USER MOD reduce.3.24.130724 H: found=0, std=0, add=1089, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1088 hydrogens (31 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 98 ASN :FLIP amide:sc= 0.0171 F(o=-5.2!,f=1.2) USER MOD Set 1.2: A 119 TYR OH : rot -74:sc= 1.14 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.117 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0.0334 K(o=0.033,f=-2.4!) USER MOD Single : A 13 ASN : amide:sc= -1.29 X(o=-1.3,f=-0.82) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -148:sc= -0.165 (180deg=-2.1!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -118:sc= -0.0322 (180deg=-0.0881) USER MOD Single : A 24 ASN : amide:sc= -0.256 X(o=-0.26,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -166:sc= -0.0761 (180deg=-0.313) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc=-0.00708 K(o=-0.0071,f=-0.54) USER MOD Single : A 35 ASN : amide:sc= -0.0186 X(o=-0.019,f=-0.42) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 41 THR OG1 : rot -52:sc= 0.468 USER MOD Single : A 42 GLN :FLIP amide:sc= -2.48 F(o=-3.8,f=-2.5) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.022) USER MOD Single : A 48 THR OG1 : rot -38:sc= -0.582! USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -140:sc= -0.211 USER MOD Single : A 53 SER OG : rot -115:sc= 1.31 USER MOD Single : A 54 ASN : amide:sc= -0.472 K(o=-0.47,f=-2.6!) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 TYR OH : rot 122:sc= 1.27 USER MOD Single : A 71 SER OG : rot 180:sc= -0.0345 USER MOD Single : A 76 THR OG1 : rot -36:sc= 0.0832 USER MOD Single : A 79 THR OG1 : rot 180:sc= -1.21 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= 0.102 X(o=0.1,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -169:sc= -0.0336 (180deg=-0.205) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 115 GLN :FLIP amide:sc= -2.2 F(o=-6.6!,f=-2.2) USER MOD Single : A 116 THR OG1 : rot 75:sc= 0.21 USER MOD Single : A 117 TYR OH : rot 31:sc= -0.867 USER MOD Single : A 118 THR OG1 : rot 59:sc= 2.01 USER MOD Single : A 125 LYS NZ :NH3+ -129:sc= 0.0441 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ -96:sc= -0.111 (180deg=-0.77) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 PLM O1 : rot 153:sc= 0.352 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.524 6.931 2.795 1.00 0.00 N ATOM 2 CA ALA A 1 3.820 7.702 1.601 1.00 0.00 C ATOM 3 C ALA A 1 5.057 8.543 1.849 1.00 0.00 C ATOM 4 O ALA A 1 5.033 9.744 1.648 1.00 0.00 O ATOM 5 CB ALA A 1 2.669 8.685 1.350 1.00 0.00 C ATOM 0 H1 ALA A 1 2.676 6.351 2.632 1.00 0.00 H new ATOM 0 H2 ALA A 1 4.330 6.312 3.017 1.00 0.00 H new ATOM 0 H3 ALA A 1 3.354 7.577 3.592 1.00 0.00 H new ATOM 0 HA ALA A 1 3.961 7.023 0.760 1.00 0.00 H new ATOM 0 HB1 ALA A 1 2.879 9.271 0.455 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.741 8.131 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 1 2.568 9.353 2.205 1.00 0.00 H new ATOM 13 N PHE A 2 6.153 7.966 2.276 1.00 0.00 N ATOM 14 CA PHE A 2 7.345 8.750 2.517 1.00 0.00 C ATOM 15 C PHE A 2 8.143 8.997 1.255 1.00 0.00 C ATOM 16 O PHE A 2 9.186 9.635 1.296 1.00 0.00 O ATOM 17 CB PHE A 2 8.159 8.039 3.590 1.00 0.00 C ATOM 18 CG PHE A 2 7.296 7.716 4.789 1.00 0.00 C ATOM 19 CD1 PHE A 2 6.537 8.695 5.443 1.00 0.00 C ATOM 20 CD2 PHE A 2 7.256 6.418 5.252 1.00 0.00 C ATOM 21 CE1 PHE A 2 5.772 8.310 6.538 1.00 0.00 C ATOM 22 CE2 PHE A 2 6.503 6.005 6.342 1.00 0.00 C ATOM 23 CZ PHE A 2 5.752 7.000 6.980 1.00 0.00 C ATOM 0 H PHE A 2 6.248 6.968 2.463 1.00 0.00 H new ATOM 0 HA PHE A 2 7.065 9.744 2.865 1.00 0.00 H new ATOM 0 HB2 PHE A 2 8.583 7.121 3.183 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.995 8.668 3.896 1.00 0.00 H new ATOM 0 HD1 PHE A 2 6.546 9.721 5.106 1.00 0.00 H new ATOM 0 HD2 PHE A 2 7.847 5.677 4.734 1.00 0.00 H new ATOM 0 HE1 PHE A 2 5.180 9.051 7.055 1.00 0.00 H new ATOM 0 HE2 PHE A 2 6.497 4.979 6.678 1.00 0.00 H new ATOM 0 HZ PHE A 2 5.145 6.739 7.834 1.00 0.00 H new ATOM 33 N ASP A 3 7.652 8.492 0.140 1.00 0.00 N ATOM 34 CA ASP A 3 8.289 8.629 -1.159 1.00 0.00 C ATOM 35 C ASP A 3 8.562 10.038 -1.594 1.00 0.00 C ATOM 36 O ASP A 3 7.749 10.648 -2.301 1.00 0.00 O ATOM 37 CB ASP A 3 7.509 7.894 -2.267 1.00 0.00 C ATOM 38 CG ASP A 3 6.076 8.265 -2.245 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.568 8.805 -1.281 1.00 0.00 O ATOM 40 OD2 ASP A 3 5.462 7.937 -3.379 1.00 0.00 O ATOM 0 H ASP A 3 6.780 7.963 0.109 1.00 0.00 H new ATOM 0 HA ASP A 3 9.261 8.159 -1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.936 8.138 -3.240 1.00 0.00 H new ATOM 0 HB3 ASP A 3 7.611 6.817 -2.135 1.00 0.00 H new ATOM 45 N GLY A 4 9.710 10.496 -1.139 1.00 0.00 N ATOM 46 CA GLY A 4 10.046 11.842 -1.510 1.00 0.00 C ATOM 47 C GLY A 4 11.384 12.235 -0.935 1.00 0.00 C ATOM 48 O GLY A 4 12.259 11.407 -0.713 1.00 0.00 O ATOM 0 H GLY A 4 10.379 9.995 -0.554 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.071 11.930 -2.596 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.276 12.526 -1.153 1.00 0.00 H new ATOM 52 N THR A 5 11.537 13.535 -0.690 1.00 0.00 N ATOM 53 CA THR A 5 12.761 14.030 -0.148 1.00 0.00 C ATOM 54 C THR A 5 12.653 14.829 1.124 1.00 0.00 C ATOM 55 O THR A 5 11.652 15.477 1.371 1.00 0.00 O ATOM 56 CB THR A 5 13.810 14.610 -1.133 1.00 0.00 C ATOM 57 OG1 THR A 5 14.069 15.983 -0.979 1.00 0.00 O ATOM 58 CG2 THR A 5 13.925 13.987 -2.500 1.00 0.00 C ATOM 0 H THR A 5 10.824 14.244 -0.863 1.00 0.00 H new ATOM 0 HA THR A 5 13.195 13.074 0.144 1.00 0.00 H new ATOM 0 HB THR A 5 14.744 14.184 -0.767 1.00 0.00 H new ATOM 0 HG1 THR A 5 14.740 16.265 -1.635 1.00 0.00 H new ATOM 0 HG21 THR A 5 14.699 14.501 -3.070 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.187 12.934 -2.399 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.972 14.075 -3.021 1.00 0.00 H new ATOM 66 N TRP A 6 13.753 14.731 1.891 1.00 0.00 N ATOM 67 CA TRP A 6 13.849 15.457 3.147 1.00 0.00 C ATOM 68 C TRP A 6 15.233 16.028 3.204 1.00 0.00 C ATOM 69 O TRP A 6 15.833 16.013 2.130 1.00 0.00 O ATOM 70 CB TRP A 6 13.519 14.470 4.267 1.00 0.00 C ATOM 71 CG TRP A 6 12.281 13.703 3.912 1.00 0.00 C ATOM 72 CD1 TRP A 6 12.156 12.594 3.135 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.950 13.948 4.288 1.00 0.00 C ATOM 74 NE1 TRP A 6 10.874 12.133 2.994 1.00 0.00 N ATOM 75 CE2 TRP A 6 10.097 12.981 3.719 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.362 14.920 5.075 1.00 0.00 C ATOM 77 CZ2 TRP A 6 8.702 12.981 3.925 1.00 0.00 C ATOM 78 CZ3 TRP A 6 9.013 14.955 5.294 1.00 0.00 C ATOM 79 CH2 TRP A 6 8.195 13.981 4.715 1.00 0.00 C ATOM 0 H TRP A 6 14.569 14.164 1.660 1.00 0.00 H new ATOM 0 HA TRP A 6 13.151 16.288 3.248 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.353 13.785 4.419 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.371 15.005 5.205 1.00 0.00 H new ATOM 0 HD1 TRP A 6 13.002 12.114 2.666 1.00 0.00 H new ATOM 0 HE1 TRP A 6 10.566 11.322 2.457 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.987 15.674 5.530 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 8.064 12.230 3.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.582 15.730 5.910 1.00 0.00 H new ATOM 0 HH2 TRP A 6 7.131 14.017 4.895 1.00 0.00 H new ATOM 90 N LYS A 7 15.777 16.540 4.310 1.00 0.00 N ATOM 91 CA LYS A 7 17.062 17.157 4.449 1.00 0.00 C ATOM 92 C LYS A 7 17.309 17.684 5.866 1.00 0.00 C ATOM 93 O LYS A 7 18.081 18.637 5.891 1.00 0.00 O ATOM 94 CB LYS A 7 17.195 18.350 3.494 1.00 0.00 C ATOM 95 CG LYS A 7 18.587 18.486 2.900 1.00 0.00 C ATOM 96 CD LYS A 7 18.698 19.755 2.053 1.00 0.00 C ATOM 97 CE LYS A 7 18.056 20.964 2.701 1.00 0.00 C ATOM 98 NZ LYS A 7 18.523 22.278 2.241 1.00 0.00 N ATOM 0 H LYS A 7 15.272 16.523 5.196 1.00 0.00 H new ATOM 0 HA LYS A 7 17.791 16.381 4.218 1.00 0.00 H new ATOM 0 HB2 LYS A 7 16.471 18.244 2.686 1.00 0.00 H new ATOM 0 HB3 LYS A 7 16.944 19.266 4.029 1.00 0.00 H new ATOM 0 HG2 LYS A 7 19.327 18.512 3.700 1.00 0.00 H new ATOM 0 HG3 LYS A 7 18.812 17.614 2.286 1.00 0.00 H new ATOM 0 HD2 LYS A 7 19.750 19.968 1.865 1.00 0.00 H new ATOM 0 HD3 LYS A 7 18.231 19.579 1.084 1.00 0.00 H new ATOM 0 HE2 LYS A 7 16.980 20.908 2.538 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.219 20.901 3.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.014 23.026 2.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 19.543 22.367 2.