846 CA SER A 52 23.375 13.261 1.344 1.00 0.00 C ATOM 847 C SER A 52 23.595 14.521 2.194 1.00 0.00 C ATOM 848 O SER A 52 23.464 15.599 1.643 1.00 0.00 O ATOM 849 CB SER A 52 23.100 13.638 -0.060 1.00 0.00 C ATOM 850 OG SER A 52 24.276 14.250 -0.585 1.00 0.00 O ATOM 0 H SER A 52 21.310 12.934 1.628 1.00 0.00 H new ATOM 0 HA SER A 52 24.235 12.593 1.301 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.833 12.759 -0.646 1.00 0.00 H new ATOM 0 HB3 SER A 52 22.256 14.325 -0.113 1.00 0.00 H new ATOM 0 HG SER A 52 24.442 15.095 -0.117 1.00 0.00 H new ATOM 856 N SER A 53 23.890 14.280 3.449 1.00 0.00 N ATOM 857 CA SER A 53 24.106 15.292 4.464 1.00 0.00 C ATOM 858 C SER A 53 25.228 16.226 4.118 1.00 0.00 C ATOM 859 O SER A 53 25.691 16.167 2.977 1.00 0.00 O ATOM 860 CB SER A 53 24.275 14.742 5.893 1.00 0.00 C ATOM 861 OG SER A 53 24.700 13.408 5.910 1.00 0.00 O ATOM 0 H SER A 53 23.991 13.331 3.810 1.00 0.00 H new ATOM 0 HA SER A 53 23.176 15.860 4.468 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.997 15.356 6.432 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.327 14.824 6.424 1.00 0.00 H new ATOM 0 HG SER A 53 24.794 13.106 6.838 1.00 0.00 H new ATOM 867 N ASN A 54 25.686 17.076 4.991 1.00 0.00 N ATOM 868 CA ASN A 54 26.778 18.006 4.576 1.00 0.00 C ATOM 869 C ASN A 54 28.070 17.271 4.652 1.00 0.00 C ATOM 870 O ASN A 54 29.053 17.867 5.149 1.00 0.00 O ATOM 871 CB ASN A 54 26.839 19.292 5.439 1.00 0.00 C ATOM 872 CG ASN A 54 27.835 20.319 4.952 1.00 0.00 C ATOM 873 OD1 ASN A 54 28.160 20.298 3.641 1.00 0.00 O flip ATOM 874 ND2 ASN A 54 28.295 21.111 5.763 1.00 0.00 N flip ATOM 0 H ASN A 54 25.363 17.170 5.954 1.00 0.00 H new ATOM 0 HA ASN A 54 26.575 18.336 3.557 1.00 0.00 H new ATOM 0 HB2 ASN A 54 25.849 19.746 5.464 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.089 19.017 6.464 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.003 21.068 6.739 1.00 0.00 H new ATOM 0 HD22 ASN A 54 28.970 21.814 5.463 1.00 0.00 H new ATOM 881 N PHE A 55 28.201 16.038 4.248 1.00 0.00 N ATOM 882 CA PHE A 55 29.498 15.380 4.407 1.00 0.00 C ATOM 883 C PHE A 55 29.767 14.153 3.653 1.00 0.00 C ATOM 884 O PHE A 55 30.644 14.181 2.802 1.00 0.00 O ATOM 885 CB PHE A 55 29.503 14.794 5.838 1.00 0.00 C ATOM 886 CG PHE A 55 29.729 15.805 6.899 1.00 0.00 C ATOM 887 CD1 PHE A 55 30.880 16.551 7.037 1.00 0.00 C ATOM 888 CD2 PHE A 55 28.707 16.031 7.838 1.00 0.00 C ATOM 889 CE1 PHE A 55 31.023 17.482 8.061 1.00 0.00 C ATOM 890 CE2 PHE A 55 28.839 16.966 8.873 1.00 0.00 C ATOM 891 CZ PHE A 55 30.010 17.705 8.996 1.00 0.00 C ATOM 0 H PHE A 55 27.466 15.474 3.821 1.00 0.00 H new ATOM 0 HA PHE A 55 30.203 16.153 4.102 1.00 0.00 H new ATOM 0 HB2 PHE A 55 28.550 14.297 6.020 1.00 0.00 H new ATOM 0 HB3 PHE A 55 30.279 14.031 5.905 1.00 0.00 H new ATOM 0 HD1 PHE A 55 31.688 16.410 6.335 1.00 0.00 H new ATOM 0 HD2 PHE A 55 27.790 15.465 7.759 1.00 0.00 H new ATOM 0 HE1 PHE A 55 31.941 18.047 8.135 1.00 0.00 H new ATOM 0 HE2 PHE A 55 28.031 17.113 9.575 1.00 0.00 H new ATOM 0 HZ PHE A 55 30.132 18.428 9.789 1.00 0.00 H new ATOM 901 N ARG A 56 29.056 13.072 3.928 1.00 0.00 N ATOM 902 CA ARG A 56 29.264 11.824 3.230 1.00 0.00 C ATOM 903 C ARG A 56 28.094 11.548 2.346 1.00 0.00 C ATOM 904 O ARG A 56 27.291 10.675 2.638 1.00 0.00 O ATOM 905 CB ARG A 56 29.417 10.646 4.195 1.00 0.00 C ATOM 906 CG ARG A 56 30.029 9.443 3.508 1.00 0.00 C ATOM 907 CD ARG A 56 29.851 8.164 4.311 1.00 0.00 C ATOM 908 NE ARG A 56 31.063 7.373 4.422 1.00 0.00 N ATOM 909 CZ ARG A 56 31.046 6.045 4.508 1.00 0.00 C ATOM 910 NH1 ARG A 56 29.947 5.313 4.504 1.00 0.00 N ATOM 911 NH2 ARG A 56 32.229 5.431 4.602 1.00 0.00 N ATOM 0 H ARG A 56 28.324 13.039 4.638 1.00 0.00 H new ATOM 0 HA ARG A 56 30.183 11.925 2.652 1.00 0.00 H new ATOM 0 HB2 ARG A 56 30.042 10.943 5.037 1.00 0.00 H new ATOM 0 HB3 ARG A 56 28.442 10.378 4.601 1.00 0.00 H new ATOM 0 HG2 ARG A 56 29.574 9.318 2.526 1.00 0.00 H new ATOM 0 HG3 ARG A 56 31.092 9.622 3.346 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.501 8.419 5.311 1.00 0.00 H new ATOM 0 HD3 ARG A 56 29.073 7.558 3.846 1.00 0.00 H new ATOM 0 HE ARG A 56 31.963 7.854 4.435 1.00 0.00 H new ATOM 0 HH11 ARG A 56 29.035 5.763 4.432 1.00 0.00 H new ATOM 0 HH12 ARG A 56 30.010 4.297 4.573 1.00 0.00 H new ATOM 0 HH21 ARG A 56 33.089 5.979 4.605 1.00 0.00 H new ATOM 0 HH22 ARG A 56 32.272 4.414 4.670 1.00 0.00 H new ATOM 925 N ASN A 57 28.081 12.328 1.310 1.00 0.00 N ATOM 926 CA ASN A 57 27.082 12.293 0.297 1.00 0.00 C ATOM 927 C ASN A 57 26.945 10.828 -0.119 1.00 0.00 C ATOM 928 O ASN A 57 27.925 10.289 -0.614 1.00 0.00 O ATOM 929 CB ASN A 57 27.508 13.195 -0.854 1.00 0.00 C ATOM 930 CG ASN A 57 27.347 12.502 -2.211 1.00 0.00 C ATOM 931 OD1 ASN A 57 28.294 11.936 -2.795 1.00 0.00 O ATOM 932 ND2 ASN A 57 26.144 12.526 -2.751 1.00 0.00 N ATOM 0 H ASN A 57 28.798 13.034 1.144 1.00 0.00 H new ATOM 0 HA ASN A 57 26.115 12.663 0.639 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.913 14.108 -0.839 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.548 13.490 -0.718 1.00 0.00 H new ATOM 0 HD21 ASN A 57 25.981 12.080 -3.654 1.00 0.00 H new ATOM 0 HD22 ASN A 57 25.377 12.991 -2.266 1.00 0.00 H new ATOM 939 N ILE A 58 25.773 10.262 0.088 1.00 0.00 N ATOM 940 CA ILE A 58 25.457 8.928 -0.232 1.00 0.00 C ATOM 941 C ILE A 58 24.008 8.637 0.201 1.00 0.00 C ATOM 942 O ILE A 58 23.357 9.518 0.761 1.00 0.00 O ATOM 943 CB ILE A 58 26.351 7.994 0.559 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.673 6.683 -0.114 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.764 7.771 1.943 1.00 0.00 C ATOM 946 CD1 ILE A 58 28.151 6.394 -0.004 1.00 0.00 C ATOM 0 H ILE A 58 24.991 10.766 0.506 1.00 0.00 H new ATOM 0 HA ILE A 58 25.589 8.780 -1.304 1.00 0.00 H new ATOM 0 HB ILE A 58 27.314 8.499 0.631 1.00 0.00 H new ATOM 0 HG12 ILE A 58 26.102 5.878 0.348 1.00 0.00 H new ATOM 0 HG13 ILE A 58 26.379 6.722 -1.163 1.00 0.00 H new ATOM 0 HG21 ILE A 58 26.410 7.099 2.508 1.00 0.00 H new ATOM 0 HG22 ILE A 58 25.688 8.725 2.464 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.772 7.329 1.851 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.374 5.446 -0.493 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.715 7.192 -0.487 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.433 6.335 1.047 1.00 0.00 H new ATOM 958 N ASP A 59 23.654 7.419 -0.111 1.00 0.00 N ATOM 959 CA ASP A 59 22.333 6.978 0.225 1.00 0.00 C ATOM 960 C ASP A 59 22.495 5.715 1.014 1.00 0.00 C ATOM 961 O ASP A 59 23.501 5.020 0.814 1.00 0.00 O ATOM 962 CB ASP A 59 21.595 6.573 -1.067 1.00 0.00 C ATOM 963 CG ASP A 59 22.386 5.897 -2.157 1.00 0.00 C ATOM 964 OD1 ASP A 59 23.506 6.269 -2.443 1.00 0.00 O ATOM 965 OD2 ASP A 59 21.769 4.901 -2.744 1.00 0.00 O ATOM 0 H ASP A 59 24.244 6.734 -0.583 1.00 0.00 H new ATOM 0 HA ASP A 59 21.793 7.759 0.759 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.777 5.909 -0.789 1.00 0.00 H new ATOM 0 HB3 ASP A 59 21.146 7.472 -1.490 1.00 0.00 H new ATOM 970 N VAL A 60 21.525 5.452 1.873 1.00 0.00 N ATOM 971 CA VAL A 60 21.576 4.271 2.675 1.00 0.00 C ATOM 972 C VAL A 60 20.325 3.456 2.425 1.00 0.00 C ATOM 973 O VAL A 60 19.196 3.961 2.508 1.00 0.00 O ATOM 974 CB VAL A 60 21.689 4.618 4.154 1.00 0.00 C ATOM 975 CG1 VAL A 60 22.024 3.365 4.951 1.00 0.00 C ATOM 976 CG2 VAL A 60 22.826 5.600 4.388 1.00 0.00 C ATOM 0 H VAL A 60 20.706 6.042 2.023 1.00 0.00 H new ATOM 0 HA VAL A 60 22.459 3.693 2.401 1.00 0.00 H new ATOM 0 HB VAL A 60 20.738 5.049 4.466 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.104 3.617 6.008 1.00 0.00 H new ATOM 0 HG12 VAL A 60 21.236 2.625 4.813 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.972 2.955 4.603 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.891 5.835 5.450 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.765 5.155 4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 60 22.639 6.514 3.824 1.00 0.00 H new ATOM 986 N VAL A 61 20.462 2.188 2.110 1.00 0.00 N ATOM 987 CA VAL A 61 19.315 1.312 1.848 1.00 0.00 C ATOM 988 C VAL A 61 19.271 0.151 2.764 1.00 0.00 C ATOM 989 O VAL A 61 20.298 -0.488 2.979 1.00 0.00 O ATOM 990 CB VAL A 61 19.388 0.830 0.403 1.00 0.00 C ATOM 991 CG1 VAL A 61 20.837 0.795 -0.104 1.00 0.00 C ATOM 992 CG2 VAL A 61 18.831 -0.586 0.268 1.00 0.00 C ATOM 0 H VAL A 61 21.366 1.724 2.025 1.00 0.00 H new ATOM 0 HA VAL A 61 18.404 1.885 2.019 1.00 0.00 H new ATOM 0 HB VAL A 61 18.798 1.534 -0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 61 20.853 0.447 -1.137 1.00 0.00 H new ATOM 0 HG12 VAL A 61 21.265 1.796 -0.052 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.423 0.117 0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.895 -0.905 -0.772 1.00 0.00 H new ATOM 0 HG22 VAL A 61 19.411 -1.266 0.892 1.00 0.00 H new ATOM 0 HG23 VAL A 61 17.789 -0.599 0.588 1.00 0.00 H new ATOM 1002 N PHE A 62 18.096 -0.120 3.298 1.00 0.00 N ATOM 1003 CA PHE A 62 17.971 -1.233 4.198 1.00 0.00 C ATOM 1004 C PHE A 62 16.567 -1.826 4.162 1.00 0.00 C ATOM 1005 O PHE A 62 15.604 -1.088 4.395 1.00 0.00 O ATOM 1006 CB PHE A 62 18.234 -0.752 5.635 1.00 0.00 C ATOM 1007 CG PHE A 62 17.759 0.680 5.914 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.553 1.758 5.537 1.00 0.00 C ATOM 1009 CD2 PHE A 62 16.544 0.918 6.539 1.00 0.00 C ATOM 1010 CE1 PHE A 62 18.147 3.053 5.777 1.00 0.00 C ATOM 1011 CE2 PHE A 62 16.090 2.209 6.802 1.00 0.00 C ATOM 1012 CZ PHE A 62 16.916 3.256 