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.343 22.373 1.221 1.00 0.00 H new ATOM 112 N VAL A 8 16.733 17.150 6.914 1.00 0.00 N ATOM 113 CA VAL A 8 16.888 17.566 8.288 1.00 0.00 C ATOM 114 C VAL A 8 17.504 18.923 8.521 1.00 0.00 C ATOM 115 O VAL A 8 18.714 19.153 8.319 1.00 0.00 O ATOM 116 CB VAL A 8 17.377 16.360 9.140 1.00 0.00 C ATOM 117 CG1 VAL A 8 17.452 15.035 8.438 1.00 0.00 C ATOM 118 CG2 VAL A 8 18.624 16.633 10.002 1.00 0.00 C ATOM 0 H VAL A 8 16.098 16.357 6.824 1.00 0.00 H new ATOM 0 HA VAL A 8 15.907 17.827 8.685 1.00 0.00 H new ATOM 0 HB VAL A 8 16.545 16.253 9.836 1.00 0.00 H new ATOM 0 HG11 VAL A 8 17.805 14.274 9.134 1.00 0.00 H new ATOM 0 HG12 VAL A 8 16.463 14.761 8.072 1.00 0.00 H new ATOM 0 HG13 VAL A 8 18.143 15.107 7.598 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.886 15.733 10.558 1.00 0.00 H new ATOM 0 HG22 VAL A 8 19.456 16.917 9.358 1.00 0.00 H new ATOM 0 HG23 VAL A 8 18.413 17.443 10.701 1.00 0.00 H new ATOM 128 N ASP A 9 16.689 19.897 8.974 1.00 0.00 N ATOM 129 CA ASP A 9 17.197 21.225 9.194 1.00 0.00 C ATOM 130 C ASP A 9 16.877 21.759 10.557 1.00 0.00 C ATOM 131 O ASP A 9 17.764 21.915 11.385 1.00 0.00 O ATOM 132 CB ASP A 9 16.563 22.185 8.151 1.00 0.00 C ATOM 133 CG ASP A 9 17.305 23.435 7.809 1.00 0.00 C ATOM 134 OD1 ASP A 9 18.306 23.743 8.577 1.00 0.00 O ATOM 135 OD2 ASP A 9 16.970 24.113 6.865 1.00 0.00 O ATOM 0 H ASP A 9 15.699 19.773 9.185 1.00 0.00 H new ATOM 0 HA ASP A 9 18.281 21.168 9.099 1.00 0.00 H new ATOM 0 HB2 ASP A 9 16.411 21.624 7.229 1.00 0.00 H new ATOM 0 HB3 ASP A 9 15.577 22.471 8.516 1.00 0.00 H new ATOM 140 N ARG A 10 15.641 22.048 10.834 1.00 0.00 N ATOM 141 CA ARG A 10 15.338 22.566 12.156 1.00 0.00 C ATOM 142 C ARG A 10 15.158 21.459 13.150 1.00 0.00 C ATOM 143 O ARG A 10 14.072 20.903 13.273 1.00 0.00 O ATOM 144 CB ARG A 10 14.178 23.551 12.195 1.00 0.00 C ATOM 145 CG ARG A 10 12.884 23.032 11.593 1.00 0.00 C ATOM 146 CD ARG A 10 11.946 24.151 11.089 1.00 0.00 C ATOM 147 NE ARG A 10 12.671 25.243 10.494 1.00 0.00 N ATOM 148 CZ ARG A 10 12.828 26.441 11.080 1.00 0.00 C ATOM 149 NH1 ARG A 10 12.328 26.772 12.302 1.00 0.00 N ATOM 150 NH2 ARG A 10 13.532 27.329 10.376 1.00 0.00 N ATOM 0 H ARG A 10 14.848 21.944 10.201 1.00 0.00 H new ATOM 0 HA ARG A 10 16.213 23.149 12.444 1.00 0.00 H new ATOM 0 HB2 ARG A 10 13.993 23.833 13.232 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.471 24.458 11.666 1.00 0.00 H new ATOM 0 HG2 ARG A 10 13.120 22.366 10.763 1.00 0.00 H new ATOM 0 HG3 ARG A 10 12.358 22.437 12.340 1.00 0.00 H new ATOM 0 HD2 ARG A 10 11.251 23.738 10.358 1.00 0.00 H new ATOM 0 HD3 ARG A 10 11.349 24.524 11.921 1.00 0.00 H new ATOM 0 HE ARG A 10 13.089 25.099 9.575 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.793 26.088 12.836 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.489 27.704 12.683 1.00 0.00 H new ATOM 0 HH21 ARG A 10 13.906 27.074 9.462 1.00 0.00 H new ATOM 0 HH22 ARG A 10 13.696 28.263 10.752 1.00 0.00 H new ATOM 164 N ASN A 11 16.273 21.197 13.823 1.00 0.00 N ATOM 165 CA ASN A 11 16.301 20.158 14.821 1.00 0.00 C ATOM 166 C ASN A 11 16.011 20.769 16.174 1.00 0.00 C ATOM 167 O ASN A 11 15.669 21.961 16.224 1.00 0.00 O ATOM 168 CB ASN A 11 17.763 19.627 14.905 1.00 0.00 C ATOM 169 CG ASN A 11 18.723 19.996 13.805 1.00 0.00 C ATOM 170 OD1 ASN A 11 19.130 21.112 13.540 1.00 0.00 O ATOM 171 ND2 ASN A 11 19.138 18.970 13.060 1.00 0.00 N ATOM 0 H ASN A 11 17.156 21.690 13.691 1.00 0.00 H new ATOM 0 HA ASN A 11 15.580 19.381 14.567 1.00 0.00 H new ATOM 0 HB2 ASN A 11 18.188 19.973 15.847 1.00 0.00 H new ATOM 0 HB3 ASN A 11 17.719 18.539 14.956 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.783 19.130 12.286 1.00 0.00 H new ATOM 0 HD22 ASN A 11 18.810 18.026 13.264 1.00 0.00 H new ATOM 178 N GLU A 12 16.112 20.070 17.273 1.00 0.00 N ATOM 179 CA GLU A 12 15.815 20.723 18.528 1.00 0.00 C ATOM 180 C GLU A 12 16.773 20.185 19.599 1.00 0.00 C ATOM 181 O GLU A 12 17.585 20.982 20.039 1.00 0.00 O ATOM 182 CB GLU A 12 14.376 20.449 18.992 1.00 0.00 C ATOM 183 CG GLU A 12 13.732 21.656 19.732 1.00 0.00 C ATOM 184 CD GLU A 12 14.269 22.008 21.106 1.00 0.00 C ATOM 185 OE1 GLU A 12 14.927 21.026 21.667 1.00 0.00 O ATOM 186 OE2 GLU A 12 14.136 23.078 21.680 1.00 0.00 O ATOM 0 H GLU A 12 16.385 19.089 17.332 1.00 0.00 H new ATOM 0 HA GLU A 12 15.932 21.797 18.384 1.00 0.00 H new ATOM 0 HB2 GLU A 12 13.764 20.193 18.127 1.00 0.00 H new ATOM 0 HB3 GLU A 12 14.373 19.582 19.653 1.00 0.00 H new ATOM 0 HG2 GLU A 12 13.837 22.535 19.096 1.00 0.00 H new ATOM 0 HG3 GLU A 12 12.664 21.459 19.829 1.00 0.00 H new ATOM 193 N ASN A 13 16.625 18.910 19.940 1.00 0.00 N ATOM 194 CA ASN A 13 17.485 18.292 20.948 1.00 0.00 C ATOM 195 C ASN A 13 18.682 17.543 20.357 1.00 0.00 C ATOM 196 O ASN A 13 19.325 16.753 21.026 1.00 0.00 O ATOM 197 CB ASN A 13 16.707 17.371 21.918 1.00 0.00 C ATOM 198 CG ASN A 13 17.336 17.239 23.284 1.00 0.00 C ATOM 199 OD1 ASN A 13 16.898 17.824 24.266 1.00 0.00 O ATOM 200 ND2 ASN A 13 18.412 16.458 23.403 1.00 0.00 N ATOM 0 H ASN A 13 15.924 18.287 19.539 1.00 0.00 H new ATOM 0 HA ASN A 13 17.878 19.134 21.519 1.00 0.00 H new ATOM 0 HB2 ASN A 13 15.694 17.756 22.033 1.00 0.00 H new ATOM 0 HB3 ASN A 13 16.623 16.380 21.472 1.00 0.00 H new ATOM 0 HD21 ASN A 13 18.866 16.350 24.310 1.00 0.00 H new ATOM 0 HD22 ASN A 13 18.780 15.969 22.587 1.00 0.00 H new ATOM 207 N TYR A 14 18.905 17.854 19.095 1.00 0.00 N ATOM 208 CA TYR A 14 19.985 17.286 18.297 1.00 0.00 C ATOM 209 C TYR A 14 21.413 17.813 18.538 1.00 0.00 C ATOM 210 O TYR A 14 22.391 17.118 18.310 1.00 0.00 O ATOM 211 CB TYR A 14 19.686 17.093 16.822 1.00 0.00 C ATOM 212 CG TYR A 14 20.238 15.813 16.184 1.00 0.00 C ATOM 213 CD1 TYR A 14 21.069 14.891 16.795 1.00 0.00 C ATOM 214 CD2 TYR A 14 19.879 15.544 14.867 1.00 0.00 C ATOM 215 CE1 TYR A 14 21.498 13.758 16.081 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.286 14.440 14.144 1.00 0.00 C ATOM 217 CZ TYR A 14 21.122 13.518 14.771 1.00 0.00 C ATOM 218 OH TYR A 14 21.550 12.408 14.083 1.00 0.00 O ATOM 0 H TYR A 14 18.331 18.522 18.581 1.00 0.00 H new ATOM 0 HA TYR A 14 20.003 16.290 18.739 1.00 0.00 H new ATOM 0 HB2 TYR A 14 18.604 17.105 16.687 1.00 0.00 H new ATOM 0 HB3 TYR A 14 20.085 17.948 16.276 1.00 0.00 H new ATOM 0 HD1 TYR A 14 21.387 15.041 17.816 1.00 0.00 H new ATOM 0 HD2 TYR A 14 19.232 16.253 14.372 1.00 0.00 H new ATOM 0 HE1 TYR A 14 22.146 13.048 16.574 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.966 14.295 13.123 1.00 0.00 H new ATOM 0 HH TYR A 14 21.176 12.420 13.177 1.00 0.00 H new ATOM 228 N GLU A 15 21.533 19.055 19.017 1.00 0.00 N ATOM 229 CA GLU A 15 22.859 19.594 19.261 1.00 0.00 C ATOM 230 C GLU A 15 23.488 19.004 20.505 1.00 0.00 C ATOM 231 O GLU A 15 24.682 18.747 20.582 1.00 0.00 O ATOM 232 CB GLU A 15 22.805 21.142 19.284 1.00 0.00 C ATOM 233 CG GLU A 15 22.370 21.703 20.656 1.00 0.00 C ATOM 234 CD GLU A 15 21.684 23.055 20.634 1.00 0.00 C ATOM 235 OE1 GLU A 15 20.542 22.980 19.992 1.00 0.00 O ATOM 236 OE2 GLU A 15 22.115 24.107 21.133 1.00 0.00 O ATOM 0 H GLU A 15 20.756 19.680 19.234 1.00 0.00 H new ATOM 0 HA GLU A 15 23.513 19.301 18.440 1.00 0.00 H new ATOM 0 HB2 GLU A 15 23.787 21.540 19.028 1.00 0.00 H new ATOM 0 HB3 GLU A 15 22.112 21.489 18.518 1.00 0.00 H new ATOM 0 HG2 GLU A 15 21.697 20.984 21.124 1.00 0.00 H new ATOM 0 HG3 GLU A 15 23.252 21.775 21.293 1.00 0.00 H new ATOM 243 N LYS A 16 22.599 18.808 21.483 1.00 0.00 N ATOM 244 CA LYS A 16 23.025 18.257 22.748 1.00 0.00 C ATOM 245 C LYS A 16 23.237 16.754 22.722 1.00 0.00 C ATOM 246 O LYS A 16 23.973 16.104 23.489 1.00 0.00 O ATOM 247 CB LYS A 16 22.049 18.707 23.851 1.00 0.00 C ATOM 248 CG LYS A 16 22.632 18.513 25.244 1.00 0.00 C ATOM 249 CD LYS A 16 21.626 18.261 26.366 1.00 0.00 C ATOM 250 CE LYS A 16 20.338 19.097 26.302 1.00 0.00 C ATOM 251 NZ LYS A 16 19.743 19.484 27.606 1.00 0.00 N ATOM 0 H LYS A 16 21.604 19.021 21.416 1.00 0.00 H new ATOM 0 HA LYS A 16 24.016 18.654 22.970 1.00 0.00 H new ATOM 0 HB2 LYS A 16 21.798 19.758 23.706 1.00 0.00 H new ATOM 0 HB3 LYS A 16 21.120 18.143 23.765 1.00 0.00 H new ATOM 0 HG2 LYS A 16 23.326 17.673 25.211 1.00 0.00 H new ATOM 0 HG3 LYS A 16 23.214 19.399 25.498 1.00 0.00 H new ATOM 0 HD2 LYS A 16 21.354 17.206 26.356 1.00 0.00 H new ATOM 0 HD3 LYS A 16 22.117 18.454 27.320 1.00 0.00 H new ATOM 0 HE2 LYS A 16 20.547 20.006 25.737 1.00 0.00 H new ATOM 0 HE3 LYS A 16 19.593 18.536 25.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 18.881 20.043 27.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 19.503 18.628 28.