6.408 1.00 0.00 C ATOM 0 H PHE A 62 17.238 0.404 3.126 1.00 0.00 H new ATOM 0 HA PHE A 62 18.691 -1.991 3.889 1.00 0.00 H new ATOM 0 HB2 PHE A 62 17.738 -1.430 6.330 1.00 0.00 H new ATOM 0 HB3 PHE A 62 19.303 -0.814 5.837 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.500 1.578 5.050 1.00 0.00 H new ATOM 0 HD2 PHE A 62 15.931 0.078 6.831 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.764 3.890 5.485 1.00 0.00 H new ATOM 0 HE2 PHE A 62 15.142 2.388 7.288 1.00 0.00 H new ATOM 0 HZ PHE A 62 16.593 4.269 6.597 1.00 0.00 H new ATOM 1022 N GLU A 63 16.529 -3.111 3.876 1.00 0.00 N ATOM 1023 CA GLU A 63 15.321 -3.917 3.780 1.00 0.00 C ATOM 1024 C GLU A 63 14.690 -3.938 5.167 1.00 0.00 C ATOM 1025 O GLU A 63 14.717 -5.007 5.798 1.00 0.00 O ATOM 1026 CB GLU A 63 15.567 -5.328 3.231 1.00 0.00 C ATOM 1027 CG GLU A 63 15.175 -5.395 1.724 1.00 0.00 C ATOM 1028 CD GLU A 63 15.977 -6.392 0.963 1.00 0.00 C ATOM 1029 OE1 GLU A 63 17.168 -6.242 0.690 1.00 0.00 O ATOM 1030 OE2 GLU A 63 15.244 -7.441 0.631 1.00 0.00 O ATOM 0 H GLU A 63 17.376 -3.650 3.695 1.00 0.00 H new ATOM 0 HA GLU A 63 14.643 -3.470 3.053 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.616 -5.596 3.354 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.984 -6.054 3.798 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.118 -5.645 1.639 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.307 -4.411 1.275 1.00 0.00 H new ATOM 1037 N LEU A 64 14.148 -2.799 5.608 1.00 0.00 N ATOM 1038 CA LEU A 64 13.504 -2.619 6.883 1.00 0.00 C ATOM 1039 C LEU A 64 14.118 -3.462 7.991 1.00 0.00 C ATOM 1040 O LEU A 64 13.585 -4.562 8.228 1.00 0.00 O ATOM 1041 CB LEU A 64 11.988 -2.920 6.755 1.00 0.00 C ATOM 1042 CG LEU A 64 11.107 -1.669 6.601 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.085 -1.953 5.494 1.00 0.00 C ATOM 1044 CD2 LEU A 64 10.295 -1.415 7.870 1.00 0.00 C ATOM 0 H LEU A 64 14.154 -1.946 5.049 1.00 0.00 H new ATOM 0 HA LEU A 64 13.655 -1.578 7.169 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.830 -3.570 5.895 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.663 -3.473 7.636 1.00 0.00 H new ATOM 0 HG LEU A 64 11.749 -0.814 6.387 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.443 -1.083 5.360 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.608 -2.165 4.562 1.00 0.00 H new ATOM 0 HD13 LEU A 64 9.476 -2.813 5.773 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.680 -0.525 7.736 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.653 -2.273 8.069 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.972 -1.265 8.711 1.00 0.00 H new ATOM 1056 N GLY A 65 15.164 -3.051 8.673 1.00 0.00 N ATOM 1057 CA GLY A 65 15.763 -3.860 9.755 1.00 0.00 C ATOM 1058 C GLY A 65 16.938 -4.741 9.371 1.00 0.00 C ATOM 1059 O GLY A 65 16.903 -5.962 9.602 1.00 0.00 O ATOM 0 H GLY A 65 15.632 -2.160 8.510 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.088 -3.184 10.546 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.984 -4.495 10.177 1.00 0.00 H new ATOM 1063 N VAL A 66 18.029 -4.248 8.777 1.00 0.00 N ATOM 1064 CA VAL A 66 19.178 -5.063 8.387 1.00 0.00 C ATOM 1065 C VAL A 66 20.322 -4.743 9.331 1.00 0.00 C ATOM 1066 O VAL A 66 20.225 -3.779 10.079 1.00 0.00 O ATOM 1067 CB VAL A 66 19.517 -4.829 6.925 1.00 0.00 C ATOM 1068 CG1 VAL A 66 18.781 -5.859 6.098 1.00 0.00 C ATOM 1069 CG2 VAL A 66 19.145 -3.402 6.496 1.00 0.00 C ATOM 0 H VAL A 66 18.138 -3.259 8.552 1.00 0.00 H new ATOM 0 HA VAL A 66 18.958 -6.127 8.472 1.00 0.00 H new ATOM 0 HB VAL A 66 20.591 -4.935 6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 66 19.010 -5.710 5.043 1.00 0.00 H new ATOM 0 HG12 VAL A 66 19.094 -6.859 6.399 1.00 0.00 H new ATOM 0 HG13 VAL A 66 17.708 -5.752 6.255 1.00 0.00 H new ATOM 0 HG21 VAL A 66 19.398 -3.260 5.445 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.075 -3.247 6.636 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.698 -2.684 7.102 1.00 0.00 H new ATOM 1079 N ASP A 67 21.409 -5.471 9.366 1.00 0.00 N ATOM 1080 CA ASP A 67 22.483 -5.162 10.276 1.00 0.00 C ATOM 1081 C ASP A 67 23.740 -4.651 9.711 1.00 0.00 C ATOM 1082 O ASP A 67 24.470 -5.340 8.972 1.00 0.00 O ATOM 1083 CB ASP A 67 22.635 -6.385 11.231 1.00 0.00 C ATOM 1084 CG ASP A 67 22.867 -7.674 10.544 1.00 0.00 C ATOM 1085 OD1 ASP A 67 22.138 -8.070 9.646 1.00 0.00 O ATOM 1086 OD2 ASP A 67 23.911 -8.320 10.996 1.00 0.00 O ATOM 0 H ASP A 67 21.574 -6.284 8.773 1.00 0.00 H new ATOM 0 HA ASP A 67 22.198 -4.268 10.830 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.464 -6.197 11.913 1.00 0.00 H new ATOM 0 HB3 ASP A 67 21.735 -6.469 11.840 1.00 0.00 H new ATOM 1091 N PHE A 68 24.112 -3.408 10.003 1.00 0.00 N ATOM 1092 CA PHE A 68 25.334 -2.806 9.501 1.00 0.00 C ATOM 1093 C PHE A 68 26.029 -1.921 10.533 1.00 0.00 C ATOM 1094 O PHE A 68 25.441 -0.966 11.020 1.00 0.00 O ATOM 1095 CB PHE A 68 25.243 -1.998 8.168 1.00 0.00 C ATOM 1096 CG PHE A 68 24.389 -2.595 7.109 1.00 0.00 C ATOM 1097 CD1 PHE A 68 24.649 -3.835 6.516 1.00 0.00 C ATOM 1098 CD2 PHE A 68 23.272 -1.887 6.684 1.00 0.00 C ATOM 1099 CE1 PHE A 68 23.822 -4.360 5.527 1.00 0.00 C ATOM 1100 CE2 PHE A 68 22.446 -2.405 5.700 1.00 0.00 C ATOM 1101 CZ PHE A 68 22.715 -3.641 5.116 1.00 0.00 C ATOM 0 H PHE A 68 23.565 -2.788 10.601 1.00 0.00 H new ATOM 0 HA PHE A 68 25.917 -3.700 9.281 1.00 0.00 H new ATOM 0 HB2 PHE A 68 24.865 -1.001 8.394 1.00 0.00 H new ATOM 0 HB3 PHE A 68 26.250 -1.875 7.770 1.00 0.00 H new ATOM 0 HD1 PHE A 68 25.513 -4.399 6.834 1.00 0.00 H new ATOM 0 HD2 PHE A 68 23.046 -0.927 7.123 1.00 0.00 H new ATOM 0 HE1 PHE A 68 24.043 -5.320 5.085 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.581 -1.843 5.381 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.064 -4.034 4.349 1.00 0.00 H new ATOM 1111 N ALA A 69 27.263 -2.245 10.841 1.00 0.00 N ATOM 1112 CA ALA A 69 28.008 -1.462 11.807 1.00 0.00 C ATOM 1113 C ALA A 69 28.461 -0.161 11.132 1.00 0.00 C ATOM 1114 O ALA A 69 29.567 0.018 10.622 1.00 0.00 O ATOM 1115 CB ALA A 69 29.172 -2.270 12.300 1.00 0.00 C ATOM 0 H ALA A 69 27.770 -3.036 10.444 1.00 0.00 H new ATOM 0 HA ALA A 69 27.391 -1.207 12.668 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.737 -1.687 13.027 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.808 -3.183 12.771 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.818 -2.527 11.461 1.00 0.00 H new ATOM 1121 N TYR A 70 27.512 0.772 11.157 1.00 0.00 N ATOM 1122 CA TYR A 70 27.667 2.079 10.599 1.00 0.00 C ATOM 1123 C TYR A 70 27.698 3.134 11.682 1.00 0.00 C ATOM 1124 O TYR A 70 26.660 3.501 12.188 1.00 0.00 O ATOM 1125 CB TYR A 70 26.436 2.475 9.737 1.00 0.00 C ATOM 1126 CG TYR A 70 26.502 3.929 9.252 1.00 0.00 C ATOM 1127 CD1 TYR A 70 27.653 4.517 8.756 1.00 0.00 C ATOM 1128 CD2 TYR A 70 25.341 4.717 9.306 1.00 0.00 C ATOM 1129 CE1 TYR A 70 27.638 5.847 8.328 1.00 0.00 C ATOM 1130 CE2 TYR A 70 25.298 6.064 8.883 1.00 0.00 C ATOM 1131 CZ TYR A 70 26.478 6.620 8.388 1.00 0.00 C ATOM 1132 OH TYR A 70 26.555 7.926 7.942 1.00 0.00 O ATOM 0 H TYR A 70 26.597 0.619 11.581 1.00 0.00 H new ATOM 0 HA TYR A 70 28.590 2.039 10.020 1.00 0.00 H new ATOM 0 HB2 TYR A 70 26.371 1.811 8.875 1.00 0.00 H new ATOM 0 HB3 TYR A 70 25.527 2.331 10.320 1.00 0.00 H new ATOM 0 HD1 TYR A 70 28.567 3.945 8.700 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.436 4.271 9.690 1.00 0.00 H new ATOM 0 HE1 TYR A 70 28.546 6.287 7.942 1.00 0.00 H new ATOM 0 HE2 TYR A 70 24.387 6.641 8.941 1.00 0.00 H new ATOM 0 HH TYR A 70 25.679 8.356 8.036 1.00 0.00 H new ATOM 1142 N SER A 71 28.904 3.608 12.022 1.00 0.00 N ATOM 1143 CA SER A 71 29.029 4.619 13.047 1.00 0.00 C ATOM 1144 C SER A 71 28.289 5.899 12.716 1.00 0.00 C ATOM 1145 O SER A 71 28.543 6.586 11.739 1.00 0.00 O ATOM 1146 CB SER A 71 30.467 5.035 13.320 1.00 0.00 C ATOM 1147 OG SER A 71 30.855 6.252 12.751 1.00 0.00 O ATOM 0 H SER A 71 29.784 3.306 11.604 1.00 0.00 H new ATOM 0 HA SER A 71 28.597 4.130 13.920 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.612 5.094 14.399 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.130 4.253 12.952 1.00 0.00 H new ATOM 0 HG SER A 71 30.264 6.464 11.999 1.00 0.00 H new ATOM 1153 N LEU A 72 27.337 6.203 13.586 1.00 0.00 N ATOM 1154 CA LEU A 72 26.495 7.354 13.498 1.00 0.00 C ATOM 1155 C LEU A 72 27.450 8.536 13.430 1.00 0.00 C ATOM 1156 O LEU A 72 27.967 9.055 14.428 1.00 0.00 O ATOM 1157 CB LEU A 72 25.629 7.425 14.766 1.00 0.00 C ATOM 1158 CG LEU A 72 24.735 8.666 14.759 1.00 0.00 C ATOM 1159 CD1 LEU A 72 25.458 9.891 15.302 1.00 0.00 C ATOM 1160 CD2 LEU A 72 24.261 8.909 13.336 1.00 0.00 C ATOM 0 H LEU A 72 27.134 5.622 14.399 1.00 0.00 H new ATOM 0 HA LEU A 72 25.827 7.336 12.637 1.00 0.00 H new ATOM 0 HB2 LEU A 72 25.012 6.530 14.838 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.271 7.441 15.647 1.00 0.00 H new ATOM 0 HG LEU A 72 23.882 8.491 15.415 1.00 0.00 H new ATOM 0 HD11 LEU A 72 24.787 10.750 15.279 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.772 9.703 16.329 1.00 0.00 H new ATOM 0 HD13 LEU A 72 26.334 10.099 14.687 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.621 9.791 13.311 1.00 0.00 H new ATOM 0 HD22 LEU A 72 25.123 9.067 12.688 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.698 8.043 12.987 1.00 0.00 H new ATOM 1172 N ALA A 73 27.664 8.949 12.187 1.00 0.00 N ATOM 1173 CA ALA A 73 28.517 10.046 11.757 1.00 0.00 C ATOM 1174 C ALA A 73 29.736 10.271 12.649 1.00 0.00 C ATOM 1175 O ALA A 73 29.733 11.230 13.426 1.00 0.00 O ATOM 1176 CB ALA A 73 27.677 11.297 11.538 1.00 0.00 C ATOM 0 H ALA A 73 27.212 8.491 11.396 1.00 0.00 H new ATOM 0 HA ALA A 73 28.959 9.767 10.800 1.00 0.00 H new ATOM 0 HB1 ALA A 73 28.321 12.116 11.216 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.927 11.102 10.771 1.00 0.00 H new ATOM 0 HB3 ALA A 73 27.181 11.570 12.470 1.00 0.00 H new ATOM 1182 N ASP A 74 30.743 9.389 12.514 1.00 0.00 N ATOM 1183 CA ASP A 74 31.993 9.401 13.245 1.00 0.00 C ATOM 1184 C ASP A 74 32.020 8.856 14.648 1.00 0.00 C ATOM 1185 O ASP A 74 33.103 8.782 15.235 1.00 0.00 O ATOM 1186 CB ASP A 74 32.723 10.716 13.227 1.00 0.00 C ATOM 1187 CG ASP A 74 33.819 10.636 12.176 1.00 0.00 C ATOM 1188 OD1 ASP A 74 34.908 9.983 12.353 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.664 11.255 11.039 1.00 0.00 O ATOM 0 H ASP A 74 30.689 8.614 11.854 1.00 0.00 H new ATOM 0 HA ASP A 74 32.519 8.664 12.638 1.00 0.00 H new ATOM 0 HB2 ASP A 74 32.035 11.530 12.998 1.00 0.00 H new ATOM 0 HB3 ASP A 74 33.151 10.927 14.207 1.00 0.00 H new ATOM 1194 N GLY A 75 30.915 8.459 15.259 1.00 0.00 N ATOM 1195 CA GLY A 75 30.926 7.925 16.634 1.00 0.00 C ATOM 1196 C GLY A 75 31.607 6.536 16.722 1.00 0.00 C ATOM 1197 O GLY A 75 32.815 6.378 16.859 1.00 0.00 O ATOM 0 H GLY A 75 29.989 8.492 14.832 1.00 0.00 H new ATOM 0 HA2 GLY A 75 31.447 8.624 17.288 1.00 0.00 H new ATOM 0 HA3 GLY A 75 29.902 7.849 17.000 1.00 0.00 H new ATOM 1201 N THR A 76 30.823 5.482 16.638 1.00 0.00 N ATOM 1202 CA THR A 76 31.363 4.155 16.699 1.00 0.00 C ATOM 1203 C THR A 76 30.559 3.104 15.942 1.00 0.00 C ATOM 1204 O THR A 76 31.208 2.183 15.414 1.00 0.00 O ATOM 1205 CB THR A 76 31.537 3.735 18.185 1.00 0.00 C ATOM 1206 OG1 THR A 76 32.881 3.909 18.470 1.00 0.00 O ATOM 1207 CG2 THR A 76 31.232 2.268 18.347 1.00 0.00 C ATOM 0 H THR A 76 29.810 5.526 16.527 1.00 0.00 H new ATOM 0 HA THR A 76 32.327 4.197 16.191 1.00 0.00 H new ATOM 0 HB THR A 76 30.878 4.315 18.831 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.204 4.726 18.037 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.357 1.984 19.392 1.00 0.00 H new ATOM 0 HG22 THR A 76 30.205 2.074 18.038 1.00 0.00 H new ATOM 0 HG23 THR A 76 31.913 1.684 17.728 1.00 0.00 H new ATOM 1215 N GLU A 77 29.236 3.218 15.881 1.00 0.00 N ATOM 1216 CA GLU A 77 28.486 2.177 15.140 1.00 0.00 C ATOM 1217 C GLU A 77 26.979 2.466 15.049 1.00 0.00 C ATOM 1218 O GLU A 77 26.637 3.658 15.049 1.00 0.00 O ATOM 1219 CB GLU A 77 28.671 0.841 15.874 1.00 0.00 C ATOM 1220 CG GLU A 77 28.943 -0.333 14.884 1.00 0.00 C ATOM 1221 CD GLU A 77 30.348 -0.317 14.332 1.00 0.00 C ATOM 1222 OE1 GLU A 77 30.476 0.421 13.272 1.00 0.00 O ATOM 1223 OE2 GLU A 77 31.226 -0.939 14.853 1.00 0.00 O ATOM 0 H GLU A 77 28.679 3.963 16.300 1.00 0.00 H new ATOM 0 HA GLU A 77 28.877 2.154 14.123 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.501 0.924 16.576 1.00 0.00 H new ATOM 0 HB3 GLU A 77 27.779 0.622 16.460 1.00 0.00 H new ATOM 0 HG2 GLU A 77 28.768 -1.280 15.394 1.00 0.00 H new ATOM 0 HG3 GLU A 77 28.232 -0.279 14.059 1.00 0.00 H new ATOM 1230 N LEU A 78 26.148 1.448 14.999 1.00 0.00 N ATOM 1231 CA LEU A 78 24.699 1.457 14.942 1.00 0.00 C ATOM 1232 C LEU A 78 24.335 0.283 13.972 1.00 0.00 C ATOM 1233 O LEU A 78 23.859 0.444 12.846 1.00 0.00 O ATOM 1234 CB LEU A 78 24.113 2.737 14.317 1.00 0.00 C ATOM 1235 CG LEU A 78 23.570 3.715 15.378 1.00 0.00 C ATOM 1236 CD1 LEU A 78 22.687 4.751 14.732 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.615 2.876 16.238 1.00 0.00 C ATOM 0 H LEU A 78 26.507 0.493 14.997 1.00 0.00 H new ATOM 0 HA LEU A 78 24.302 1.380 15.954 1.00 0.00 H new ATOM 0 HB2 LEU A 78 24.883 3.235 13.728 1.00 0.00 H new ATOM 0 HB3 LEU A 78 23.310 2.468 13.630 1.00 0.00 H new ATOM 0 HG LEU A 78 24.393 4.189 15.913 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.311 5.434 15.493 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.262 5.311 13.994 1.00 0.00 H new ATOM 0 HD13 LEU A 78 21.848 4.259 14.240 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.185 3.502 17.020 1.00 0.00 H new ATOM 0 HD22 LEU A 78 21.817 2.477 15.612 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.164 2.052 16.694 1.00 0.00 H new ATOM 1249 N THR A 79 24.608 -0.850 14.513 1.00 0.00 N ATOM 1250 CA THR A 79 24.402 -2.141 13.873 1.00 0.00 C ATOM 1251 C THR A 79 22.921 -2.481 14.085 1.00 0.00 C ATOM 1252 O THR A 79 22.082 -1.719 13.550 1.00 0.00 O ATOM 1253 CB THR A 79 25.283 -3.287 14.432 1.00 0.00 C ATOM 1254 OG1 THR A 79 26.610 -2.800 14.343 1.00 0.00 O ATOM 1255 CG2 THR A 79 25.102 -4.655 13.806 1.00 0.00 C ATOM 0 H THR A 79 24.998 -0.928 15.452 1.00 0.00 H new ATOM 0 HA THR A 79 24.687 -2.058 12.824 1.00 0.00 H new ATOM 0 HB THR A 79 24.978 -3.508 15.455 1.00 0.00 H new ATOM 0 HG1 THR A 79 27.231 -3.477 14.684 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.775 -5.366 14.285 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.071 -4.983 13.941 1.00 0.00 H new ATOM 0 HG23 THR A 79 25.330 -4.601 12.741 1.00 0.00 H new ATOM 1263 N GLY A 80 22.588 -3.527 14.803 1.00 0.00 N ATOM 1264 CA GLY A 80 21.213 -3.945 15.059 1.00 0.00 C ATOM 1265 C GLY A 80 20.470 -3.829 13.727 1.00 0.00 C ATOM 1266 O GLY A 80 20.665 -4.598 12.807 1.00 0.00 O ATOM 0 H GLY A 80 23.280 -4.134 15.242 1.00 0.00 H new ATOM 0 HA2 GLY A 80 21.182 -4.968 15.433 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.750 -3.314 15.818 1.00 0.00 H new ATOM 1270 N THR A 81 19.627 -2.801 13.751 1.00 0.00 N ATOM 1271 CA THR A 81 18.791 -2.452 12.622 1.00 0.00 C ATOM 1272 C THR A 81 18.125 -1.075 12.777 1.00 0.00 C ATOM 1273 O THR A 81 18.646 -0.262 13.542 1.00 0.00 O ATOM 1274 CB THR A 81 17.629 -3.472 12.560 1.00 0.00 C ATOM 1275 OG1 THR A 81 16.395 -2.994 13.056 1.00 0.00 O ATOM 1276 CG2 THR A 81 17.892 -4.824 13.246 1.00 0.00 C ATOM 0 H THR A 81 19.509 -2.189 14.559 1.00 0.00 H new ATOM 0 HA THR A 81 19.429 -2.447 11.738 1.00 0.00 H new ATOM 0 HB THR A 81 17.566 -3.625 11.483 1.00 0.00 H new ATOM 0 HG1 THR A 81 15.776 -2.849 12.310 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.014 -5.461 13.143 1.00 0.00 H new ATOM 0 HG22 THR A 81 18.749 -5.309 12.779 1.00 0.00 H new ATOM 0 HG23 THR A 81 18.099 -4.661 14.304 1.00 0.00 H new ATOM 1284 N TRP A 82 17.064 -0.895 12.062 1.00 0.00 N ATOM 1285 CA TRP A 82 16.206 0.257 12.027 1.00 0.00 C ATOM 1286 C TRP A 82 14.869 -0.373 11.540 1.00 0.00 C ATOM 1287 O TRP A 82 14.718 -1.621 11.662 1.00 0.00 O ATOM 1288 CB TRP A 82 16.486 1.352 10.994 1.00 0.00 C ATOM 1289 CG TRP A 82 17.841 1.935 10.886 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.052 1.396 11.094 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.078 3.295 10.508 1.00 0.00 C ATOM 1292 NE1 TRP A 82 19.999 2.366 10.862 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.463 3.567 10.496 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.254 4.387 10.158 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 19.984 4.803 10.172 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 17.756 5.616 9.837 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.123 5.825 9.843 1.00 0.00 C ATOM 0 H TRP A 82 16.739 -1.620 11.422 1.00 0.00 H new ATOM 0 HA TRP A 82 16.286 0.751 12.995 1.00 0.00 H new ATOM 0 HB2 TRP A 82 16.227 0.948 10.015 1.00 0.00 H new ATOM 0 HB3 TRP A 82 15.795 2.171 11.194 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.249 0.377 11.392 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.002 2.204 10.954 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.184 4.245 10.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.052 4.966 10.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.087 6.423 9.579 1.00 0.00 H new ATOM 0 HH2 TRP A 82 19.518 6.797 9.588 1.00 0.00 H new ATOM 1308 N THR A 83 13.938 0.383 11.019 1.00 0.00 N ATOM 1309 CA THR A 83 12.645 -0.082 10.519 1.00 0.00 C ATOM 1310 C THR A 83 11.693 1.065 10.861 1.00 0.00 C ATOM 1311 O THR A 83 12.065 2.053 11.432 1.00 0.00 O ATOM 1312 CB THR A 83 12.023 -1.327 11.164 1.00 0.00 C ATOM 1313 OG1 THR A 83 12.359 -1.394 12.518 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.405 -2.643 10.454 1.00 0.00 C ATOM 0 H THR A 83 14.055 1.392 10.921 1.00 0.00 H new ATOM 0 HA THR A 83 12.797 -0.354 9.474 1.00 0.00 H new ATOM 0 HB THR A 83 10.944 -1.219 11.057 1.00 0.00 H new ATOM 0 HG1 THR A 83 13.220 -1.851 12.619 1.00 0.00 H new ATOM 0 HG21 THR A 83 11.930 -3.482 10.963 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.067 -2.609 9.418 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.487 -2.769 10.479 1.00 0.00 H new ATOM 1322 N MET A 84 10.443 0.948 10.519 1.00 0.00 N ATOM 1323 CA MET A 84 9.419 1.938 10.804 1.00 0.00 C ATOM 1324 C MET A 84 8.208 1.146 11.293 1.00 0.00 C ATOM 1325 O MET A 84 8.348 0.056 11.821 1.00 0.00 O ATOM 1326 CB MET A 84 9.095 2.702 9.522 1.00 0.00 C ATOM 1327 CG MET A 84 8.444 1.837 8.427 1.00 0.00 C ATOM 1328 SD MET A 84 7.296 2.694 7.317 1.00 0.00 S ATOM 1329 CE MET A 84 6.826 1.267 6.294 1.00 0.00 C ATOM 0 H MET A 84 10.086 0.136 10.016 1.00 0.00 H new ATOM 0 HA MET A 84 9.732 2.668 11.550 1.00 0.00 H new ATOM 0 HB2 MET A 84 8.427 3.529 9.763 1.00 0.00 H new ATOM 0 HB3 MET A 84 10.013 3.138 9.129 1.00 0.00 H new ATOM 0 HG2 MET A 84 9.236 1.391 7.825 1.00 0.00 H new ATOM 0 HG3 MET A 84 7.910 1.018 8.908 1.00 0.00 H new ATOM 0 HE1 MET A 84 6.464 1.616 5.327 1.00 0.00 H new ATOM 0 HE2 MET A 84 7.694 