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 20.427 20.052 28.145 1.00 0.00 H new ATOM 265 N PHE A 17 22.541 16.118 21.774 1.00 0.00 N ATOM 266 CA PHE A 17 22.619 14.691 21.613 1.00 0.00 C ATOM 267 C PHE A 17 23.985 14.210 21.153 1.00 0.00 C ATOM 268 O PHE A 17 24.500 13.131 21.435 1.00 0.00 O ATOM 269 CB PHE A 17 21.502 14.299 20.629 1.00 0.00 C ATOM 270 CG PHE A 17 21.396 12.826 20.311 1.00 0.00 C ATOM 271 CD1 PHE A 17 21.645 11.918 21.355 1.00 0.00 C ATOM 272 CD2 PHE A 17 21.072 12.346 19.054 1.00 0.00 C ATOM 273 CE1 PHE A 17 21.532 10.561 21.023 1.00 0.00 C ATOM 274 CE2 PHE A 17 20.971 10.993 18.723 1.00 0.00 C ATOM 275 CZ PHE A 17 21.213 10.101 19.759 1.00 0.00 C ATOM 0 H PHE A 17 21.920 16.584 21.113 1.00 0.00 H new ATOM 0 HA PHE A 17 22.481 14.202 22.577 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.549 14.633 21.039 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.657 14.843 19.697 1.00 0.00 H new ATOM 0 HD1 PHE A 17 21.907 12.246 22.350 1.00 0.00 H new ATOM 0 HD2 PHE A 17 20.884 13.069 18.274 1.00 0.00 H new ATOM 0 HE1 PHE A 17 21.704 9.832 21.801 1.00 0.00 H new ATOM 0 HE2 PHE A 17 20.721 10.662 17.726 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.151 9.038 19.576 1.00 0.00 H new ATOM 285 N MET A 18 24.660 15.050 20.385 1.00 0.00 N ATOM 286 CA MET A 18 25.983 14.748 19.866 1.00 0.00 C ATOM 287 C MET A 18 26.946 14.866 21.025 1.00 0.00 C ATOM 288 O MET A 18 28.022 14.298 21.121 1.00 0.00 O ATOM 289 CB MET A 18 26.262 15.647 18.665 1.00 0.00 C ATOM 290 CG MET A 18 25.187 15.422 17.593 1.00 0.00 C ATOM 291 SD MET A 18 25.475 16.136 15.962 1.00 0.00 S ATOM 292 CE MET A 18 24.404 15.108 14.925 1.00 0.00 C ATOM 0 H MET A 18 24.304 15.963 20.103 1.00 0.00 H new ATOM 0 HA MET A 18 26.088 13.736 19.476 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.269 16.692 18.974 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.249 15.429 18.256 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.054 14.347 17.471 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.245 15.819 17.972 1.00 0.00 H new ATOM 0 HE1 MET A 18 24.846 15.006 13.934 1.00 0.00 H new ATOM 0 HE2 MET A 18 24.296 14.122 15.378 1.00 0.00 H new ATOM 0 HE3 MET A 18 23.424 15.576 14.838 1.00 0.00 H new ATOM 302 N GLU A 19 26.541 15.669 22.025 1.00 0.00 N ATOM 303 CA GLU A 19 27.412 15.841 23.202 1.00 0.00 C ATOM 304 C GLU A 19 27.375 14.564 24.055 1.00 0.00 C ATOM 305 O GLU A 19 28.250 14.227 24.849 1.00 0.00 O ATOM 306 CB GLU A 19 27.173 17.137 23.998 1.00 0.00 C ATOM 307 CG GLU A 19 27.750 17.168 25.442 1.00 0.00 C ATOM 308 CD GLU A 19 27.677 18.496 26.141 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.482 19.416 25.967 1.00 0.00 O ATOM 310 OE2 GLU A 19 26.632 18.503 26.952 1.00 0.00 O ATOM 0 H GLU A 19 25.662 16.186 22.047 1.00 0.00 H new ATOM 0 HA GLU A 19 28.430 15.981 22.840 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.603 17.968 23.439 1.00 0.00 H new ATOM 0 HB3 GLU A 19 26.099 17.312 24.054 1.00 0.00 H new ATOM 0 HG2 GLU A 19 27.217 16.431 26.043 1.00 0.00 H new ATOM 0 HG3 GLU A 19 28.793 16.854 25.404 1.00 0.00 H new ATOM 317 N LYS A 20 26.325 13.791 23.899 1.00 0.00 N ATOM 318 CA LYS A 20 26.064 12.548 24.578 1.00 0.00 C ATOM 319 C LYS A 20 26.916 11.372 24.047 1.00 0.00 C ATOM 320 O LYS A 20 27.370 10.541 24.824 1.00 0.00 O ATOM 321 CB LYS A 20 24.588 12.187 24.380 1.00 0.00 C ATOM 322 CG LYS A 20 24.155 11.106 25.303 1.00 0.00 C ATOM 323 CD LYS A 20 24.240 11.685 26.705 1.00 0.00 C ATOM 324 CE LYS A 20 23.256 10.960 27.573 1.00 0.00 C ATOM 325 NZ LYS A 20 23.977 9.968 28.387 1.00 0.00 N ATOM 0 H LYS A 20 25.579 14.034 23.247 1.00 0.00 H new ATOM 0 HA LYS A 20 26.321 12.696 25.627 1.00 0.00 H new ATOM 0 HB2 LYS A 20 23.973 13.072 24.543 1.00 0.00 H new ATOM 0 HB3 LYS A 20 24.426 11.871 23.349 1.00 0.00 H new ATOM 0 HG2 LYS A 20 23.139 10.784 25.076 1.00 0.00 H new ATOM 0 HG3 LYS A 20 24.796 10.230 25.204 1.00 0.00 H new ATOM 0 HD2 LYS A 20 25.249 11.575 27.101 1.00 0.00 H new ATOM 0 HD3 LYS A 20 24.019 12.752 26.689 1.00 0.00 H new ATOM 0 HE2 LYS A 20 22.730 11.665 28.217 1.00 0.00 H new ATOM 0 HE3 LYS A 20 22.503 10.467 26.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 23.302 9.460 28.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 24.459 9.291 27.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 24.680 10.452 28.982 1.00 0.00 H new ATOM 339 N MET A 21 27.090 11.369 22.722 1.00 0.00 N ATOM 340 CA MET A 21 27.856 10.354 22.036 1.00 0.00 C ATOM 341 C MET A 21 29.330 10.686 22.289 1.00 0.00 C ATOM 342 O MET A 21 30.143 9.804 22.475 1.00 0.00 O ATOM 343 CB MET A 21 27.579 10.468 20.539 1.00 0.00 C ATOM 344 CG MET A 21 26.599 9.442 19.978 1.00 0.00 C ATOM 345 SD MET A 21 26.616 9.379 18.180 1.00 0.00 S ATOM 346 CE MET A 21 25.609 10.860 17.929 1.00 0.00 C ATOM 0 H MET A 21 26.697 12.078 22.103 1.00 0.00 H new ATOM 0 HA MET A 21 27.603 9.351 22.380 1.00 0.00 H new ATOM 0 HB2 MET A 21 27.193 11.466 20.333 1.00 0.00 H new ATOM 0 HB3 MET A 21 28.524 10.375 20.003 1.00 0.00 H new ATOM 0 HG2 MET A 21 26.844 8.457 20.375 1.00 0.00 H new ATOM 0 HG3 MET A 21 25.592 9.682 20.320 1.00 0.00 H new ATOM 0 HE1 MET A 21 24.688 10.591 17.412 1.00 0.00 H new ATOM 0 HE2 MET A 21 25.366 11.303 18.895 1.00 0.00 H new ATOM 0 HE3 MET A 21 26.165 11.580 17.329 1.00 0.00 H new ATOM 356 N GLY A 22 29.614 11.959 22.282 1.00 0.00 N ATOM 357 CA GLY A 22 30.966 12.433 22.505 1.00 0.00 C ATOM 358 C GLY A 22 31.437 13.349 21.386 1.00 0.00 C ATOM 359 O GLY A 22 32.579 13.172 20.969 1.00 0.00 O ATOM 0 H GLY A 22 28.928 12.697 22.124 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.012 12.966 23.454 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.641 11.581 22.585 1.00 0.00 H new ATOM 363 N ILE A 23 30.563 14.277 20.941 1.00 0.00 N ATOM 364 CA ILE A 23 30.817 15.219 19.895 1.00 0.00 C ATOM 365 C ILE A 23 30.677 16.626 20.505 1.00 0.00 C ATOM 366 O ILE A 23 29.522 16.989 20.760 1.00 0.00 O ATOM 367 CB ILE A 23 29.818 15.043 18.767 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.364 13.596 18.688 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.345 15.684 17.462 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.262 13.062 17.246 1.00 0.00 C ATOM 0 H ILE A 23 29.627 14.372 21.336 1.00 0.00 H new ATOM 0 HA ILE A 23 31.815 15.069 19.482 1.00 0.00 H new ATOM 0 HB ILE A 23 28.900 15.596 18.967 1.00 0.00 H new ATOM 0 HG12 ILE A 23 30.061 12.974 19.249 1.00 0.00 H new ATOM 0 HG13 ILE A 23 28.392 13.502 19.172 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.612 15.546 16.667 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.511 16.749 17.621 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.284 15.209 17.177 1.00 0.00 H new ATOM 0 HD11 ILE A 23 28.933 12.023 17.265 1.00 0.00 H new ATOM 0 HD12 ILE A 23 28.543 13.660 16.686 1.00 0.00 H new ATOM 0 HD13 ILE A 23 30.238 13.124 16.765 1.00 0.00 H new ATOM 382 N ASN A 24 31.761 17.363 20.722 1.00 0.00 N ATOM 383 CA ASN A 24 31.676 18.681 21.297 1.00 0.00 C ATOM 384 C ASN A 24 32.482 19.763 20.569 1.00 0.00 C ATOM 385 O ASN A 24 32.679 20.831 21.134 1.00 0.00 O ATOM 386 CB ASN A 24 31.971 18.664 22.822 1.00 0.00 C ATOM 387 CG ASN A 24 32.693 17.458 23.391 1.00 0.00 C ATOM 388 OD1 ASN A 24 33.872 17.563 23.773 1.00 0.00 O ATOM 389 ND2 ASN A 24 31.983 16.327 23.438 1.00 0.00 N ATOM 0 H ASN A 24 32.710 17.059 20.503 1.00 0.00 H new ATOM 0 HA ASN A 24 30.637 18.976 21.153 1.00 0.00 H new ATOM 0 HB2 ASN A 24 32.561 19.549 23.058 1.00 0.00 H new ATOM 0 HB3 ASN A 24 31.021 18.764 23.348 1.00 0.00 H new ATOM 0 HD21 ASN A 24 32.405 15.475 23.806 1.00 0.00 H new ATOM 0 HD22 ASN A 24 31.019 16.316 23.106 1.00 0.00 H new ATOM 396 N VAL A 25 32.903 19.406 19.337 1.00 0.00 N ATOM 397 CA VAL A 25 33.691 20.286 18.454 1.00 0.00 C ATOM 398 C VAL A 25 33.053 20.616 17.138 1.00 0.00 C ATOM 399 O VAL A 25 31.868 20.892 17.154 1.00 0.00 O ATOM 400 CB VAL A 25 35.192 20.020 18.335 1.00 0.00 C ATOM 401 CG1 VAL A 25 35.944 20.127 19.670 1.00 0.00 C ATOM 402 CG2 VAL A 25 35.500 18.682 17.668 1.00 0.00 C ATOM 0 H VAL A 25 32.704 18.494 18.927 1.00 0.00 H new ATOM 0 HA VAL A 25 33.655 21.200 19.047 1.00 0.00 H new ATOM 0 HB VAL A 25 35.559 20.819 17.691 1.00 0.00 H new ATOM 0 HG11 VAL A 25 37.003 19.926 19.508 1.00 0.00 H new ATOM 0 HG12 VAL A 25 35.823 21.131 20.076 1.00 0.00 H new ATOM 0 HG13 VAL A 25 35.540 19.400 20.374 1.00 0.00 H new ATOM 0 HG21 VAL A 25 36.580 18.545 17.609 1.00 0.00 H new ATOM 0 HG22 VAL A 25 35.063 17.874 18.254 1.00 0.00 H new ATOM 0 HG23 VAL A 25 35.078 18.671 16.663 1.00 0.00 H new ATOM 412 N VAL A 26 33.745 20.603 16.003 1.00 0.00 N ATOM 413 CA VAL A 26 33.163 20.911 14.722 1.00 0.00 C ATOM 414 C VAL A 26 32.224 19.858 14.208 1.00 0.00 C ATOM 415 O VAL A 26 31.338 20.162 13.387 1.00 0.00 O ATOM 416 CB VAL A 26 34.022 21.557 13.614 1.00 0.00 C ATOM 417 CG1 VAL A 26 34.943 22.656 14.128 1.00 0.00 C ATOM 418 CG2 VAL A 26 34.786 20.445 12.901 1.00 0.00 C ATOM 0 H VAL A 26 34.738 20.374 15.958 1.00 0.00 H new ATOM 0 HA VAL A 26 32.577 21.780 15.021 1.00 0.00 H new ATOM 0 HB VAL A 26 33.365 22.067 12.910 1.00 0.00 H new ATOM 0 HG11 VAL A 26 35.518 23.067 13.298 1.00 0.00 H new ATOM 0 HG12 VAL A 26 34.347 23.447 14.583 1.00 0.00 H new ATOM 0 HG13 VAL A 26 35.624 22.242 14.871 1.00 0.00 H new ATOM 0 HG21 VAL A 26 35.402 20.875 12.112 1.00 0.00 H new ATOM 0 HG22 VAL A 26 35.423 19.925 13.616 1.00 0.00 H new ATOM 0 HG23 VAL A 26 34.079 19.739 12.465 1.00 0.00 H new ATOM 428 N LYS A 27 32.401 18.629 14.674 1.00 0.00 N ATOM 429 CA LYS A 27 31.590 17.503 14.281 1.00 0.00 C ATOM 430 C LYS A 27 30.148 17.574 14.715 1.00 0.00 C ATOM 431 O LYS A 27 29.278 17.109 13.987 1.00 0.00 O ATOM 432 CB LYS A 27 32.239 16.217 14.785 1.00 0.00 C ATOM 433 CG LYS A 27 33.136 15.607 13.728 1.00 0.00 C ATOM 434 CD LYS A 27 34.097 14.587 14.296 1.00 0.00 C ATOM 435 CE LYS A 27 35.218 15.177 15.110 1.00 0.00 C ATOM 436 NZ LYS A 27 36.023 16.163 14.359 1.00 0.00 N ATOM 0 H LYS A 27 33.128 18.391 15.348 1.00 0.00 H new ATOM 0 HA LYS A 27 31.552 17.521 13.192 1.00 0.00 H new ATOM 0 HB2 LYS A 27 32.821 16.427 15.682 1.00 0.00 H new ATOM 0 HB3 LYS A 27 31.466 15.502 15.067 1.00 0.00 H new ATOM 0 HG2 LYS A 27 32.520 15.133 12.964 1.00 0.00 H new ATOM 0 HG3 LYS A 27 33.701 16.399 13.236 1.00 0.00 H new ATOM 0 HD2 LYS A 27 33.540 13.888 14.920 1.00 0.00 H new ATOM 0 HD3 LYS A 27 34.524 14.011 13.475 1.00 0.00 H new ATOM 0 HE2 LYS A 27 34.802 15.656 15.996 1.00 0.00 H new ATOM 0 HE3 LYS A 27 35.869 14.374 15.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 36.905 16.356 14.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 36.248 15.783 13.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 35.483 17.046 14.256 1.00 0.00 H new ATOM 450 N ARG A 28 29.883 18.150 15.893 1.00 0.00 N ATOM 451 CA ARG A 28 28.476 18.219 16.321 1.00 0.00 C ATOM 452 C ARG A 28 27.810 19.367 15.581 1.00 0.00 C ATOM 453 O ARG A 28 26.605 19.432 15.377 1.00 0.00 O ATOM 454 CB ARG A 28 28.253 18.484 17.793 1.00 0.00 C ATOM 455 CG ARG A 28 28.886 19.759 18.247 1.00 0.00 C ATOM 456 CD ARG A 28 28.254 20.107 19.563 1.00 0.00 C ATOM 457 NE ARG A 28 28.210 21.554 19.812 1.00 0.00 N ATOM 458 CZ ARG A 28 27.314 22.258 20.531 1.00 0.00 C ATOM 459 NH1 ARG A 28 26.303 21.633 21.121 1.00 0.00 N ATOM 460 NH2 ARG A 28 27.434 23.575 20.652 1.00 0.00 N ATOM 0 H ARG A 28 30.570 18.551 16.532 1.00 0.00 H new ATOM 0 HA ARG A 28 28.064 17.234 16.103 1.00 0.00 H new ATOM 0 HB2 ARG A 28 27.182 18.522 17.994 1.00 0.00 H new ATOM 0 HB3 ARG A 28 28.657 17.655 18.374 1.00 0.00 H new ATOM 0 HG2 ARG A 28 29.964 19.639 18.355 1.00 0.00 H new ATOM 0 HG3 ARG A 28 28.725 20.553 17.518 1.00 0.00 H new ATOM 0 HD2 ARG A 28 27.240 19.708 19.590 1.00 0.00 H new ATOM 0 HD3 ARG A 28 28.809 19.622 20.366 1.00 0.00 H new ATOM 0 HE ARG A 28 28.958 22.099 19.383 1.00 0.00 H new ATOM 0 HH11 ARG A 28 26.205 20.622 21.030 1.00 0.00 H new ATOM 0 HH12 ARG A 28 25.623 22.164 21.666 1.00 0.00 H new ATOM 0 HH21 ARG A 28 28.208 24.060 20.199 1.00 0.00 H new ATOM 0 HH22 ARG A 28 26.752 24.101 21.198 1.00 0.00 H new ATOM 474 N LYS A 29 28.669 20.322 15.163 1.00 0.00 N ATOM 475 CA LYS A 29 28.142 21.460 14.447 1.00 0.00 C ATOM 476 C LYS A 29 27.866 21.110 13.011 1.00 0.00 C ATOM 477 O LYS A 29 26.959 21.629 12.395 1.00 0.00 O ATOM 478 CB LYS A 29 29.033 22.668 14.478 1.00 0.00 C ATOM 479 CG LYS A 29 28.104 23.846 14.296 1.00 0.00 C ATOM 480 CD LYS A 29 28.872 25.143 14.425 1.00 0.00 C ATOM 481 CE LYS A 29 28.242 26.028 15.492 1.00 0.00 C ATOM 482 NZ LYS A 29 28.682 27.436 15.512 1.00 0.00 N ATOM 0 H LYS A 29 29.679 20.316 15.308 1.00 0.00 H new ATOM 0 HA LYS A 29 27.220 21.717 14.969 1.00 0.00 H new ATOM 0 HB2 LYS A 29 29.574 22.735 15.422 1.00 0.00 H new ATOM 0 HB3 LYS A 29 29.779 22.628 13.685 1.00 0.00 H new ATOM 0 HG2 LYS A 29 27.626 23.794 13.318 1.00 0.00 H new ATOM 0 HG3 LYS A 29 27.309 23.810 15.041 1.00 0.00 H new ATOM 0 HD2 LYS A 29 29.910 24.934 14.683 1.00 0.00 H new ATOM 0 HD3 LYS A 29 28.880 25.665 13.468 1.00 0.00 H new ATOM 0 HE2 LYS A 29 27.160 26.009 15.359 1.00 0.00 H new ATOM 0 HE3 LYS A 29 28.451 25.590 16.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 28.190 27.943 16.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 29.708 27.477 15.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 28.458 27.883 14.600 1.00 0.00 H new ATOM 496 N LEU A 30 28.683 20.208 12.497 1.00 0.00 N ATOM 497 CA LEU A 30 28.562 19.747 11.132 1.00 0.00 C ATOM 498 C LEU A 30 27.430 18.745 10.970 1.00 0.00 C ATOM 499 O LEU A 30 26.760 18.741 9.940 1.00 0.00 O ATOM 500 CB LEU A 30 29.838 19.023 10.668 1.00 0.00 C ATOM 501 CG LEU A 30 30.102 19.128 9.184 1.00 0.00 C ATOM 502 CD1 LEU A 30 29.983 20.594 8.730 1.00 0.00 C ATOM 503 CD2 LEU A 30 31.525 18.664 8.935 1.00 0.00 C ATOM 0 H LEU A 30 29.448 19.777 13.017 1.00 0.00 H new ATOM 0 HA LEU A 30 28.376 20.643 10.540 1.00 0.00 H new ATOM 0 HB2 LEU A 30 30.692 19.432 11.208 1.00 0.00 H new ATOM 0 HB3 LEU A 30 29.764 17.970 10.939 1.00 0.00 H new ATOM 0 HG LEU A 30 29.382 18.522 8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 30 30.175 20.660 7.659 1.00 0.00 H new ATOM 0 HD12 LEU A 30 28.978 20.960 8.942 1.00 0.00 H new ATOM 0 HD13 LEU A 30 30.711 21.202 9.267 1.00 0.00 H new ATOM 0 HD21 LEU A 30 31.747 18.728 7.870 1.00 0.00 H new ATOM 0 HD22 LEU A 30 32.217 19.299 9.489 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.634 17.632 9.267 1.00 0.00 H new ATOM 515 N GLY A 31 27.205 17.885 11.979 1.00 0.00 N ATOM 516 CA GLY A 31 26.172 16.879 11.964 1.00 0.00 C ATOM 517 C GLY A 31 24.771 17.471 12.131 1.00 0.00 C ATOM 518 O GLY A 31 23.814 16.871 11.688 1.00 0.00 O ATOM 0 H GLY A 31 27.757 17.884 12.837 1.00 0.00 H new ATOM 0 HA2 GLY A 31 26.220 16.328 11.025 1.00 0.00 H new ATOM 0 HA3 GLY A 31 26.357 16.162 12.764 1.00 0.00 H new ATOM 522 N ALA A 32 24.657 18.623 12.754 1.00 0.00 N ATOM 523 CA ALA A 32 23.408 19.345 13.001 1.00 0.00 C ATOM 524 C ALA A 32 22.963 20.030 11.718 1.00 0.00 C ATOM 525 O ALA A 32 21.755 20.140 11.537 1.00 0.00 O ATOM 526 CB ALA A 32 23.514 20.310 14.161 1.00 0.00 C ATOM 0 H ALA A 32 25.470 19.115 13.125 1.00 0.00 H new ATOM 0 HA ALA A 32 22.645 18.625 13.298 1.00 0.00 H new ATOM 0 HB1 ALA A 32 22.560 20.818 14.300 1.00 0.00 H new ATOM 0 HB2 ALA A 32 23.769 19.762 15.068 1.00 0.00 H new ATOM 0 HB3 ALA A 32 24.290 21.046 13.952 1.00 0.00 H new ATOM 532 N HIS A 33 23.941 20.450 10.905 1.00 0.00 N ATOM 533 CA HIS A 33 23.723 21.121 9.636 1.00 0.00 C ATOM 534 C HIS A 33 24.379 20.426 8.437 1.00 0.00 C ATOM 535 O HIS A 33 24.712 21.123 7.472 1.00 0.00 O ATOM 536 CB HIS A 33 24.027 22.617 9.597 1.00 0.00 C ATOM 537 CG HIS A 33 22.909 23.286 10.330 1.00 0.00 C ATOM 538 ND1 HIS A 33 22.885 23.254 11.707 1.00 0.00 N ATOM 539 CD2 HIS A 33 21.845 23.968 9.862 1.00 0.00 C ATOM 540 CE1 HIS A 33 21.801 23.920 12.052 1.00 0.00 C ATOM 541 NE2 HIS A 33 21.146 24.371 10.976 1.00 0.00 N ATOM 0 H HIS A 33 24.929 20.325 11.126 1.00 0.00 H new ATOM 0 HA HIS A 33 22.641 21.032 9.543 1.00 0.00 H new ATOM 0 HB2 HIS A 33 24.986 22.832 10.068 1.00 0.00 H new ATOM 0 HB3 HIS A 33 24.089 22.976 8.570 1.00 0.00 H new ATOM 0 HD2 HIS A 33 21.594 24.158 8.829 1.00 0.00 H new ATOM 0 HE1 HIS A 33 21.483 24.081 13.071 1.00 0.00 H new ATOM 0 HE2 HIS A 33 20.284 24.916 10.981 1.00 0.00 H new ATOM 550 N ASP A 34 24.551 19.094 8.493 1.00 0.00 N ATOM 551 CA ASP A 34 25.172 18.391 7.368 1.00 0.00 C ATOM 552 C ASP A 34 24.348 18.379 6.105 1.00 0.00 C ATOM 553 O ASP A 34 24.863 18.162 5.025 1.00 0.00 O ATOM 554 CB ASP A 34 25.373 16.902 7.695 1.00 0.00 C ATOM 555 CG ASP A 34 26.766 16.327 7.613 1.00 0.00 C ATOM 556 OD1 ASP A 34 27.754 16.975 7.726 1.00 0.00 O ATOM 557 OD2 ASP A 34 26.818 15.046 7.403 1.00 0.00 O ATOM 0 H ASP A 34 24.278 18.503 9.278 1.00 0.00 H new ATOM 0 HA ASP A 34 26.100 18.940 7.210 1.00 0.00 H new ATOM 0 HB2 ASP A 34 25.004 16.732 8.706 1.00 0.00 H new ATOM 0 HB3 ASP A 34 24.737 16.326 7.023 1.00 0.00 H new ATOM 562 N ASN A 35 23.058 18.624 6.244 1.00 0.00 N ATOM 563 CA ASN A 35 22.245 18.625 5.019 1.00 0.00 C ATOM 564 C ASN A 35 21.997 17.167 4.586 1.00 0.00 C ATOM 565 O ASN A 35 22.427 16.789 3.505 1.00 0.00 O ATOM 566 CB ASN A 35 22.693 19.466 3.834 1.00 0.00 C ATOM 567 CG ASN A 35 23.368 20.845 4.051 1.00 0.00 C ATOM 568 OD1 ASN A 35 23.046 21.445 5.074 1.00 0.00 O ATOM 569 ND2 ASN A 35 24.037 21.272 2.991 1.00 0.00 N ATOM 0 H ASN A 35 22.569 18.813 7.119 1.00 0.00 H new ATOM 0 HA ASN A 35 21.336 19.146 5.320 1.00 0.00 H new ATOM 0 HB2 ASN A 35 23.386 18.858 3.253 1.00 0.00 H new ATOM 0 HB3 ASN A 35 21.815 19.633 3.210 1.00 0.00 H new ATOM 0 HD21 ASN A 35 24.366 22.237 2.950 1.00 0.00 H new ATOM 0 HD22 ASN A 35 24.223 20.636 2.215 1.00 0.00 H new ATOM 576 N LEU A 36 21.316 16.440 5.472 1.00 0.00 N ATOM 577 CA LEU A 36 20.937 15.026 5.344 1.00 0.00 C ATOM 578 C LEU A 36 19.706 14.940 4.456 1.00 0.00 C ATOM 579 O LEU A 36 18.625 14.675 4.968 1.00 0.00 O ATOM 580 CB LEU A 36 20.601 14.453 6.716 1.00 0.00 C ATOM 581 CG LEU A 36 20.210 12.962 6.633 1.00 0.00 C ATOM 582 CD1 LEU A 36 21.396 12.028 6.478 1.00 0.00 C ATOM 583 CD2 LEU A 36 19.409 12.649 7.902 1.00 0.00 C ATOM 0 H LEU A 36 20.993 16.843 6.352 1.00 0.00 H new ATOM 0 HA LEU A 36 21.763 14.460 4.913 1.00 0.00 H new ATOM 0 HB2 LEU A 36 