0.624 6.146 1.00 0.00 H new ATOM 0 HE3 MET A 84 6.038 0.704 6.795 1.00 0.00 H new ATOM 1339 N GLU A 85 7.040 1.725 11.103 1.00 0.00 N ATOM 1340 CA GLU A 85 5.825 1.032 11.544 1.00 0.00 C ATOM 1341 C GLU A 85 4.653 1.523 10.783 1.00 0.00 C ATOM 1342 O GLU A 85 3.570 1.817 11.319 1.00 0.00 O ATOM 1343 CB GLU A 85 5.597 1.358 13.023 1.00 0.00 C ATOM 1344 CG GLU A 85 4.787 0.274 13.736 1.00 0.00 C ATOM 1345 CD GLU A 85 3.408 0.671 14.173 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.260 1.548 14.985 1.00 0.00 O ATOM 1347 OE2 GLU A 85 2.446 -0.016 13.590 1.00 0.00 O ATOM 0 H GLU A 85 6.896 2.635 10.666 1.00 0.00 H new ATOM 0 HA GLU A 85 5.943 -0.040 11.385 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.560 1.475 13.520 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.077 2.312 13.107 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.704 -0.587 13.072 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.346 -0.053 14.613 1.00 0.00 H new ATOM 1354 N GLY A 86 4.820 1.639 9.477 1.00 0.00 N ATOM 1355 CA GLY A 86 3.754 2.110 8.653 1.00 0.00 C ATOM 1356 C GLY A 86 3.891 3.603 8.753 1.00 0.00 C ATOM 1357 O GLY A 86 4.292 4.207 7.788 1.00 0.00 O ATOM 0 H GLY A 86 5.682 1.412 8.980 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.854 1.763 7.625 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.783 1.768 9.012 1.00 0.00 H new ATOM 1361 N ASN A 87 3.550 4.141 9.927 1.00 0.00 N ATOM 1362 CA ASN A 87 3.649 5.549 10.102 1.00 0.00 C ATOM 1363 C ASN A 87 4.900 6.047 10.837 1.00 0.00 C ATOM 1364 O ASN A 87 4.895 7.219 11.199 1.00 0.00 O ATOM 1365 CB ASN A 87 2.374 6.350 10.374 1.00 0.00 C ATOM 1366 CG ASN A 87 1.304 5.355 10.706 1.00 0.00 C ATOM 1367 OD1 ASN A 87 0.357 5.142 9.927 1.00 0.00 O ATOM 1368 ND2 ASN A 87 1.465 4.751 11.866 1.00 0.00 N ATOM 0 H ASN A 87 3.214 3.620 10.737 1.00 0.00 H new ATOM 0 HA ASN A 87 3.819 5.825 9.061 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.523 7.047 11.198 1.00 0.00 H new ATOM 0 HB3 ASN A 87 2.095 6.942 9.502 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.786 4.056 12.178 1.00 0.00 H new ATOM 0 HD22 ASN A 87 2.268 4.978 12.452 1.00 0.00 H new ATOM 1375 N LYS A 88 5.908 5.218 11.047 1.00 0.00 N ATOM 1376 CA LYS A 88 7.042 5.738 11.727 1.00 0.00 C ATOM 1377 C LYS A 88 8.240 4.775 11.768 1.00 0.00 C ATOM 1378 O LYS A 88 8.026 3.722 12.299 1.00 0.00 O ATOM 1379 CB LYS A 88 6.883 5.963 13.217 1.00 0.00 C ATOM 1380 CG LYS A 88 5.803 5.245 13.957 1.00 0.00 C ATOM 1381 CD LYS A 88 5.304 6.209 15.022 1.00 0.00 C ATOM 1382 CE LYS A 88 4.097 7.004 14.611 1.00 0.00 C ATOM 1383 NZ LYS A 88 4.440 8.352 14.156 1.00 0.00 N ATOM 0 H LYS A 88 5.952 4.238 10.768 1.00 0.00 H new ATOM 0 HA LYS A 88 7.176 6.653 11.151 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.831 5.704 13.690 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.731 7.031 13.372 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.996 4.957 13.284 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.184 4.329 14.409 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.065 5.646 15.924 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.109 6.897 15.280 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.574 6.477 13.813 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.408 7.073 15.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.677 8.719 13.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.561 8.976 14.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.326 8.320 13.612 1.00 0.00 H new ATOM 1397 N LEU A 89 9.363 5.252 11.237 1.00 0.00 N ATOM 1398 CA LEU A 89 10.659 4.627 11.161 1.00 0.00 C ATOM 1399 C LEU A 89 11.003 4.344 12.637 1.00 0.00 C ATOM 1400 O LEU A 89 10.208 4.482 13.548 1.00 0.00 O ATOM 1401 CB LEU A 89 11.678 5.637 10.547 1.00 0.00 C ATOM 1402 CG LEU A 89 12.380 5.228 9.249 1.00 0.00 C ATOM 1403 CD1 LEU A 89 13.487 6.262 9.003 1.00 0.00 C ATOM 1404 CD2 LEU A 89 13.014 3.851 9.341 1.00 0.00 C ATOM 0 H LEU A 89 9.377 6.178 10.810 1.00 0.00 H new ATOM 0 HA LEU A 89 10.682 3.729 10.544 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.154 6.576 10.365 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.444 5.839 11.295 1.00 0.00 H new ATOM 0 HG LEU A 89 11.647 5.191 8.443 1.00 0.00 H new ATOM 0 HD11 LEU A 89 14.019 6.014 8.085 1.00 0.00 H new ATOM 0 HD12 LEU A 89 13.044 7.254 8.909 1.00 0.00 H new ATOM 0 HD13 LEU A 89 14.185 6.254 9.840 1.00 0.00 H new ATOM 0 HD21 LEU A 89 13.498 3.609 8.395 1.00 0.00 H new ATOM 0 HD22 LEU A 89 13.755 3.844 10.140 1.00 0.00 H new ATOM 0 HD23 LEU A 89 12.244 3.109 9.554 1.00 0.00 H new ATOM 1416 N VAL A 90 12.249 3.935 12.881 1.00 0.00 N ATOM 1417 CA VAL A 90 12.692 3.678 14.210 1.00 0.00 C ATOM 1418 C VAL A 90 14.181 3.912 14.396 1.00 0.00 C ATOM 1419 O VAL A 90 14.560 4.155 15.543 1.00 0.00 O ATOM 1420 CB VAL A 90 12.393 2.220 14.662 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.486 2.026 16.171 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.002 1.780 14.300 1.00 0.00 C ATOM 0 H VAL A 90 12.954 3.781 12.160 1.00 0.00 H new ATOM 0 HA VAL A 90 12.132 4.386 14.821 1.00 0.00 H new ATOM 0 HB VAL A 90 13.153 1.635 14.144 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.266 0.987 16.419 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.492 2.274 16.508 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.766 2.677 16.667 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.845 0.756 14.638 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.276 2.436 14.781 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.875 1.829 13.219 1.00 0.00 H new ATOM 1432 N GLY A 91 15.043 3.817 13.393 1.00 0.00 N ATOM 1433 CA GLY A 91 16.459 3.967 13.458 1.00 0.00 C ATOM 1434 C GLY A 91 17.134 2.776 14.154 1.00 0.00 C ATOM 1435 O GLY A 91 18.189 2.331 13.716 1.00 0.00 O ATOM 0 H GLY A 91 14.727 3.617 12.444 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.859 4.071 12.449 1.00 0.00 H new ATOM 0 HA3 GLY A 91 16.702 4.885 13.994 1.00 0.00 H new ATOM 1439 N LYS A 92 16.478 2.355 15.182 1.00 0.00 N ATOM 1440 CA LYS A 92 16.880 1.248 16.029 1.00 0.00 C ATOM 1441 C LYS A 92 18.323 1.391 16.425 1.00 0.00 C ATOM 1442 O LYS A 92 18.782 2.522 16.332 1.00 0.00 O ATOM 1443 CB LYS A 92 16.510 -0.130 15.561 1.00 0.00 C ATOM 1444 CG LYS A 92 15.022 -0.321 15.899 1.00 0.00 C ATOM 1445 CD LYS A 92 14.946 -0.541 17.408 1.00 0.00 C ATOM 1446 CE LYS A 92 14.016 -1.642 17.791 1.00 0.00 C ATOM 1447 NZ LYS A 92 14.088 -1.944 19.231 1.00 0.00 N ATOM 0 H LYS A 92 15.603 2.784 15.481 1.00 0.00 H new ATOM 0 HA LYS A 92 16.263 1.332 16.923 1.00 0.00 H new ATOM 0 HB2 LYS A 92 16.681 -0.235 14.490 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.120 -0.885 16.057 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.442 0.554 15.605 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.608 -1.174 15.361 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.943 -0.767 17.787 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.624 0.383 17.888 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.995 -1.363 17.529 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.259 -2.538 17.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.091 -2.975 19.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.960 -1.538 19.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.264 -1.532 19.714 1.00 0.00 H new ATOM 1461 N PHE A 93 18.964 0.335 16.874 1.00 0.00 N ATOM 1462 CA PHE A 93 20.328 0.480 17.372 1.00 0.00 C ATOM 1463 C PHE A 93 20.939 -0.797 17.919 1.00 0.00 C ATOM 1464 O PHE A 93 20.465 -1.897 17.651 1.00 0.00 O ATOM 1465 CB PHE A 93 20.036 1.268 18.698 1.00 0.00 C ATOM 1466 CG PHE A 93 18.813 0.701 19.362 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.869 -0.623 19.819 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.614 1.344 19.531 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.812 -1.295 20.416 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.548 0.692 20.140 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.619 -0.634 20.586 1.00 0.00 C ATOM 0 H PHE A 93 18.583 -0.611 16.908 1.00 0.00 H new ATOM 0 HA PHE A 93 20.977 0.877 16.591 1.00 0.00 H new ATOM 0 HB2 PHE A 93 20.892 1.199 19.370 1.00 0.00 H new ATOM 0 HB3 PHE A 93 19.886 2.325 18.479 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.800 -1.157 19.698 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.497 2.362 19.189 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.925 -2.319 20.741 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.623 1.232 20.275 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.770 -1.118 21.045 1.00 0.00 H new ATOM 1481 N LYS A 94 21.928 -0.411 18.695 1.00 0.00 N ATOM 1482 CA LYS A 94 22.832 -1.118 19.573 1.00 0.00 C ATOM 1483 C LYS A 94 24.154 -1.042 18.862 1.00 0.00 C ATOM 1484 O LYS A 94 24.682 -2.087 18.585 1.00 0.00 O ATOM 1485 CB LYS A 94 22.482 -2.541 19.858 1.00 0.00 C ATOM 1486 CG LYS A 94 21.568 -2.265 21.049 1.00 0.00 C ATOM 1487 CD LYS A 94 20.569 -3.295 21.455 1.00 0.00 C ATOM 1488 CE LYS A 94 20.213 -3.273 22.909 1.00 0.00 C ATOM 1489 NZ LYS A 94 20.562 -4.596 23.474 1.00 0.00 N ATOM 0 H LYS A 94 22.151 0.584 18.725 1.00 0.00 H new ATOM 0 HA LYS A 94 22.810 -0.659 20.561 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.973 -3.034 19.030 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.346 -3.155 20.111 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.204 -2.068 21.912 1.00 0.00 H new ATOM 0 HG3 LYS A 94 21.023 -1.345 20.838 1.00 0.00 H new ATOM 0 HD2 LYS A 94 19.661 -3.153 20.869 1.00 0.00 H new ATOM 0 HD3 LYS A 94 20.960 -4.281 21.204 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.756 -2.481 23.424 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.150 -3.069 23.