21.459 14.568 7.378 1.00 0.00 H new ATOM 0 HB3 LEU A 36 19.781 15.020 7.156 1.00 0.00 H new ATOM 0 HG LEU A 36 19.619 12.793 5.733 1.00 0.00 H new ATOM 0 HD11 LEU A 36 21.044 10.998 6.427 1.00 0.00 H new ATOM 0 HD12 LEU A 36 21.935 12.273 5.563 1.00 0.00 H new ATOM 0 HD13 LEU A 36 22.062 12.141 7.333 1.00 0.00 H new ATOM 0 HD21 LEU A 36 19.107 11.602 7.893 1.00 0.00 H new ATOM 0 HD22 LEU A 36 20.027 12.841 8.779 1.00 0.00 H new ATOM 0 HD23 LEU A 36 18.522 13.282 7.938 1.00 0.00 H new ATOM 595 N LYS A 37 19.963 15.162 3.196 1.00 0.00 N ATOM 596 CA LYS A 37 19.015 15.165 2.094 1.00 0.00 C ATOM 597 C LYS A 37 18.662 13.680 2.039 1.00 0.00 C ATOM 598 O LYS A 37 19.498 12.874 1.711 1.00 0.00 O ATOM 599 CB LYS A 37 19.614 15.713 0.832 1.00 0.00 C ATOM 600 CG LYS A 37 18.516 16.103 -0.171 1.00 0.00 C ATOM 601 CD LYS A 37 19.055 16.872 -1.362 1.00 0.00 C ATOM 602 CE LYS A 37 20.138 16.135 -2.133 1.00 0.00 C ATOM 603 NZ LYS A 37 19.672 15.611 -3.444 1.00 0.00 N ATOM 0 H LYS A 37 20.912 15.362 2.879 1.00 0.00 H new ATOM 0 HA LYS A 37 18.146 15.811 2.220 1.00 0.00 H new ATOM 0 HB2 LYS A 37 20.227 16.584 1.064 1.00 0.00 H new ATOM 0 HB3 LYS A 37 20.274 14.969 0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 37 18.015 15.201 -0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 37 17.765 16.708 0.337 1.00 0.00 H new ATOM 0 HD2 LYS A 37 18.231 17.098 -2.039 1.00 0.00 H new ATOM 0 HD3 LYS A 37 19.454 17.825 -1.016 1.00 0.00 H new ATOM 0 HE2 LYS A 37 20.980 16.808 -2.297 1.00 0.00 H new ATOM 0 HE3 LYS A 37 20.505 15.306 -1.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 20.455 15.120 -3.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 18.887 14.946 -3.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 19.347 16.401 -4.038 1.00 0.00 H new ATOM 617 N LEU A 38 17.453 13.397 2.382 1.00 0.00 N ATOM 618 CA LEU A 38 17.059 11.986 2.388 1.00 0.00 C ATOM 619 C LEU A 38 16.203 11.802 1.158 1.00 0.00 C ATOM 620 O LEU A 38 15.049 12.214 1.177 1.00 0.00 O ATOM 621 CB LEU A 38 16.143 11.948 3.637 1.00 0.00 C ATOM 622 CG LEU A 38 16.419 11.182 4.892 1.00 0.00 C ATOM 623 CD1 LEU A 38 17.633 11.590 5.671 1.00 0.00 C ATOM 624 CD2 LEU A 38 15.164 11.371 5.742 1.00 0.00 C ATOM 0 H LEU A 38 16.734 14.068 2.653 1.00 0.00 H new ATOM 0 HA LEU A 38 17.862 11.249 2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.016 12.986 3.944 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.173 11.599 3.283 1.00 0.00 H new ATOM 0 HG LEU A 38 16.642 10.150 4.622 1.00 0.00 H new ATOM 0 HD11 LEU A 38 17.725 10.962 6.557 1.00 0.00 H new ATOM 0 HD12 LEU A 38 18.521 11.473 5.049 1.00 0.00 H new ATOM 0 HD13 LEU A 38 17.538 12.633 5.974 1.00 0.00 H new ATOM 0 HD21 LEU A 38 15.281 10.839 6.686 1.00 0.00 H new ATOM 0 HD22 LEU A 38 15.015 12.433 5.939 1.00 0.00 H new ATOM 0 HD23 LEU A 38 14.300 10.976 5.208 1.00 0.00 H new ATOM 636 N THR A 39 16.617 11.234 0.059 1.00 0.00 N ATOM 637 CA THR A 39 15.718 11.098 -1.072 1.00 0.00 C ATOM 638 C THR A 39 15.136 9.692 -0.912 1.00 0.00 C ATOM 639 O THR A 39 15.631 8.716 -1.463 1.00 0.00 O ATOM 640 CB THR A 39 16.362 11.306 -2.463 1.00 0.00 C ATOM 641 OG1 THR A 39 16.461 12.690 -2.689 1.00 0.00 O ATOM 642 CG2 THR A 39 15.502 10.677 -3.550 1.00 0.00 C ATOM 0 H THR A 39 17.555 10.860 -0.085 1.00 0.00 H new ATOM 0 HA THR A 39 14.968 11.889 -1.055 1.00 0.00 H new ATOM 0 HB THR A 39 17.345 10.835 -2.489 1.00 0.00 H new ATOM 0 HG1 THR A 39 16.869 12.850 -3.566 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.971 10.834 -4.521 1.00 0.00 H new ATOM 0 HG22 THR A 39 15.403 9.608 -3.363 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.515 11.139 -3.545 1.00 0.00 H new ATOM 650 N ILE A 40 14.073 9.644 -0.130 1.00 0.00 N ATOM 651 CA ILE A 40 13.405 8.385 0.127 1.00 0.00 C ATOM 652 C ILE A 40 12.914 7.884 -1.232 1.00 0.00 C ATOM 653 O ILE A 40 12.558 8.724 -2.076 1.00 0.00 O ATOM 654 CB ILE A 40 12.280 8.484 1.140 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.680 9.232 2.406 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.754 7.090 1.533 1.00 0.00 C ATOM 657 CD1 ILE A 40 14.046 8.783 2.952 1.00 0.00 C ATOM 0 H ILE A 40 13.659 10.453 0.333 1.00 0.00 H new ATOM 0 HA ILE A 40 14.100 7.683 0.588 1.00 0.00 H new ATOM 0 HB ILE A 40 11.494 9.053 0.644 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.710 10.301 2.197 1.00 0.00 H new ATOM 0 HG13 ILE A 40 11.919 9.078 3.171 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.949 7.197 2.260 1.00 0.00 H new ATOM 0 HG22 ILE A 40 11.377 6.580 0.646 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.563 6.506 1.971 1.00 0.00 H new ATOM 0 HD11 ILE A 40 14.281 9.348 3.854 1.00 0.00 H new ATOM 0 HD12 ILE A 40 14.011 7.720 3.189 1.00 0.00 H new ATOM 0 HD13 ILE A 40 14.815 8.963 2.201 1.00 0.00 H new ATOM 669 N THR A 41 12.920 6.545 -1.375 1.00 0.00 N ATOM 670 CA THR A 41 12.478 5.918 -2.616 1.00 0.00 C ATOM 671 C THR A 41 11.879 4.547 -2.444 1.00 0.00 C ATOM 672 O THR A 41 12.103 3.734 -3.354 1.00 0.00 O ATOM 673 CB THR A 41 13.696 5.879 -3.536 1.00 0.00 C ATOM 674 OG1 THR A 41 13.226 5.691 -4.864 1.00 0.00 O ATOM 675 CG2 THR A 41 14.700 4.838 -3.123 1.00 0.00 C ATOM 0 H THR A 41 13.223 5.892 -0.652 1.00 0.00 H new ATOM 0 HA THR A 41 11.662 6.506 -3.037 1.00 0.00 H new ATOM 0 HB THR A 41 14.240 6.821 -3.468 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.628 4.915 -4.893 1.00 0.00 H new ATOM 0 HG21 THR A 41 15.545 4.854 -3.811 1.00 0.00 H new ATOM 0 HG22 THR A 41 15.051 5.051 -2.113 1.00 0.00 H new ATOM 0 HG23 THR A 41 14.233 3.853 -3.145 1.00 0.00 H new ATOM 683 N GLN A 42 11.182 4.338 -1.354 1.00 0.00 N ATOM 684 CA GLN A 42 10.527 3.092 -0.996 1.00 0.00 C ATOM 685 C GLN A 42 10.017 2.348 -2.233 1.00 0.00 C ATOM 686 O GLN A 42 9.095 2.778 -2.907 1.00 0.00 O ATOM 687 CB GLN A 42 9.281 3.273 -0.092 1.00 0.00 C ATOM 688 CG GLN A 42 8.578 1.928 0.113 1.00 0.00 C ATOM 689 CD GLN A 42 7.774 1.825 1.400 1.00 0.00 C ATOM 690 OE1 GLN A 42 7.873 0.684 2.078 1.00 0.00 O flip ATOM 691 NE2 GLN A 42 7.076 2.794 1.764 1.00 0.00 N flip ATOM 0 H GLN A 42 11.046 5.066 -0.653 1.00 0.00 H new ATOM 0 HA GLN A 42 11.302 2.540 -0.464 1.00 0.00 H new ATOM 0 HB2 GLN A 42 9.578 3.687 0.871 1.00 0.00 H new ATOM 0 HB3 GLN A 42 8.593 3.986 -0.547 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.913 1.748 -0.731 1.00 0.00 H new ATOM 0 HG3 GLN A 42 9.327 1.136 0.103 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.044 3.641 1.197 1.00 0.00 H new ATOM 0 HE22 GLN A 42 6.538 2.738 2.629 1.00 0.00 H new ATOM 700 N GLU A 43 10.606 1.220 -2.554 1.00 0.00 N ATOM 701 CA GLU A 43 10.288 0.388 -3.660 1.00 0.00 C ATOM 702 C GLU A 43 9.121 -0.484 -3.380 1.00 0.00 C ATOM 703 O GLU A 43 8.642 -1.287 -4.177 1.00 0.00 O ATOM 704 CB GLU A 43 11.538 -0.480 -3.860 1.00 0.00 C ATOM 705 CG GLU A 43 11.431 -1.196 -5.207 1.00 0.00 C ATOM 706 CD GLU A 43 11.387 -2.685 -5.106 1.00 0.00 C ATOM 707 OE1 GLU A 43 12.344 -3.381 -4.797 1.00 0.00 O ATOM 708 OE2 GLU A 43 10.220 -3.199 -5.384 1.00 0.00 O ATOM 0 H GLU A 43 11.375 0.844 -1.999 1.00 0.00 H new ATOM 0 HA GLU A 43 10.025 0.981 -4.536 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.435 0.138 -3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.626 -1.207 -3.052 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.533 -0.851 -5.719 1.00 0.00 H new ATOM 0 HG3 GLU A 43 12.281 -0.910 -5.827 1.00 0.00 H new ATOM 715 N GLY A 44 8.610 -0.355 -2.200 1.00 0.00 N ATOM 716 CA GLY A 44 7.480 -1.136 -1.789 1.00 0.00 C ATOM 717 C GLY A 44 7.832 -1.604 -0.378 1.00 0.00 C ATOM 718 O GLY A 44 7.095 -1.370 0.561 1.00 0.00 O ATOM 0 H GLY A 44 8.959 0.291 -1.492 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.565 -0.544 -1.794 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.317 -1.981 -2.458 1.00 0.00 H new ATOM 722 N ASN A 45 8.978 -2.249 -0.339 1.00 0.00 N ATOM 723 CA ASN A 45 9.471 -2.775 0.931 1.00 0.00 C ATOM 724 C ASN A 45 10.896 -2.330 1.235 1.00 0.00 C ATOM 725 O ASN A 45 11.287 -2.051 2.361 1.00 0.00 O ATOM 726 CB ASN A 45 9.215 -4.270 1.171 1.00 0.00 C ATOM 727 CG ASN A 45 7.999 -4.895 0.446 1.00 0.00 C ATOM 728 OD1 ASN A 45 6.895 -4.798 0.969 1.00 0.00 O ATOM 729 ND2 ASN A 45 8.313 -5.282 -0.779 1.00 0.00 N ATOM 0 H ASN A 45 9.578 -2.423 -1.145 1.00 0.00 H new ATOM 0 HA ASN A 45 8.839 -2.304 1.684 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.108 -4.820 0.873 1.00 0.00 H new ATOM 0 HB3 ASN A 45 9.088 -4.425 2.242 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.578 -5.552 -1.433 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.290 -5.310 -1.070 1.00 0.00 H new ATOM 736 N LYS A 46 11.759 -2.242 0.243 1.00 0.00 N ATOM 737 CA LYS A 46 13.126 -1.822 0.515 1.00 0.00 C ATOM 738 C LYS A 46 13.181 -0.319 0.364 1.00 0.00 C ATOM 739 O LYS A 46 12.580 0.259 -0.548 1.00 0.00 O ATOM 740 CB LYS A 46 14.053 -2.477 -0.477 1.00 0.00 C ATOM 741 CG LYS A 46 15.491 -2.152 -0.135 1.00 0.00 C ATOM 742 CD LYS A 46 16.405 -2.462 -1.308 1.00 0.00 C ATOM 743 CE LYS A 46 16.872 -3.902 -1.261 1.00 0.00 C ATOM 744 NZ LYS A 46 17.970 -4.091 -2.210 1.00 0.00 N ATOM 0 H LYS A 46 11.551 -2.448 -0.734 1.00 0.00 H new ATOM 0 HA LYS A 46 13.432 -2.111 1.520 1.00 0.00 H new ATOM 0 HB2 LYS A 46 13.904 -3.557 -0.469 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.823 -2.131 -1.485 1.00 0.00 H new ATOM 0 HG2 LYS A 46 15.578 -1.099 0.131 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.802 -2.728 0.737 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.878 -2.276 -2.244 1.00 0.00 H new ATOM 0 HD3 LYS A 46 17.267 -1.795 -1.289 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.201 -4.156 -0.253 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.047 -4.571 -1.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.960 -5.069 -2.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.856 -3.434 -3.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 18.876 -3.904 -1.735 1.00 0.00 H new ATOM 758 N PHE A 47 13.907 0.343 1.266 1.00 0.00 N ATOM 759 CA PHE A 47 14.070 1.770 1.289 1.00 0.00 C ATOM 760 C PHE A 47 15.518 2.150 1.115 1.00 0.00 C ATOM 761 O PHE A 47 16.303 1.905 2.031 1.00 0.00 O ATOM 762 CB PHE A 47 13.761 2.362 2.679 1.00 0.00 C ATOM 763 CG PHE A 47 12.325 2.655 2.991 1.00 0.00 C ATOM 764 CD1 PHE A 47 11.484 1.593 3.259 1.00 0.00 C ATOM 765 CD2 PHE A 47 11.821 3.962 3.015 1.00 0.00 C ATOM 766 CE1 PHE A 47 10.133 1.824 3.552 1.00 0.00 C ATOM 767 CE2 PHE A 47 10.486 4.211 3.304 1.00 0.00 C ATOM 768 CZ PHE A 47 9.652 3.120 3.574 1.00 0.00 C ATOM 0 H PHE A 47 14.408 -0.129 2.019 1.00 0.00 H new ATOM 0 HA PHE A 47 13.409 2.135 0.503 1.00 0.00 H new ATOM 0 HB2 PHE A 47 14.137 1.670 3.433 1.00 0.00 H new ATOM 0 HB3 PHE A 47 14.326 3.288 2.786 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.868 0.584 3.243 1.00 0.00 H new ATOM 0 HD2 PHE A 47 12.482 4.790 2.805 1.00 0.00 H new ATOM 0 HE1 PHE A 47 9.472 0.995 3.759 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.101 5.220 3.320 1.00 0.00 H new ATOM 0 HZ PHE A 47 8.611 3.294 3.804 1.00 0.00 H new ATOM 778 N THR A 48 15.843 2.726 -0.032 1.00 0.00 N ATOM 779 CA THR A 48 17.200 3.128 -0.296 1.00 0.00 C ATOM 780 C THR A 48 17.291 4.608 0.001 1.00 0.00 C ATOM 781 O THR A 48 17.289 5.471 -0.873 1.00 0.00 O ATOM 782 CB THR A 48 17.944 2.702 -1.554 1.00 0.00 C ATOM 783 OG1 THR A 48 18.915 3.636 -2.007 1.00 0.00 O ATOM 784 CG2 THR A 48 17.001 2.365 -2.680 1.00 0.00 C ATOM 0 H THR A 48 15.184 2.921 -0.786 1.00 0.00 H new ATOM 0 HA THR A 48 17.789 2.500 0.372 1.00 0.00 H new ATOM 0 HB THR A 48 18.486 1.806 -1.253 1.00 0.00 H new ATOM 0 HG1 THR A 48 18.576 4.547 -1.881 1.00 0.00 H new ATOM 0 HG21 THR A 48 17.574 2.066 -3.558 1.00 0.00 H new ATOM 0 HG22 THR A 48 16.349 1.546 -2.376 1.00 0.00 H new ATOM 0 HG23 THR A 48 16.396 3.239 -2.922 1.00 0.00 H new ATOM 792 N VAL A 49 17.368 4.790 1.295 1.00 0.00 N ATOM 793 CA VAL A 49 17.468 6.127 1.793 1.00 0.00 C ATOM 794 C VAL A 49 18.569 6.909 1.154 1.00 0.00 C ATOM 795 O VAL A 49 19.702 6.746 1.602 1.00 0.00 O ATOM 796 CB VAL A 49 17.143 6.440 3.245 1.00 0.00 C ATOM 797 CG1 VAL A 49 17.968 5.791 4.348 1.00 0.00 C ATOM 798 CG2 VAL A 49 17.087 7.944 3.470 1.00 0.00 C ATOM 0 H VAL A 49 17.363 4.052 1.999 1.00 0.00 H new ATOM 0 HA VAL A 49 16.534 6.551 1.424 1.00 0.00 H new ATOM 0 HB VAL A 49 16.172 5.959 3.357 1.00 0.00 H new ATOM 0 HG11 VAL A 49 17.602 6.123 5.319 1.00 0.00 H new ATOM 0 HG12 VAL A 49 17.880 4.707 4.278 1.00 0.00 H new ATOM 0 HG13 VAL A 49 19.014 6.078 4.237 1.00 0.00 H new ATOM 0 HG21 VAL A 49 16.853 8.147 4.515 1.00 0.00 H new ATOM 0 HG22 VAL A 49 18.052 8.385 3.222 1.00 0.00 H new ATOM 0 HG23 VAL A 49 16.315 8.378 2.834 1.00 0.00 H new ATOM 808 N LYS A 50 18.295 7.715 0.166 1.00 0.00 N ATOM 809 CA LYS A 50 19.377 8.463 -0.451 1.00 0.00 C ATOM 810 C LYS A 50 19.842 9.304 0.749 1.00 0.00 C ATOM 811 O LYS A 50 18.975 9.746 1.461 1.00 0.00 O ATOM 812 CB LYS A 50 18.933 9.324 -1.603 1.00 0.00 C ATOM 813 CG LYS A 50 19.757 9.012 -2.841 1.00 0.00 C ATOM 814 CD LYS A 50 20.731 10.149 -3.149 1.00 0.00 C ATOM 815 CE LYS A 50 22.109 9.908 -2.584 1.00 0.00 C ATOM 816 NZ LYS A 50 23.117 10.172 -3.606 1.00 0.00 N ATOM 0 H LYS A 50 17.367 7.875 -0.226 1.00 0.00 H new ATOM 0 HA LYS A 50 20.142 7.836 -0.908 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.876 9.153 -1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.040 10.377 -1.342 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.310 8.085 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.095 8.854 -3.693 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.803 10.277 -4.229 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.335 11.080 -2.744 1.00 0.00 H new ATOM 0 HE2 LYS A 50 22.276 10.553 -1.721 1.00 0.00 H new ATOM 0 HE3 LYS A 50 22.194 8.879 -2.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 24.064 10.004 -3.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 22.963 9.539 -4.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 23.043 11.161 -3.919 1.00 0.00 H new ATOM 830 N GLU A 51 21.136 9.488 0.949 1.00 0.00 N ATOM 831 CA GLU A 51 21.672 10.250 2.059 1.00 0.00 C ATOM 832 C GLU A 51 22.820 11.086 1.514 1.00 0.00 C ATOM 833 O GLU A 51 23.955 10.644 1.483 1.00 0.00 O ATOM 834 CB GLU A 51 22.287 9.203 3.036 1.00 0.00 C ATOM 835 CG GLU A 51 22.610 9.808 4.410 1.00 0.00 C ATOM 836 CD GLU A 51 23.846 9.241 5.076 1.00 0.00 C ATOM 837 OE1 GLU A 51 23.594 8.199 5.817 1.00 0.00 O ATOM 838 OE2 GLU A 51 24.958 9.717 4.934 1.00 0.00 O ATOM 0 H GLU A 51 21.853 9.105 0.333 1.00 0.00 H new ATOM 0 HA GLU A 51 20.920 10.876 2.539 1.00 0.00 H new ATOM 0 HB2 GLU A 51 21.591 8.373 3.161 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.197 8.792 2.599 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.736 10.885 4.297 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.756 9.655 5.069 1.00 0.00 H new ATOM 845 N SER A 52 22.467 12.255 1.110 1.00 0.00 N ATOM 846 CA SER A 52 23.395 13.209 0.556 1.00 0.00 C ATOM 847 C SER A 52 23.842 14.071 1.724 1.00 0.00 C ATOM 848 O SER A 52 23.729 15.291 1.701 1.00 0.00 O ATOM 849 CB SER A 52 22.596 14.007 -0.447 1.00 0.00 C ATOM 850 OG SER A 52 21.606 13.210 -1.075 1.00 0.00 O ATOM 0 H SER A 52 21.506 12.594 1.151 1.00 0.00 H new ATOM 0 HA SER A 52 24.269 12.777 0.069 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.121 14.851 0.053 1.00 0.00 H new ATOM 0 HB3 SER A 52 23.266 14.419 -1.202 1.00 0.00 H new ATOM 0 HG SER A 52 21.556 13.440 -2.026 1.00 0.00 H new ATOM 856 N SER A 53 24.357 13.388 2.767 1.00 0.00 N ATOM 857 CA SER A 53 24.800 14.135 3.928 1.00 0.00 C ATOM 858 C SER A 53 26.049 14.933 3.565 1.00 0.00 C ATOM 859 O SER A 53 26.659 14.520 2.585 1.00 0.00 O ATOM 860 CB SER A 53 25.133 13.211 5.085 1.00 0.00 C ATOM 861 OG SER A 53 26.199 12.310 4.821 1.00 0.00 O ATOM 0 H SER A 53 24.467 12.375 2.818 1.00 0.00 H new ATOM 0 HA SER A 53 23.991 14.799 4.233 1.00 0.00 H new ATOM 0 HB2 SER A 53 25.389 13.815 5.956 1.00 0.00 H new ATOM 0 HB3 SER A 53 24.243 12.638 5.345 1.00 0.00 H new ATOM 0 HG SER A 53 25.859 11.391 4.826 1.00 0.00 H new ATOM 867 N ASN A 54 26.384 15.992 4.305 1.00 0.00 N ATOM 868 CA ASN A 54 27.588 16.749 3.951 1.00 0.00 C ATOM 869 C ASN A 54 28.736 15.743 3.859 1.00 0.00 C ATOM 870 O ASN A 54 29.664 15.940 3.105 1.00 0.00 O ATOM 871 CB ASN A 54 27.922 17.808 4.984 1.00 0.00 C ATOM 872 CG ASN A 54 28.210 19.144 4.342 1.00 0.00 C ATOM 873 OD1 ASN A 54 28.058 19.373 3.136 1.00 0.00 O ATOM 874 ND2 ASN A 54 28.646 20.079 5.193 1.00 0.00 N ATOM 0 H ASN A 54 25.868 16.334 5.116 1.00 0.00 H new ATOM 0 HA ASN A 54 27.425 17.270 3.008 1.00 0.00 H new ATOM 0 HB2 ASN A 54 27.091 17.911 5.681 1.00 0.00 H new ATOM 0 HB3 ASN A 54 28.788 17.489 5.565 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.865 21.016 4.853 1.00 0.00 H new ATOM 0 HD22 ASN A 54 28.760 19.856 6.182 1.00 0.00 H new ATOM 881 N PHE A 55 28.621 14.656 4.652 1.00 0.00 N ATOM 882 CA PHE A 55 29.660 13.630 4.625 1.00 0.00 C ATOM 883 C PHE A 55 29.589 12.809 3.348 1.00 0.00 C ATOM 884 O PHE A 55 30.624 12.780 2.702 1.00 0.00 O ATOM 885 CB PHE A 55 29.694 12.699 5.837 1.00 0.00 C ATOM 886 CG PHE A 55 30.466 13.287 6.997 1.00 0.00 C ATOM 887 CD1 PHE A 55 30.000 14.444 7.605 1.00 0.00 C ATOM 888 CD2 PHE A 55 31.631 12.715 7.494 1.00 0.00 C ATOM 889 CE1 PHE A 55 30.613 15.084 8.680 1.00 0.00 C ATOM 890 CE2 PHE A 55 32.274 13.331 8.579 1.00 0.00 C ATOM 891 CZ PHE A 55 31.780 14.495 9.169 1.00 0.00 C ATOM 0 H PHE A 55 27.847 14.478 5.292 1.00 0.00 H new ATOM 0 HA PHE A 55 30.591 14.195 4.662 1.00 0.00 H new ATOM 0 HB2 PHE A 55 28.674 12.484 6.155 1.00 0.00 H new ATOM 0 HB3 PHE A 55 30.144 11.749 5.549 1.00 