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 20.326 -4.614 24.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 20.025 -5.337 22.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 21.581 -4.768 23.353 1.00 0.00 H new ATOM 1503 N ARG A 95 24.503 0.192 18.618 1.00 0.00 N ATOM 1504 CA ARG A 95 25.727 0.561 17.911 1.00 0.00 C ATOM 1505 C ARG A 95 26.888 -0.139 18.569 1.00 0.00 C ATOM 1506 O ARG A 95 26.931 -1.349 18.468 1.00 0.00 O ATOM 1507 CB ARG A 95 25.921 2.033 17.713 1.00 0.00 C ATOM 1508 CG ARG A 95 25.839 2.951 18.875 1.00 0.00 C ATOM 1509 CD ARG A 95 24.570 2.821 19.742 1.00 0.00 C ATOM 1510 NE ARG A 95 24.813 1.703 20.597 1.00 0.00 N ATOM 1511 CZ ARG A 95 25.882 1.487 21.414 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.707 2.466 21.692 1.00 0.00 N ATOM 1513 NH2 ARG A 95 25.974 0.241 21.831 1.00 0.00 N ATOM 0 H ARG A 95 23.942 0.994 18.905 1.00 0.00 H new ATOM 0 HA ARG A 95 25.646 0.214 16.881 1.00 0.00 H new ATOM 0 HB2 ARG A 95 26.901 2.173 17.257 1.00 0.00 H new ATOM 0 HB3 ARG A 95 25.180 2.363 16.985 1.00 0.00 H new ATOM 0 HG2 ARG A 95 26.709 2.783 19.510 1.00 0.00 H new ATOM 0 HG3 ARG A 95 25.904 3.976 18.510 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.394 3.728 20.320 1.00 0.00 H new ATOM 0 HD3 ARG A 95 23.686 2.660 19.125 1.00 0.00 H new ATOM 0 HE ARG A 95 24.098 0.976 20.596 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.550 3.393 21.297 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.506 2.301 22.304 1.00 0.00 H new ATOM 0 HH21 ARG A 95 25.282 -0.448 21.536 1.00 0.00 H new ATOM 0 HH22 ARG A 95 26.737 -0.035 22.449 1.00 0.00 H new ATOM 1527 N VAL A 96 27.805 0.456 19.242 1.00 0.00 N ATOM 1528 CA VAL A 96 28.879 -0.308 19.867 1.00 0.00 C ATOM 1529 C VAL A 96 29.568 0.536 20.964 1.00 0.00 C ATOM 1530 O VAL A 96 30.130 -0.130 21.847 1.00 0.00 O ATOM 1531 CB VAL A 96 29.920 -0.793 18.926 1.00 0.00 C ATOM 1532 CG1 VAL A 96 31.156 -1.392 19.643 1.00 0.00 C ATOM 1533 CG2 VAL A 96 29.427 -1.799 17.900 1.00 0.00 C ATOM 0 H VAL A 96 27.854 1.464 19.387 1.00 0.00 H new ATOM 0 HA VAL A 96 28.392 -1.189 20.285 1.00 0.00 H new ATOM 0 HB VAL A 96 30.207 0.115 18.396 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.880 -1.728 18.901 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.613 -0.632 20.277 1.00 0.00 H new ATOM 0 HG13 VAL A 96 30.846 -2.238 20.257 1.00 0.00 H new ATOM 0 HG21 VAL A 96 30.254 -2.097 17.256 1.00 0.00 H new ATOM 0 HG22 VAL A 96 29.031 -2.676 18.412 1.00 0.00 H new ATOM 0 HG23 VAL A 96 28.641 -1.346 17.295 1.00 0.00 H new ATOM 1543 N ASP A 97 29.508 1.849 20.958 1.00 0.00 N ATOM 1544 CA ASP A 97 30.129 2.505 22.163 1.00 0.00 C ATOM 1545 C ASP A 97 29.454 1.954 23.420 1.00 0.00 C ATOM 1546 O ASP A 97 29.934 2.262 24.530 1.00 0.00 O ATOM 1547 CB ASP A 97 30.094 4.024 22.107 1.00 0.00 C ATOM 1548 CG ASP A 97 30.566 4.772 23.345 1.00 0.00 C ATOM 1549 OD1 ASP A 97 31.808 4.562 23.650 1.00 0.00 O ATOM 1550 OD2 ASP A 97 29.850 5.504 24.000 1.00 0.00 O ATOM 0 H ASP A 97 29.098 2.452 20.245 1.00 0.00 H new ATOM 0 HA ASP A 97 31.191 2.259 22.181 1.00 0.00 H new ATOM 0 HB2 ASP A 97 30.705 4.346 21.263 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.070 4.332 21.895 1.00 0.00 H new ATOM 1555 N ASN A 98 28.389 1.164 23.260 1.00 0.00 N ATOM 1556 CA ASN A 98 27.690 0.736 24.439 1.00 0.00 C ATOM 1557 C ASN A 98 26.548 -0.228 24.459 1.00 0.00 C ATOM 1558 O ASN A 98 26.644 -1.368 24.895 1.00 0.00 O ATOM 1559 CB ASN A 98 27.191 2.102 25.055 1.00 0.00 C ATOM 1560 CG ASN A 98 26.463 2.042 26.368 1.00 0.00 C ATOM 1561 OD1 ASN A 98 25.205 1.987 26.471 1.00 0.00 O ATOM 1562 ND2 ASN A 98 27.233 2.041 27.440 1.00 0.00 N ATOM 0 H ASN A 98 28.019 0.831 22.370 1.00 0.00 H new ATOM 0 HA ASN A 98 28.415 0.103 24.950 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.057 2.752 25.179 1.00 0.00 H new ATOM 0 HB3 ASN A 98 26.535 2.580 24.327 1.00 0.00 H new ATOM 0 HD21 ASN A 98 26.814 1.995 28.369 1.00 0.00 H new ATOM 0 HD22 ASN A 98 28.247 2.086 27.340 1.00 0.00 H new ATOM 1569 N GLY A 99 25.396 0.230 23.984 1.00 0.00 N ATOM 1570 CA GLY A 99 24.140 -0.444 23.881 1.00 0.00 C ATOM 1571 C GLY A 99 22.939 0.546 23.925 1.00 0.00 C ATOM 1572 O GLY A 99 21.993 0.384 24.692 1.00 0.00 O ATOM 0 H GLY A 99 25.329 1.184 23.629 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.108 -1.011 22.950 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.047 -1.163 24.695 1.00 0.00 H new ATOM 1576 N LYS A 100 23.069 1.570 23.079 1.00 0.00 N ATOM 1577 CA LYS A 100 22.156 2.683 22.935 1.00 0.00 C ATOM 1578 C LYS A 100 20.887 2.453 22.086 1.00 0.00 C ATOM 1579 O LYS A 100 20.700 1.351 21.650 1.00 0.00 O ATOM 1580 CB LYS A 100 22.901 3.833 22.261 1.00 0.00 C ATOM 1581 CG LYS A 100 23.525 4.828 23.221 1.00 0.00 C ATOM 1582 CD LYS A 100 24.996 4.845 22.905 1.00 0.00 C ATOM 1583 CE LYS A 100 25.755 6.165 22.851 1.00 0.00 C ATOM 1584 NZ LYS A 100 25.745 6.964 24.050 1.00 0.00 N ATOM 0 H LYS A 100 23.864 1.639 22.444 1.00 0.00 H new ATOM 0 HA LYS A 100 21.817 2.872 23.954 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.685 3.419 21.627 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.209 4.364 21.607 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.088 5.818 23.095 1.00 0.00 H new ATOM 0 HG3 LYS A 100 23.352 4.533 24.256 1.00 0.00 H new ATOM 0 HD2 LYS A 100 25.492 4.217 23.645 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.124 4.359 21.938 1.00 0.00 H new ATOM 0 HE2 LYS A 100 26.792 5.951 22.593 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.341 6.763 22.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 26.639 7.491 24.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.950 7.634 24.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 25.639 6.345 24.879 1.00 0.00 H new ATOM 1598 N GLU A 101 20.198 3.554 21.960 1.00 0.00 N ATOM 1599 CA GLU A 101 18.959 3.471 21.181 1.00 0.00 C ATOM 1600 C GLU A 101 18.588 4.778 20.444 1.00 0.00 C ATOM 1601 O GLU A 101 17.515 5.260 20.654 1.00 0.00 O ATOM 1602 CB GLU A 101 17.793 2.786 21.870 1.00 0.00 C ATOM 1603 CG GLU A 101 17.997 1.365 22.465 1.00 0.00 C ATOM 1604 CD GLU A 101 16.892 0.924 23.405 1.00 0.00 C ATOM 1605 OE1 GLU A 101 15.758 1.424 23.321 1.00 0.00 O ATOM 1606 OE2 GLU A 101 17.266 0.006 24.251 1.00 0.00 O ATOM 0 H GLU A 101 20.436 4.466 22.349 1.00 0.00 H new ATOM 0 HA GLU A 101 19.213 2.768 20.388 1.00 0.00 H new ATOM 0 HB2 GLU A 101 17.461 3.437 22.679 1.00 0.00 H new ATOM 0 HB3 GLU A 101 16.975 2.727 21.152 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.072 0.648 21.648 1.00 0.00 H new ATOM 0 HG3 GLU A 101 18.946 1.339 23.000 1.00 0.00 H new ATOM 1613 N LEU A 102 19.594 5.170 19.696 1.00 0.00 N ATOM 1614 CA LEU A 102 19.608 6.345 18.859 1.00 0.00 C ATOM 1615 C LEU A 102 18.185 6.313 18.262 1.00 0.00 C ATOM 1616 O LEU A 102 17.529 7.306 18.395 1.00 0.00 O ATOM 1617 CB LEU A 102 20.548 6.087 17.640 1.00 0.00 C ATOM 1618 CG LEU A 102 21.987 6.293 18.054 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.736 4.955 18.186 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.611 7.154 16.987 1.00 0.00 C ATOM 0 H LEU A 102 20.470 4.649 19.654 1.00 0.00 H new ATOM 0 HA LEU A 102 19.906 7.249 19.390 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.408 5.072 17.269 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.294 6.763 16.823 1.00 0.00 H new ATOM 0 HG LEU A 102 22.043 6.767 19.034 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.767 5.143 18.485 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.247 4.337 18.939 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.725 4.436 17.228 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.657 7.338 17.233 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.549 6.644 16.026 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.080 8.104 16.929 1.00 0.00 H new ATOM 1632 N ILE A 103 17.896 5.174 17.686 1.00 0.00 N ATOM 1633 CA ILE A 103 16.517 5.047 17.171 1.00 0.00 C ATOM 1634 C ILE A 103 16.236 6.161 16.193 1.00 0.00 C ATOM 1635 O ILE A 103 15.200 6.823 16.142 1.00 0.00 O ATOM 1636 CB ILE A 103 15.623 5.188 18.397 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.388 3.916 19.164 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.249 5.798 18.132 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.968 2.705 18.334 1.00 0.00 C ATOM 0 H ILE A 103 18.518 4.375 17.558 1.00 0.00 H new ATOM 0 HA ILE A 103 16.352 4.103 16.651 1.00 0.00 H new ATOM 0 HB ILE A 103 16.222 5.875 18.994 1.00 0.00 H new ATOM 0 HG12 ILE A 103 16.302 3.664 19.702 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.619 4.103 19.913 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.690 5.855 19.066 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.369 6.799 17.719 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.705 5.175 17.422 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.827 1.846 18.990 1.00 0.00 H new ATOM 0 HD12 ILE A 103 14.034 2.925 17.817 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.743 2.479 17.602 1.00 0.00 H new ATOM 1651 N ALA A 104 17.189 6.454 15.296 1.00 0.00 N ATOM 1652 