0.00 H new ATOM 0 HD1 PHE A 55 29.093 14.882 7.215 1.00 0.00 H new ATOM 0 HD2 PHE A 55 32.034 11.814 7.054 1.00 0.00 H new ATOM 0 HE1 PHE A 55 30.207 15.987 9.112 1.00 0.00 H new ATOM 0 HE2 PHE A 55 33.179 12.890 8.969 1.00 0.00 H new ATOM 0 HZ PHE A 55 32.301 14.940 10.004 1.00 0.00 H new ATOM 901 N ARG A 56 28.525 12.167 2.940 1.00 0.00 N ATOM 902 CA ARG A 56 28.489 11.388 1.715 1.00 0.00 C ATOM 903 C ARG A 56 27.145 11.519 1.017 1.00 0.00 C ATOM 904 O ARG A 56 26.188 12.131 1.506 1.00 0.00 O ATOM 905 CB ARG A 56 28.499 9.915 2.128 1.00 0.00 C ATOM 906 CG ARG A 56 29.842 9.345 1.633 1.00 0.00 C ATOM 907 CD ARG A 56 31.179 9.420 2.357 1.00 0.00 C ATOM 908 NE ARG A 56 32.032 8.296 2.045 1.00 0.00 N ATOM 909 CZ ARG A 56 32.684 7.980 0.936 1.00 0.00 C ATOM 910 NH1 ARG A 56 32.577 8.793 -0.107 1.00 0.00 N ATOM 911 NH2 ARG A 56 33.443 6.889 0.799 1.00 0.00 N ATOM 0 H ARG A 56 27.643 12.166 3.452 1.00 0.00 H new ATOM 0 HA ARG A 56 29.313 11.717 1.082 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.406 9.812 3.209 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.660 9.379 1.684 1.00 0.00 H new ATOM 0 HG2 ARG A 56 29.663 8.284 1.460 1.00 0.00 H new ATOM 0 HG3 ARG A 56 30.012 9.802 0.658 1.00 0.00 H new ATOM 0 HD2 ARG A 56 31.686 10.346 2.085 1.00 0.00 H new ATOM 0 HD3 ARG A 56 31.006 9.456 3.433 1.00 0.00 H new ATOM 0 HE ARG A 56 32.153 7.632 2.810 1.00 0.00 H new ATOM 0 HH11 ARG A 56 32.004 9.635 -0.041 1.00 0.00 H new ATOM 0 HH12 ARG A 56 33.067 8.576 -0.975 1.00 0.00 H new ATOM 0 HH21 ARG A 56 33.547 6.239 1.578 1.00 0.00 H new ATOM 0 HH22 ARG A 56 33.918 6.706 -0.085 1.00 0.00 H new ATOM 925 N ASN A 57 27.151 10.898 -0.156 1.00 0.00 N ATOM 926 CA ASN A 57 26.109 10.735 -1.172 1.00 0.00 C ATOM 927 C ASN A 57 26.043 9.213 -1.237 1.00 0.00 C ATOM 928 O ASN A 57 26.482 8.610 -2.204 1.00 0.00 O ATOM 929 CB ASN A 57 26.539 11.358 -2.493 1.00 0.00 C ATOM 930 CG ASN A 57 27.697 12.328 -2.319 1.00 0.00 C ATOM 931 OD1 ASN A 57 28.834 11.930 -2.565 1.00 0.00 O ATOM 932 ND2 ASN A 57 27.431 13.553 -1.914 1.00 0.00 N ATOM 0 H ASN A 57 28.005 10.431 -0.461 1.00 0.00 H new ATOM 0 HA ASN A 57 25.155 11.215 -0.955 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.829 10.570 -3.188 1.00 0.00 H new ATOM 0 HB3 ASN A 57 25.693 11.881 -2.939 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.188 14.225 -1.790 1.00 0.00 H new ATOM 0 HD22 ASN A 57 26.468 13.830 -1.724 1.00 0.00 H new ATOM 939 N ILE A 58 25.473 8.694 -0.135 1.00 0.00 N ATOM 940 CA ILE A 58 25.253 7.299 0.170 1.00 0.00 C ATOM 941 C ILE A 58 23.825 6.729 0.071 1.00 0.00 C ATOM 942 O ILE A 58 23.016 6.974 0.982 1.00 0.00 O ATOM 943 CB ILE A 58 25.907 7.028 1.543 1.00 0.00 C ATOM 944 CG1 ILE A 58 25.409 5.719 2.094 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.905 8.034 2.663 1.00 0.00 C ATOM 946 CD1 ILE A 58 26.463 5.171 3.050 1.00 0.00 C ATOM 0 H ILE A 58 25.134 9.299 0.613 1.00 0.00 H new ATOM 0 HA ILE A 58 25.719 6.742 -0.643 1.00 0.00 H new ATOM 0 HB ILE A 58 26.953 7.064 1.237 1.00 0.00 H new ATOM 0 HG12 ILE A 58 24.462 5.862 2.614 1.00 0.00 H new ATOM 0 HG13 ILE A 58 25.225 5.012 1.285 1.00 0.00 H new ATOM 0 HG21 ILE A 58 26.424 7.618 3.527 1.00 0.00 H new ATOM 0 HG22 ILE A 58 26.413 8.942 2.338 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.877 8.272 2.937 1.00 0.00 H new ATOM 0 HD11 ILE A 58 26.122 4.221 3.462 1.00 0.00 H new ATOM 0 HD12 ILE A 58 27.398 5.018 2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 58 26.623 5.881 3.861 1.00 0.00 H new ATOM 958 N ASP A 59 23.454 5.974 -0.976 1.00 0.00 N ATOM 959 CA ASP A 59 22.078 5.457 -0.942 1.00 0.00 C ATOM 960 C ASP A 59 22.084 4.493 0.249 1.00 0.00 C ATOM 961 O ASP A 59 22.935 3.606 0.261 1.00 0.00 O ATOM 962 CB ASP A 59 21.556 4.849 -2.239 1.00 0.00 C ATOM 963 CG ASP A 59 22.495 5.125 -3.395 1.00 0.00 C ATOM 964 OD1 ASP A 59 23.047 6.203 -3.545 1.00 0.00 O ATOM 965 OD2 ASP A 59 22.660 4.132 -4.208 1.00 0.00 O ATOM 0 H ASP A 59 24.024 5.725 -1.784 1.00 0.00 H new ATOM 0 HA ASP A 59 21.360 6.269 -0.826 1.00 0.00 H new ATOM 0 HB2 ASP A 59 21.435 3.773 -2.115 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.570 5.257 -2.463 1.00 0.00 H new ATOM 970 N VAL A 60 21.205 4.656 1.205 1.00 0.00 N ATOM 971 CA VAL A 60 21.232 3.769 2.356 1.00 0.00 C ATOM 972 C VAL A 60 20.147 2.722 2.179 1.00 0.00 C ATOM 973 O VAL A 60 18.978 3.017 2.501 1.00 0.00 O ATOM 974 CB VAL A 60 20.875 4.576 3.634 1.00 0.00 C ATOM 975 CG1 VAL A 60 20.491 3.686 4.823 1.00 0.00 C ATOM 976 CG2 VAL A 60 21.938 5.611 3.992 1.00 0.00 C ATOM 0 H VAL A 60 20.478 5.371 1.219 1.00 0.00 H new ATOM 0 HA VAL A 60 22.220 3.317 2.444 1.00 0.00 H new ATOM 0 HB VAL A 60 19.975 5.138 3.385 1.00 0.00 H new ATOM 0 HG11 VAL A 60 20.253 4.311 5.684 1.00 0.00 H new ATOM 0 HG12 VAL A 60 19.621 3.084 4.561 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.325 3.030 5.071 1.00 0.00 H new ATOM 0 HG21 VAL A 60 21.637 6.145 4.893 1.00 0.00 H new ATOM 0 HG22 VAL A 60 22.889 5.109 4.169 1.00 0.00 H new ATOM 0 HG23 VAL A 60 22.048 6.319 3.170 1.00 0.00 H new ATOM 986 N VAL A 61 20.413 1.536 1.697 1.00 0.00 N ATOM 987 CA VAL A 61 19.337 0.576 1.556 1.00 0.00 C ATOM 988 C VAL A 61 19.055 -0.055 2.913 1.00 0.00 C ATOM 989 O VAL A 61 19.970 -0.435 3.648 1.00 0.00 O ATOM 990 CB VAL A 61 19.312 -0.396 0.343 1.00 0.00 C ATOM 991 CG1 VAL A 61 20.079 0.067 -0.883 1.00 0.00 C ATOM 992 CG2 VAL A 61 19.542 -1.873 0.674 1.00 0.00 C ATOM 0 H VAL A 61 21.334 1.213 1.402 1.00 0.00 H new ATOM 0 HA VAL A 61 18.484 1.170 1.228 1.00 0.00 H new ATOM 0 HB VAL A 61 18.264 -0.342 0.048 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.996 -0.684 -1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 61 19.663 1.010 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.128 0.207 -0.624 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.504 -2.461 -0.243 1.00 0.00 H new ATOM 0 HG22 VAL A 61 20.519 -1.993 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 61 18.767 -2.218 1.358 1.00 0.00 H new ATOM 1002 N PHE A 62 17.784 -0.183 3.286 1.00 0.00 N ATOM 1003 CA PHE A 62 17.464 -0.767 4.554 1.00 0.00 C ATOM 1004 C PHE A 62 16.006 -1.248 4.557 1.00 0.00 C ATOM 1005 O PHE A 62 15.058 -0.549 4.893 1.00 0.00 O ATOM 1006 CB PHE A 62 17.798 0.249 5.664 1.00 0.00 C ATOM 1007 CG PHE A 62 16.825 1.393 5.743 1.00 0.00 C ATOM 1008 CD1 PHE A 62 16.750 2.412 4.792 1.00 0.00 C ATOM 1009 CD2 PHE A 62 15.937 1.475 6.804 1.00 0.00 C ATOM 1010 CE1 PHE A 62 15.884 3.489 4.796 1.00 0.00 C ATOM 1011 CE2 PHE A 62 15.053 2.546 6.832 1.00 0.00 C ATOM 1012 CZ PHE A 62 15.004 3.559 5.862 1.00 0.00 C ATOM 0 H PHE A 62 16.982 0.109 2.728 1.00 0.00 H new ATOM 0 HA PHE A 62 18.065 -1.656 4.747 1.00 0.00 H new ATOM 0 HB2 PHE A 62 17.818 -0.267 6.624 1.00 0.00 H new ATOM 0 HB3 PHE A 62 18.799 0.645 5.494 1.00 0.00 H new ATOM 0 HD1 PHE A 62 17.442 2.352 3.965 1.00 0.00 H new ATOM 0 HD2 PHE A 62 15.933 0.729 7.585 1.00 0.00 H new ATOM 0 HE1 PHE A 62 15.893 4.233 4.013 1.00 0.00 H new ATOM 0 HE2 PHE A 62 14.357 2.603 7.656 1.00 0.00 H new ATOM 0 HZ PHE A 62 14.298 4.372 5.945 1.00 0.00 H new ATOM 1022 N GLU A 63 15.785 -2.511 4.166 1.00 0.00 N ATOM 1023 CA GLU A 63 14.463 -3.092 4.120 1.00 0.00 C ATOM 1024 C GLU A 63 13.945 -2.995 5.550 1.00 0.00 C ATOM 1025 O GLU A 63 14.731 -3.046 6.503 1.00 0.00 O ATOM 1026 CB GLU A 63 14.431 -4.593 3.799 1.00 0.00 C ATOM 1027 CG GLU A 63 14.565 -5.021 2.325 1.00 0.00 C ATOM 1028 CD GLU A 63 13.394 -5.899 1.903 1.00 0.00 C ATOM 1029 OE1 GLU A 63 13.218 -7.025 2.393 1.00 0.00 O ATOM 1030 OE2 GLU A 63 12.617 -5.359 1.002 1.00 0.00 O ATOM 0 H GLU A 63 16.527 -3.147 3.875 1.00 0.00 H new ATOM 0 HA GLU A 63 13.899 -2.571 3.346 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.234 -5.071 4.360 1.00 0.00 H new ATOM 0 HB3 GLU A 63 13.492 -4.996 4.180 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.609 -4.137 1.689 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.500 -5.563 2.184 1.00 0.00 H new ATOM 1037 N LEU A 64 12.626 -2.854 5.712 1.00 0.00 N ATOM 1038 CA LEU A 64 12.122 -2.753 7.043 1.00 0.00 C ATOM 1039 C LEU A 64 12.359 -4.080 7.754 1.00 0.00 C ATOM 1040 O LEU A 64 11.724 -5.096 7.411 1.00 0.00 O ATOM 1041 CB LEU A 64 10.619 -2.408 6.999 1.00 0.00 C ATOM 1042 CG LEU A 64 10.312 -1.146 6.212 1.00 0.00 C ATOM 1043 CD1 LEU A 64 9.061 -1.434 5.373 1.00 0.00 C ATOM 1044 CD2 LEU A 64 9.958 -0.044 7.186 1.00 0.00 C ATOM 0 H LEU A 64 11.934 -2.811 4.964 1.00 0.00 H new ATOM 0 HA LEU A 64 12.635 -1.961 7.589 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.075 -3.243 6.558 1.00 0.00 H new ATOM 0 HB3 LEU A 64 10.251 -2.290 8.018 1.00 0.00 H new ATOM 0 HG LEU A 64 11.162 -0.855 5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.803 -0.550 4.789 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.258 -2.269 4.700 