CA ALA A 104 17.036 7.456 14.267 1.00 0.00 C ATOM 1653 C ALA A 104 15.743 7.193 13.502 1.00 0.00 C ATOM 1654 O ALA A 104 15.749 6.582 12.428 1.00 0.00 O ATOM 1655 CB ALA A 104 18.144 7.301 13.209 1.00 0.00 C ATOM 0 H ALA A 104 18.095 5.987 15.277 1.00 0.00 H new ATOM 0 HA ALA A 104 17.059 8.434 14.749 1.00 0.00 H new ATOM 0 HB1 ALA A 104 18.020 8.061 12.438 1.00 0.00 H new ATOM 0 HB2 ALA A 104 19.118 7.421 13.682 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.079 6.311 12.757 1.00 0.00 H new ATOM 1661 N VAL A 105 14.622 7.625 14.001 1.00 0.00 N ATOM 1662 CA VAL A 105 13.310 7.456 13.413 1.00 0.00 C ATOM 1663 C VAL A 105 13.148 8.515 12.312 1.00 0.00 C ATOM 1664 O VAL A 105 14.060 8.552 11.488 1.00 0.00 O ATOM 1665 CB VAL A 105 12.190 7.540 14.428 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.797 7.110 13.917 1.00 0.00 C ATOM 1667 CG2 VAL A 105 12.454 6.686 15.682 1.00 0.00 C ATOM 0 H VAL A 105 14.589 8.137 14.883 1.00 0.00 H new ATOM 0 HA VAL A 105 13.239 6.452 12.994 1.00 0.00 H new ATOM 0 HB VAL A 105 12.179 8.607 14.652 1.00 0.00 H new ATOM 0 HG11 VAL A 105 10.068 7.208 14.722 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.503 7.746 13.082 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.835 6.072 13.587 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.617 6.786 16.373 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.563 5.640 15.394 1.00 0.00 H new ATOM 0 HG23 VAL A 105 13.369 7.026 16.168 1.00 0.00 H new ATOM 1677 N ARG A 106 12.078 9.257 12.322 1.00 0.00 N ATOM 1678 CA ARG A 106 11.681 10.251 11.327 1.00 0.00 C ATOM 1679 C ARG A 106 10.145 10.183 11.425 1.00 0.00 C ATOM 1680 O ARG A 106 9.595 11.218 11.182 1.00 0.00 O ATOM 1681 CB ARG A 106 11.937 9.887 9.917 1.00 0.00 C ATOM 1682 CG ARG A 106 12.629 11.055 9.232 1.00 0.00 C ATOM 1683 CD ARG A 106 13.846 10.733 8.419 1.00 0.00 C ATOM 1684 NE ARG A 106 14.963 10.453 9.299 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.914 11.326 9.573 1.00 0.00 C ATOM 1686 NH1 ARG A 106 15.917 12.539 9.049 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.915 11.022 10.389 1.00 0.00 N ATOM 0 H ARG A 106 11.398 9.188 13.079 1.00 0.00 H new ATOM 0 HA ARG A 106 12.211 11.182 11.528 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.560 8.994 9.864 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.001 9.653 9.411 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.905 11.545 8.581 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.912 11.779 9.996 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.650 9.872 7.779 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.088 11.569 7.763 1.00 0.00 H new ATOM 0 HE ARG A 106 15.017 9.530 9.730 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.171 12.822 8.414 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.666 13.192 9.279 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.960 10.098 10.819 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.639 11.712 10.587 1.00 0.00 H new ATOM 1701 N GLU A 107 9.731 9.005 11.786 1.00 0.00 N ATOM 1702 CA GLU A 107 8.355 8.645 12.067 1.00 0.00 C ATOM 1703 C GLU A 107 7.546 9.072 10.849 1.00 0.00 C ATOM 1704 O GLU A 107 6.989 8.355 10.040 1.00 0.00 O ATOM 1705 CB GLU A 107 7.951 9.647 13.199 1.00 0.00 C ATOM 1706 CG GLU A 107 7.950 9.015 14.586 1.00 0.00 C ATOM 1707 CD GLU A 107 6.747 9.317 15.502 1.00 0.00 C ATOM 1708 OE1 GLU A 107 5.936 10.252 15.062 1.00 0.00 O ATOM 1709 OE2 GLU A 107 6.605 8.721 16.538 1.00 0.00 O ATOM 0 H GLU A 107 10.372 8.220 11.901 1.00 0.00 H new ATOM 0 HA GLU A 107 8.211 7.592 12.310 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.641 10.491 13.192 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.958 10.044 12.987 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.017 7.934 14.464 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.855 9.334 15.102 1.00 0.00 H new ATOM 1716 N ILE A 108 7.504 10.390 10.740 1.00 0.00 N ATOM 1717 CA ILE A 108 6.841 11.164 9.696 1.00 0.00 C ATOM 1718 C ILE A 108 5.339 11.088 9.875 1.00 0.00 C ATOM 1719 O ILE A 108 4.666 10.075 9.653 1.00 0.00 O ATOM 1720 CB ILE A 108 7.300 10.747 8.324 1.00 0.00 C ATOM 1721 CG1 ILE A 108 7.267 12.017 7.481 1.00 0.00 C ATOM 1722 CG2 ILE A 108 6.240 9.862 7.649 1.00 0.00 C ATOM 1723 CD1 ILE A 108 8.026 11.870 6.191 1.00 0.00 C ATOM 0 H ILE A 108 7.963 10.991 11.424 1.00 0.00 H new ATOM 0 HA ILE A 108 7.125 12.212 9.791 1.00 0.00 H new ATOM 0 HB ILE A 108 8.262 10.241 8.401 1.00 0.00 H new ATOM 0 HG12 ILE A 108 6.231 12.278 7.262 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.689 12.842 8.055 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.588 9.569 6.658 1.00 0.00 H new ATOM 0 HG22 ILE A 108 6.073 8.970 8.253 1.00 0.00 H new ATOM 0 HG23 ILE A 108 5.307 10.418 7.557 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.971 12.802 5.628 1.00 0.00 H new ATOM 0 HD12 ILE A 108 9.069 11.637 6.407 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.589 11.064 5.601 1.00 0.00 H new ATOM 1735 N SER A 109 4.782 12.210 10.335 1.00 0.00 N ATOM 1736 CA SER A 109 3.352 12.255 10.473 1.00 0.00 C ATOM 1737 C SER A 109 2.892 13.656 10.512 1.00 0.00 C ATOM 1738 O SER A 109 3.070 14.308 11.520 1.00 0.00 O ATOM 1739 CB SER A 109 2.963 11.473 11.726 1.00 0.00 C ATOM 1740 OG SER A 109 1.643 11.703 12.124 1.00 0.00 O ATOM 0 H SER A 109 5.284 13.056 10.604 1.00 0.00 H new ATOM 0 HA SER A 109 2.863 11.791 9.616 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.101 10.408 11.540 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.635 11.744 12.540 1.00 0.00 H new ATOM 0 HG SER A 109 1.447 11.178 12.928 1.00 0.00 H new ATOM 1746 N GLY A 110 2.281 14.043 9.392 1.00 0.00 N ATOM 1747 CA GLY A 110 1.682 15.309 9.157 1.00 0.00 C ATOM 1748 C GLY A 110 2.606 16.454 9.436 1.00 0.00 C ATOM 1749 O GLY A 110 2.782 16.755 10.627 1.00 0.00 O ATOM 0 H GLY A 110 2.199 13.422 8.587 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.351 15.361 8.120 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.793 15.406 9.781 1.00 0.00 H new ATOM 1753 N ASN A 111 3.188 17.117 8.429 1.00 0.00 N ATOM 1754 CA ASN A 111 4.142 18.183 8.711 1.00 0.00 C ATOM 1755 C ASN A 111 5.240 17.497 9.542 1.00 0.00 C ATOM 1756 O ASN A 111 5.120 17.482 10.769 1.00 0.00 O ATOM 1757 CB ASN A 111 3.577 19.447 9.354 1.00 0.00 C ATOM 1758 CG ASN A 111 2.831 20.347 8.384 1.00 0.00 C ATOM 1759 OD1 ASN A 111 1.613 20.247 8.181 1.00 0.00 O ATOM 1760 ND2 ASN A 111 3.547 21.249 7.756 1.00 0.00 N ATOM 0 H ASN A 111 3.018 16.937 7.439 1.00 0.00 H new ATOM 0 HA ASN A 111 4.519 18.606 7.780 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.903 19.162 10.162 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.394 20.011 9.804 1.00 0.00 H new ATOM 0 HD21 ASN A 111 3.102 21.880 7.090 1.00 0.00 H new ATOM 0 HD22 ASN A 111 4.549 21.319 7.934 1.00 0.00 H new ATOM 1767 N GLU A 112 6.282 16.940 8.902 1.00 0.00 N ATOM 1768 CA GLU A 112 7.186 16.231 9.734 1.00 0.00 C ATOM 1769 C GLU A 112 8.341 15.540 9.032 1.00 0.00 C ATOM 1770 O GLU A 112 8.513 15.525 7.839 1.00 0.00 O ATOM 1771 CB GLU A 112 6.343 14.945 10.100 1.00 0.00 C ATOM 1772 CG GLU A 112 5.622 14.322 8.888 1.00 0.00 C ATOM 1773 CD GLU A 112 5.737 14.863 7.503 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.911 15.832 7.171 1.00 0.00 O ATOM 1775 OE2 GLU A 112 6.506 14.460 6.642 1.00 0.00 O ATOM 0 H GLU A 112 6.486 16.973 7.903 1.00 0.00 H new ATOM 0 HA GLU A 112 7.560 16.933 10.480 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.004 14.200 10.543 1.00 0.00 H new ATOM 0 HB3 GLU A 112 5.605 15.207 10.858 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.942 13.281 8.840 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.559 14.318 9.130 1.00 0.00 H new ATOM 1782 N LEU A 113 9.070 14.833 9.907 1.00 0.00 N ATOM 1783 CA LEU A 113 10.171 13.963 9.671 1.00 0.00 C ATOM 1784 C LEU A 113 10.850 13.864 11.068 1.00 0.00 C ATOM 1785 O LEU A 113 12.045 13.996 11.227 1.00 0.00 O ATOM 1786 CB LEU A 113 11.263 14.405 8.704 1.00 0.00 C ATOM 1787 CG LEU A 113 11.052 14.159 7.227 1.00 0.00 C ATOM 1788 CD1 LEU A 113 12.433 14.451 6.625 1.00 0.00 C ATOM 1789 CD2 LEU A 113 10.859 12.684 6.901 1.00 0.00 C ATOM 0 H LEU A 113 8.856 14.881 10.903 1.00 0.00 H new ATOM 0 HA LEU A 113 9.764 13.063 9.210 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.419 15.475 8.844 1.00 0.00 H new ATOM 0 HB3 LEU A 113 12.188 13.907 8.996 1.00 0.00 H new ATOM 0 HG LEU A 113 10.195 14.737 6.879 1.00 0.00 H new ATOM 0 HD11 LEU A 113 12.398 14.303 5.546 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.714 15.482 6.841 1.00 0.00 H new ATOM 0 HD13 LEU A 113 13.170 13.776 7.060 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.712 12.565 5.828 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.742 12.124 7.211 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.985 12.305 7.431 1.00 0.00 H new ATOM 1801 N ILE A 114 10.024 13.648 12.029 1.00 0.00 N ATOM 1802 CA ILE A 114 10.409 13.512 13.409 1.00 0.00 C ATOM 1803 C ILE A 114 11.476 12.446 13.502 1.00 0.00 C ATOM 1804 O ILE A 114 11.282 11.266 13.811 1.00 0.00 O ATOM 1805 CB ILE A 114 9.276 13.045 14.322 1.00 0.00 C ATOM 1806 CG1 ILE A 114 7.997 12.653 13.573 1.00 0.00 C ATOM 1807 CG2 ILE A 114 9.116 13.893 15.553 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.940 13.746 13.376 1.00 0.00 C ATOM 0 H ILE A 114 9.019 13.556 11.881 1.00 0.00 H new ATOM 0 HA ILE A 114 10.736 14.500 13.732 1.00 0.00 H new ATOM 0 HB ILE A 114 9.587 12.087 14.739 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.282 12.277 12.590 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.532 11.825 14.108 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.295 13.507 16.157 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.037 13.867 16.135 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.899 14.921 15.261 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.089 13.335 12.833 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.608 14.111 14.348 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.370 14.570 12.807 1.00 0.00 H new ATOM 1820 N GLN A 115 12.674 12.908 13.211 1.00 0.00 N ATOM 1821 CA GLN A 115 13.910 12.180 13.195 1.00 0.00 C ATOM 1822 C GLN A 115 14.064 11.354 14.474 1.00 0.00 C ATOM 1823 O GLN A 115 14.792 10.371 14.413 1.00 0.00 O ATOM 1824 CB GLN A 115 14.967 13.269 13.064 1.00 0.00 C ATOM 1825 CG GLN A 115 14.784 14.077 11.764 1.00 0.00 C ATOM 1826 CD GLN A 115 16.176 14.683 11.572 1.00 0.00 C ATOM 1827 OE1 GLN A 115 17.069 13.968 11.164 1.00 0.00 O ATOM 1828 NE2 GLN A 115 16.223 15.959 11.914 1.00 0.00 N ATOM 0 H GLN A 115 12.811 13.887 12.959 1.00 0.00 H new ATOM 0 HA GLN A 115 13.981 11.454 12.385 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.909 13.939 13.922 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.959 12.818 13.077 1.00 0.00 H new ATOM 0 HG2 GLN A 115 14.495 13.443 10.926 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.015 14.843 11.864 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.380 16.430 12.243 1.00 0.00 H new ATOM 0 HE22 GLN A 115 17.102 16.472 11.849 1.00 0.00 H new ATOM 1837 N THR A 116 13.364 11.805 15.484 1.00 0.00 N ATOM 1838 CA THR A 116 13.245 11.228 16.802 1.00 0.00 C ATOM 1839 C THR A 116 14.295 10.228 17.147 1.00 0.00 C ATOM 1840 O THR A 116 13.905 9.078 17.373 1.00 0.00 O ATOM 1841 CB THR A 116 11.857 10.549 16.950 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.881 11.559 16.666 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.627 10.120 18.378 1.00 0.00 C ATOM 0 H THR A 116 12.814 12.660 15.399 1.00 0.00 H new ATOM 0 HA THR A 116 13.371 12.062 17.492 1.00 0.00 H new ATOM 0 HB THR A 116 11.796 9.683 16.291 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.719 12.093 17.472 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.649 9.646 18.463 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.400 9.411 18.674 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.665 10.992 19.031 1.00 0.00 H new ATOM 1851 N TYR A 117 15.565 10.627 17.224 1.00 0.00 N ATOM 1852 CA TYR A 117 16.509 9.646 17.629 1.00 0.00 C ATOM 1853 C TYR A 117 16.770 9.722 19.147 1.00 0.00 C ATOM 1854 O TYR A 117 17.483 10.624 19.624 1.00 0.00 O ATOM 1855 CB TYR A 117 17.915 9.843 17.056 1.00 0.00 C ATOM 1856 CG TYR A 117 18.319 10.691 15.868 1.00 0.00 C ATOM 1857 CD1 TYR A 117 18.325 12.072 15.839 1.00 0.00 C ATOM 1858 CD2 TYR A 117 18.755 10.091 14.681 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.724 12.807 14.723 1.00 0.00 C ATOM 1860 CE2 TYR A 117 19.155 10.780 13.549 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.141 12.158 13.562 1.00 0.00 C ATOM 1862 OH TYR A 117 19.542 12.844 12.431 1.00 0.00 O ATOM 0 H TYR A 117 15.925 11.560 17.023 1.00 0.00 H new ATOM 0 HA TYR A 117 16.057 8.717 17.282 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.514 10.213 17.888 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.274 8.840 16.826 1.00 0.00 H new ATOM 0 HD1 TYR A 117 18.006 12.607 16.721 1.00 0.00 H new ATOM 0 HD2 TYR A 117 18.781 9.012 14.646 1.00 0.00 H new ATOM 0 HE1 TYR A 117 18.710 13.886 14.759 1.00 0.00 H new ATOM 0 HE2 TYR A 117 19.474 10.245 12.667 1.00 0.00 H new ATOM 0 HH TYR A 117 19.824 13.749 12.680 1.00 0.00 H new ATOM 1872 N THR A 118 16.212 8.740 19.848 1.00 0.00 N ATOM 1873 CA THR A 118 16.296 8.767 21.286 1.00 0.00 C ATOM 1874 C THR A 118 17.220 7.752 21.851 1.00 0.00 C ATOM 1875 O THR A 118 16.792 6.852 22.577 1.00 0.00 O ATOM 1876 CB THR A 118 14.948 8.610 22.033 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.936 9.237 21.218 1.00 0.00 O ATOM 1878 CG2 THR A 118 15.108 9.384 23.301 1.00 0.00 C ATOM 0 H THR A 118 15.714 7.943 19.451 1.00 0.00 H new ATOM 0 HA THR A 118 16.679 9.773 21.455 1.00 0.00 H new ATOM 0 HB THR A 118 14.677 7.573 22.228 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.065 9.156 21.659 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.190 9.319 23.885 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.935 8.970 23.878 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.316 10.428 23.066 1.00 0.00 H new ATOM 1886 N TYR A 119 18.537 7.856 21.614 1.00 0.00 N ATOM 1887 CA TYR A 119 19.540 6.989 22.141 1.00 0.00 C ATOM 1888 C TYR A 119 19.514 6.946 23.661 1.00 0.00 C ATOM 1889 O TYR A 119 20.187 6.036 24.145 1.00 0.00 O ATOM 1890 CB TYR A 119 20.986 7.457 21.805 1.00 0.00 C ATOM 1891 CG TYR A 119 21.314 8.787 22.372 1.00 0.00 C ATOM 1892 CD1 TYR A 119 20.693 9.979 22.038 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.329 8.867 23.333 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.031 11.201 22.614 1.00 0.00 C ATOM 1895 CE2 TYR A 119 22.689 10.077 23.926 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.037 11.231 23.563 1.00 0.00 C ATOM 1897 OH TYR A 119 22.333 12.469 24.107 1.00 0.00 O ATOM 0 H TYR A 119 18.924 8.589 21.019 1.00 0.00 H new ATOM 0 HA TYR A 119 19.311 6.025 21.687 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.696 6.722 22.184 1.00 0.00 H new ATOM 0 HB3 TYR A 119 21.108 7.490 20.722 1.00 0.00 H new ATOM 0 HD1 TYR A 119 19.909 9.960 21.295 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.848 7.966 23.624 1.00 0.00 H new ATOM 0 HE1 TYR A 119 20.518 12.107 22.326 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.475 10.107 24.666 1.00 0.00 H new ATOM 0 HH TYR A 119 23.007 12.916 23.554 1.00 0.00 H new ATOM 1907 N GLU A 120 18.829 7.833 24.349 1.00 0.00 N ATOM 1908 CA GLU A 120 18.909 7.742 25.814 1.00 0.00 C ATOM 1909 C GLU A 120 17.984 8.579 26.623 1.00 0.00 C ATOM 1910 O GLU A 120 18.089 8.923 27.777 1.00 0.00 O ATOM 1911 CB GLU A 120 20.416 7.932 26.129 1.00 0.00 C ATOM 1912 CG GLU A 120 20.702 9.085 27.115 1.00 0.00 C ATOM 1913 CD GLU A 120 20.681 8.665 28.557 1.00 0.00 C ATOM 1914 OE1 GLU A 120 20.668 7.492 28.923 1.00 0.00 O ATOM 1915 OE2 GLU A 120 20.670 9.602 29.418 1.00 0.00 O ATOM 0 H GLU A 120 18.247 8.579 23.967 1.00 0.00 H new ATOM 0 HA GLU A 120 18.527 6.774 26.137 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.811 7.005 26.543 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.952 8.120 25.199 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.677 9.515 26.885 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.963 9.872 26.964 1.00 0.00 H new ATOM 1922 N GLY A 121 16.893 8.964 25.952 1.00 0.00 N ATOM 1923 CA GLY A 121 15.907 9.776 26.607 1.00 0.00 C ATOM 1924 C GLY A 121 15.938 11.255 26.240 1.00 0.00 C ATOM 1925 O GLY A 121 15.373 12.045 26.959 1.00 0.00 O ATOM 0 H GLY A 121 16.688 8.725 24.982 1.00 0.00 H new ATOM 0 HA2 GLY A 121 14.919 9.380 26.372 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.040 9.682 27.685 1.00 0.00 H new ATOM 1929 N VAL A 122 16.618 11.554 25.115 1.00 0.00 N ATOM 1930 CA VAL A 122 16.780 12.877 24.607 1.00 0.00 C ATOM 1931 C VAL A 122 16.016 13.070 23.296 1.00 0.00 C ATOM 1932 O VAL A 122 15.186 13.985 23.278 1.00 0.00 O ATOM 1933 CB VAL A 122 18.295 13.121 24.356 1.00 0.00 C ATOM 1934 CG1 VAL A 122 18.504 14.453 23.684 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.053 13.155 25.680 1.00 0.00 C ATOM 0 H VAL A 122 17.071 10.844 24.540 1.00 0.00 H new ATOM 0 HA VAL A 122 16.383 13.585 25.335 1.00 0.00 H new ATOM 0 HB VAL A 122 18.661 12.311 23.726 1.00 0.00 H new ATOM 0 HG11 VAL A 122 19.569 14.612 23.514 1.00 0.00 H new ATOM 0 HG12 VAL A 122 17.978 14.465 22.729 1.00 0.00 H new ATOM 0 HG13 VAL A 122 18.116 15.247 24.322 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.112 13.327 25.489 1.00 0.00 H new ATOM 0 HG22 VAL A 122 18.662 13.960 26.303 1.00 0.00 H new ATOM 0 HG23 VAL A 122 18.927 12.203 26.196 1.00 0.00 H new ATOM 1945 N GLU A 123 16.284 12.300 22.276 1.00 0.00 N ATOM 1946 CA GLU A 123 15.699 12.372 20.975 1.00 0.00 C ATOM 1947 C GLU A 123 16.214 13.591 20.236 1.00 0.00 C ATOM 1948 O GLU A 123 16.156 14.665 20.821 1.00 0.00 O ATOM 1949 CB GLU A 123 14.182 12.736 21.068 1.00 0.00 C ATOM 1950 CG GLU A 123 13.479 12.501 19.697 1.00 0.00 C ATOM 1951 CD GLU A 123 12.001 12.706 19.595 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.462 12.441 20.767 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.251 13.042 18.697 1.00 0.00 O ATOM 0 H GLU A 123 16.971 11.549 22.344 1.00 0.00 H new ATOM 0 HA GLU A 123 15.914 11.412 20.505 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.703 12.130 21.837 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.070 13.778 21.367 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.953 13.157 18.967 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.691 11.477 19.390 1.00 0.00 H new ATOM 1960 N ALA A 124 16.676 13.362 19.000 1.00 0.00 N ATOM 1961 CA ALA A 124 17.188 14.484 18.200 1.00 0.00 C ATOM 1962 C ALA A 124 16.382 14.621 16.913 1.00 0.00 C ATOM 1963 O ALA A 124 16.273 13.797 16.055 1.00 0.00 O ATOM 1964 CB ALA A 124 18.663 14.457 17.920 1.00 0.00 C ATOM 0 H ALA A 124 16.707 12.449 18.545 1.00 0.00 H new ATOM 0 HA ALA A 124 17.053 15.369 18.822 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.936 15.328 17.324 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.212 14.475 18.861 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.913 13.549 17.371 1.00 0.00 H new ATOM 1970 N LYS A 125 15.729 15.788 16.794 1.00 0.00 N ATOM 1971 CA LYS A 125 14.885 15.979 15.619 1.00 0.00 C ATOM 1972 C LYS A 125 14.771 17.439 15.360 1.00 0.00 C ATOM 1973 O LYS A 125 15.708 18.174 15.761 1.00 0.00 O ATOM 1974 CB LYS A 125 13.486 15.343 15.877 1.00 0.00 C ATOM 1975 CG LYS A 125 13.459 14.535 17.171 1.00 0.00 C ATOM 1976 CD LYS A 125 13.339 15.463 18.413 1.00 0.00 C ATOM 1977 CE LYS A 125 12.243 16.533 18.353 1.00 0.00 C ATOM 1978 NZ LYS A 125 12.129 17.199 19.661 1.00 0.00 N ATOM 0 H LYS A 125 15.766 16.565 17.454 1.00 0.00 H new ATOM 0 HA LYS A 125 15.319 15.493 14.745 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.733 16.129 15.924 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.221 14.697 15.040 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.620 13.840 17.151 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.367 13.936 17.248 1.00 0.00 H new ATOM 0 HD2 LYS A 125 13.163 14.841 19.290 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.297 15.961 18.563 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.478 17.265 17.580 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.291 16.077 18.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.671 18.125 19.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.559 16.611 20.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.077 17.333 20.066 1.00 0.00 H new ATOM 1992 N ARG A 126 13.726 17.906 14.727 1.00 0.00 N ATOM 1993 CA ARG A 126 13.498 19.319 14.403 1.00 0.00 C ATOM 1994 C ARG A 126 12.688 19.227 13.128 1.00 0.00 C ATOM 1995 O ARG A 126 11.645 19.825 13.115 1.00 0.00 O ATOM 1996 CB ARG A 126 14.677 20.205 14.172 1.00 0.00 C ATOM 1997 CG ARG A 126 15.054 20.850 15.457 1.00 0.00 C ATOM 1998 CD ARG A 126 14.032 21.967 15.598 1.00 0.00 C ATOM 1999 NE ARG A 126 14.740 23.145 16.071 1.00 0.00 N ATOM 2000 CZ ARG A 126 14.156 24.297 16.295 1.00 0.00 C ATOM 2001 NH1 ARG A 126 12.859 24.502 16.108 1.00 0.00 N ATOM 2002 NH2 ARG A 126 14.887 25.300 16.721 1.00 0.00 N ATOM 0 H ARG A 126 12.972 17.300 14.404 1.00 0.00 H new ATOM 0 HA ARG A 126 13.041 19.799 15.269 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.513 19.625 13.782 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.439 20.963 13.426 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.002 20.149 16.290 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.073 21.237 15.430 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.548 22.168 14.642 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.247 21.683 16.299 1.00 0.00 H new ATOM 0 HE ARG A 126 15.744 23.071 16.237 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.266 23.743 15.774 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.455 25.419 16.298 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.888 25.174 16.871 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.454 26.206 16.902 1.00 0.00 H new ATOM 2016 N ILE A 127 13.228 18.481 12.168 1.00 0.00 N ATOM 2017 CA ILE A 127 12.648 18.138 10.913 1.00 0.00 C ATOM 2018 C ILE A 127 13.364 18.644 9.715 1.00 0.00 C ATOM 2019 O ILE A 127 14.167 19.557 9.807 1.00 0.00 O ATOM 2020 CB ILE A 127 11.138 18.474 10.771 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.357 17.440 11.601 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.544 18.499 9.378 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.889 17.085 12.973 1.00 0.00 C ATOM 0 H ILE A 127 14.159 18.078 12.276 1.00 0.00 H new ATOM 0 HA ILE A 127 12.760 17.054 10.937 1.00 0.00 H new ATOM 0 HB ILE A 127 11.052 19.505 11.113 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.339 17.809 11.723 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.296 16.521 11.018 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.484 18.748 9.439 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.059 19.248 8.776 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.661 17.519 8.915 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.235 16.346 13.437 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.893 16.672 12.878 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.922 17.981 13.593 1.00 0.00 H new ATOM 2035 N PHE A 128 12.966 17.942 8.626 1.00 0.00 N ATOM 2036 CA PHE A 128 13.313 18.036 7.297 1.00 0.00 C ATOM 2037 C PHE A 128 13.415 19.369 6.610 1.00 0.00 C ATOM 2038 O PHE A 128 12.795 20.341 7.011 1.00 0.00 O ATOM 2039 CB PHE A 128 12.140 17.369 6.505 1.00 0.00 C ATOM 2040 CG PHE A 128 10.941 18.290 6.196 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.996 19.406 5.399 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.670 18.047 6.727 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.914 20.231 5.119 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.565 18.833 6.484 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.682 19.947 5.664 1.00 0.00 C ATOM 0 H PHE A 128 12.285 17.193 8.749 1.00 0.00 H new ATOM 0 HA PHE A 128 14.318 17.614 7.295 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.533 16.984 5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.781 16.512 7.075 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.948 19.661 4.958 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.547 17.187 7.369 1.00 0.00 H new ATOM 0 HE1 PHE A 128 10.039 21.091 4.477 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.613 18.584 6.929 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.828 20.575 5.459 1.00 0.00 H new ATOM 2055 N LYS A 129 14.111 19.203 5.483 1.00 0.00 N ATOM 2056 CA LYS A 129 14.363 20.191 4.489 1.00 0.00 C ATOM 2057 C LYS A 129 13.661 19.758 3.204 1.00 0.00 C ATOM 2058 O LYS A 129 13.817 20.540 2.295 1.00 0.00 O ATOM 2059 CB LYS A 129 15.714 20.793 4.279 1.00 0.00 C ATOM 2060 CG LYS A 129 16.161 21.607 5.481 1.00 0.00 C ATOM 2061 CD LYS A 129 17.077 22.752 5.059 1.00 0.00 C ATOM 2062 CE LYS A 129 16.339 24.078 5.138 1.00 0.00 C ATOM 2063 NZ LYS A 129 17.090 25.243 5.623 1.00 0.00 N ATOM 0 H LYS A 129 14.533 18.305 5.246 1.00 0.00 H new ATOM 0 HA LYS A 129 13.943 21.093 4.935 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.439 20.002 4.086 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.695 21.430 3.395 1.00 0.00 H new ATOM 0 HG2 LYS A 129 15.289 22.007 5.998 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.683 20.961 6.188 1.00 0.00 H new ATOM 0 HD2 LYS A 129 17.956 22.779 5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 129 17.432 22.586 4.042 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.960 24.312 4.143 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.472 23.943 5.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.470 26.078 5.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 17.430 25.060 6.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.902 25.417 4.997 1.00 0.00 H new ATOM 2077 N LYS A 130 12.969 18.674 3.299 1.00 0.00 N ATOM 2078 CA LYS A 130 12.317 18.022 2.230 1.00 0.00 C ATOM 2079 C LYS A 130 12.704 18.566 0.874 1.00 0.00 C ATOM 2080 O LYS A 130 12.897 19.755 0.564 1.00 0.00 O ATOM 2081 CB LYS A 130 10.798 17.940 2.301 1.00 0.00 C ATOM 2082 CG LYS A 130 10.061 17.808 0.937 1.00 0.00 C ATOM 2083 CD LYS A 130 9.526 19.091 0.341 1.00 0.00 C ATOM 2084 CE LYS A 130 8.062 18.975 -0.148 1.00 0.00 C ATOM 2085 NZ LYS A 130 7.205 18.351 0.857 1.00 0.00 N ATOM 0 H LYS A 130 12.839 18.193 4.189 1.00 0.00 H new ATOM 0 HA LYS A 130 12.687 17.004 2.354 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.528 17.086 2.922 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.428 18.832 2.807 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.746 17.356 0.220 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.229 17.115 1.063 1.00 0.00 H new ATOM 0 HD2 LYS A 130 9.591 19.884 1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 130 10.159 19.386 -0.496 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.679 19.967 -0.388 1.00 0.00 H new ATOM 0 HE3 LYS A 130 8.031 18.390 -1.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.224 18.668 0.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 7.251 17.317 0.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.529 18.623 1.807 1.00 0.00 H new ATOM 2099 N GLU A 131 12.755 17.538 -0.005 1.00 0.00 N ATOM 2100 CA GLU A 131 13.199 17.790 -1.410 1.00 0.00 C ATOM 2101 C GLU A 131 12.474 17.093 -2.517 1.00 0.00 C ATOM 2102 O GLU A 131 12.935 16.895 -3.649 1.00 0.00 O ATOM 2103 CB GLU A 131 14.730 17.867 -1.281 1.00 0.00 C ATOM 2104 CG GLU A 131 15.655 18.561 -2.267 1.00 0.00 C ATOM 2105 CD GLU A 131 14.898 19.507 -3.226 1.00 0.00 C ATOM 2106 OE1 GLU A 131 14.689 20.726 -2.858 1.00 0.00 O ATOM 2107 OE2 GLU A 131 14.477 19.097 -4.378 1.00 0.00 O ATOM 2108 OXT GLU A 131 11.370 17.930 -1.822 1.00 0.00 O ATOM 0 H GLU A 131 12.510 16.571 0.210 1.00 0.00 H new ATOM 0 HA GLU A 131 12.859 18.722 -1.862 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.926 18.327 -0.312 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.077 16.836 -1.220 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.405 19.130 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.189 17.810 -2.849 1.00 0.00 H new