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.231 -1.688 6.033 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.735 0.870 6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.085 -0.340 7.768 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.799 0.133 7.857 1.00 0.00 H new ATOM 1056 N GLY A 65 13.268 -4.033 8.721 1.00 0.00 N ATOM 1057 CA GLY A 65 13.722 -5.116 9.585 1.00 0.00 C ATOM 1058 C GLY A 65 14.618 -6.208 9.002 1.00 0.00 C ATOM 1059 O GLY A 65 14.383 -7.406 9.231 1.00 0.00 O ATOM 0 H GLY A 65 13.748 -3.160 8.939 1.00 0.00 H new ATOM 0 HA2 GLY A 65 14.255 -4.666 10.422 1.00 0.00 H new ATOM 0 HA3 GLY A 65 12.837 -5.602 9.995 1.00 0.00 H new ATOM 1063 N VAL A 66 15.624 -5.811 8.267 1.00 0.00 N ATOM 1064 CA VAL A 66 16.515 -6.767 7.676 1.00 0.00 C ATOM 1065 C VAL A 66 17.887 -6.624 8.364 1.00 0.00 C ATOM 1066 O VAL A 66 18.804 -7.276 7.858 1.00 0.00 O ATOM 1067 CB VAL A 66 16.398 -6.920 6.164 1.00 0.00 C ATOM 1068 CG1 VAL A 66 17.577 -7.468 5.343 1.00 0.00 C ATOM 1069 CG2 VAL A 66 15.098 -7.623 5.778 1.00 0.00 C ATOM 0 H VAL A 66 15.844 -4.836 8.066 1.00 0.00 H new ATOM 0 HA VAL A 66 16.216 -7.794 7.884 1.00 0.00 H new ATOM 0 HB VAL A 66 16.409 -5.872 5.864 1.00 0.00 H new ATOM 0 HG11 VAL A 66 17.302 -7.502 4.289 1.00 0.00 H new ATOM 0 HG12 VAL A 66 18.443 -6.818 5.471 1.00 0.00 H new ATOM 0 HG13 VAL A 66 17.824 -8.473 5.686 1.00 0.00 H new ATOM 0 HG21 VAL A 66 15.044 -7.717 4.693 1.00 0.00 H new ATOM 0 HG22 VAL A 66 15.072 -8.614 6.230 1.00 0.00 H new ATOM 0 HG23 VAL A 66 14.249 -7.040 6.135 1.00 0.00 H new ATOM 1079 N ASP A 67 17.988 -5.843 9.408 1.00 0.00 N ATOM 1080 CA ASP A 67 19.234 -5.614 10.161 1.00 0.00 C ATOM 1081 C ASP A 67 20.434 -5.331 9.339 1.00 0.00 C ATOM 1082 O ASP A 67 21.081 -6.167 8.750 1.00 0.00 O ATOM 1083 CB ASP A 67 19.662 -6.796 11.052 1.00 0.00 C ATOM 1084 CG ASP A 67 18.687 -7.927 11.060 1.00 0.00 C ATOM 1085 OD1 ASP A 67 17.683 -7.754 11.883 1.00 0.00 O ATOM 1086 OD2 ASP A 67 18.843 -8.891 10.358 1.00 0.00 O ATOM 0 H ASP A 67 17.193 -5.325 9.784 1.00 0.00 H new ATOM 0 HA ASP A 67 18.945 -4.739 10.744 1.00 0.00 H new ATOM 0 HB2 ASP A 67 20.629 -7.165 10.711 1.00 0.00 H new ATOM 0 HB3 ASP A 67 19.799 -6.439 12.073 1.00 0.00 H new ATOM 1091 N PHE A 68 20.808 -4.050 9.259 1.00 0.00 N ATOM 1092 CA PHE A 68 21.946 -3.611 8.503 1.00 0.00 C ATOM 1093 C PHE A 68 22.934 -2.985 9.493 1.00 0.00 C ATOM 1094 O PHE A 68 22.549 -2.556 10.582 1.00 0.00 O ATOM 1095 CB PHE A 68 21.630 -2.568 7.413 1.00 0.00 C ATOM 1096 CG PHE A 68 20.896 -1.343 7.937 1.00 0.00 C ATOM 1097 CD1 PHE A 68 19.563 -1.452 8.306 1.00 0.00 C ATOM 1098 CD2 PHE A 68 21.537 -0.108 8.058 1.00 0.00 C ATOM 1099 CE1 PHE A 68 18.903 -0.327 8.786 1.00 0.00 C ATOM 1100 CE2 PHE A 68 20.915 1.047 8.538 1.00 0.00 C ATOM 1101 CZ PHE A 68 19.566 0.884 8.899 1.00 0.00 C ATOM 0 H PHE A 68 20.312 -3.293 9.729 1.00 0.00 H new ATOM 0 HA PHE A 68 22.341 -4.483 7.982 1.00 0.00 H new ATOM 0 HB2 PHE A 68 22.562 -2.250 6.945 1.00 0.00 H new ATOM 0 HB3 PHE A 68 21.027 -3.038 6.636 1.00 0.00 H new ATOM 0 HD1 PHE A 68 19.046 -2.397 8.222 1.00 0.00 H new ATOM 0 HD2 PHE A 68 22.574 -0.042 7.763 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.864 -0.398 9.073 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.430 1.992 8.625 1.00 0.00 H new ATOM 0 HZ PHE A 68 19.025 1.737 9.280 1.00 0.00 H new ATOM 1111 N ALA A 69 24.206 -2.932 9.113 1.00 0.00 N ATOM 1112 CA ALA A 69 25.266 -2.358 9.949 1.00 0.00 C ATOM 1113 C ALA A 69 25.643 -1.037 9.309 1.00 0.00 C ATOM 1114 O ALA A 69 25.648 -0.961 8.081 1.00 0.00 O ATOM 1115 CB ALA A 69 26.500 -3.244 10.049 1.00 0.00 C ATOM 0 H ALA A 69 24.537 -3.286 8.215 1.00 0.00 H new ATOM 0 HA ALA A 69 24.896 -2.246 10.968 1.00 0.00 H new ATOM 0 HB1 ALA A 69 27.245 -2.761 10.681 1.00 0.00 H new ATOM 0 HB2 ALA A 69 26.224 -4.205 10.483 1.00 0.00 H new ATOM 0 HB3 ALA A 69 26.916 -3.402 9.054 1.00 0.00 H new ATOM 1121 N TYR A 70 25.947 -0.014 10.116 1.00 0.00 N ATOM 1122 CA TYR A 70 26.307 1.244 9.514 1.00 0.00 C ATOM 1123 C TYR A 70 27.321 2.054 10.314 1.00 0.00 C ATOM 1124 O TYR A 70 26.953 2.573 11.337 1.00 0.00 O ATOM 1125 CB TYR A 70 24.991 2.064 9.319 1.00 0.00 C ATOM 1126 CG TYR A 70 25.170 3.457 8.757 1.00 0.00 C ATOM 1127 CD1 TYR A 70 26.303 3.764 8.026 1.00 0.00 C ATOM 1128 CD2 TYR A 70 24.153 4.408 9.000 1.00 0.00 C ATOM 1129 CE1 TYR A 70 26.468 5.038 7.510 1.00 0.00 C ATOM 1130 CE2 TYR A 70 24.304 5.691 8.491 1.00 0.00 C ATOM 1131 CZ TYR A 70 25.466 5.968 7.755 1.00 0.00 C ATOM 1132 OH TYR A 70 25.652 7.212 7.236 1.00 0.00 O ATOM 0 H TYR A 70 25.948 -0.040 11.136 1.00 0.00 H new ATOM 0 HA TYR A 70 26.802 1.032 8.566 1.00 0.00 H new ATOM 0 HB2 TYR A 70 24.330 1.506 8.656 1.00 0.00 H new ATOM 0 HB3 TYR A 70 24.486 2.141 10.282 1.00 0.00 H new ATOM 0 HD1 TYR A 70 27.058 3.011 7.858 1.00 0.00 H new ATOM 0 HD2 TYR A 70 23.275 4.142 9.571 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.345 5.300 6.937 1.00 0.00 H new ATOM 0 HE2 TYR A 70 23.553 6.449 8.656 1.00 0.00 H new ATOM 0 HH TYR A 70 24.901 7.437 6.647 1.00 0.00 H new ATOM 1142 N SER A 71 28.580 2.209 9.934 1.00 0.00 N ATOM 1143 CA SER A 71 29.467 3.012 10.778 1.00 0.00 C ATOM 1144 C SER A 71 29.066 4.453 10.524 1.00 0.00 C ATOM 1145 O SER A 71 28.812 4.828 9.378 1.00 0.00 O ATOM 1146 CB SER A 71 30.899 2.817 10.345 1.00 0.00 C ATOM 1147 OG SER A 71 31.228 3.989 9.613 1.00 0.00 O ATOM 0 H SER A 71 29.000 1.815 9.092 1.00 0.00 H new ATOM 0 HA SER A 71 29.386 2.735 11.829 1.00 0.00 H new ATOM 0 HB2 SER A 71 31.557 2.692 11.205 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.006 1.924 9.729 1.00 0.00 H new ATOM 0 HG SER A 71 32.155 3.930 9.300 1.00 0.00 H new ATOM 1153 N LEU A 72 29.003 5.250 11.549 1.00 0.00 N ATOM 1154 CA LEU A 72 28.631 6.648 11.397 1.00 0.00 C ATOM 1155 C LEU A 72 29.904 7.331 10.985 1.00 0.00 C ATOM 1156 O LEU A 72 30.900 6.664 10.672 1.00 0.00 O ATOM 1157 CB LEU A 72 28.214 7.213 12.766 1.00 0.00 C ATOM 1158 CG LEU A 72 26.837 6.828 13.320 1.00 0.00 C ATOM 1159 CD1 LEU A 72 26.939 5.959 14.539 1.00 0.00 C ATOM 1160 CD2 LEU A 72 26.084 8.094 13.729 1.00 0.00 C ATOM 0 H LEU A 72 29.203 4.966 12.508 1.00 0.00 H new ATOM 0 HA LEU A 72 27.813 6.785 10.689 1.00 0.00 H new ATOM 0 HB2 LEU A 72 28.964 6.906 13.495 1.00 0.00 H new ATOM 0 HB3 LEU A 72 28.256 8.300 12.704 1.00 0.00 H new ATOM 0 HG LEU A 72 26.319 6.280 12.533 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.939 5.713 14.895 1.00 0.00 H new ATOM 0 HD12 LEU A 72 27.471 5.041 14.288 1.00 0.00 H new ATOM 0 HD13 LEU A 72 27.481 6.491 15.321 1.00 0.00 H new ATOM 0 HD21 LEU A 72 25.105 7.823 14.123 1.00 0.00 H new ATOM 0 HD22 LEU A 72 26.650 8.623 14.496 1.00 0.00 H new ATOM 0 HD23 LEU A 72 25.959 8.740 12.860 1.00 0.00 H new ATOM 1172 N ALA A 73 29.905 8.676 10.970 1.00 0.00 N ATOM 1173 CA ALA A 73 31.077 9.461 10.588 1.00 0.00 C ATOM 1174 C ALA A 73 32.061 9.612 11.772 1.00 0.00 C ATOM 1175 O ALA A 73 33.263 9.458 11.674 1.00 0.00 O ATOM 1176 CB ALA A 73 30.691 10.766 9.949 1.00 0.00 C ATOM 0 H ALA A 73 29.094 9.241 11.222 1.00 0.00 H new ATOM 0 HA ALA A 73 31.618 8.912 9.817 1.00 0.00 H new ATOM 0 HB1 ALA A 73 31.591 11.319 9.680 1.00 0.00 H new ATOM 0 HB2 ALA A 73 30.102 10.572 9.052 1.00 0.00 H new ATOM 0 HB3 ALA A 73 30.100 11.354 10.651 1.00 0.00 H new ATOM 1182 N ASP A 74 31.456 9.934 12.911 1.00 0.00 N ATOM 1183 CA ASP A 74 32.206 10.114 14.134 1.00 0.00 C ATOM 1184 C ASP A 74 31.456 9.516 15.326 1.00 0.00 C ATOM 1185 O ASP A 74 31.673 9.995 16.444 1.00 0.00 O ATOM 1186 CB ASP A 74 32.513 11.567 14.465 1.00 0.00 C ATOM 1187 CG ASP A 74 33.710 11.584 15.389 1.00 0.00 C ATOM 1188 OD1 ASP A 74 34.825 11.136 15.141 1.00 0.00 O ATOM 1189 OD2 ASP A 74 33.442 12.144 16.523 1.00 0.00 O ATOM 0 H ASP A 74 30.450 10.074 13.005 1.00 0.00 H new ATOM 0 HA ASP A 74 33.151 9.599 13.958 1.00 0.00 H new ATOM 0 HB2 ASP A 74 32.723 12.130 13.556 1.00 0.00 H new ATOM 0 HB3 ASP A 74 31.655 12.040 14.942 1.00 0.00 H new ATOM 1194 N GLY A 75 30.633 8.525 15.029 1.00 0.00 N ATOM 1195 CA GLY A 75 29.860 7.874 16.067 1.00 0.00 C ATOM 1196 C GLY A 75 30.163 6.359 16.170 1.00 0.00 C ATOM 1197 O GLY A 75 29.718 5.725 17.101 1.00 0.00 O ATOM 0 H GLY A 75 30.485 8.158 14.089 1.00 0.00 H new ATOM 0 HA2 GLY A 75 30.071 8.349 17.025 1.00 0.00 H new ATOM 0 HA3 GLY A 75 28.798 8.016 15.868 1.00 0.00 H new ATOM 1201 N THR A 76 30.897 5.824 15.234 1.00 0.00 N ATOM 1202 CA THR A 76 31.174 4.401 15.333 1.00 0.00 C ATOM 1203 C THR A 76 30.022 3.511 14.969 1.00 0.00 C ATOM 1204 O THR A 76 28.950 3.941 14.591 1.00 0.00 O ATOM 1205 CB THR A 76 31.843 3.975 16.625 1.00 0.00 C ATOM 1206 OG1 THR A 76 30.931 3.429 17.551 1.00 0.00 O ATOM 1207 CG2 THR A 76 32.793 5.014 17.174 1.00 0.00 C ATOM 0 H THR A 76 31.299 6.310 14.433 1.00 0.00 H new ATOM 0 HA THR A 76 31.919 4.249 14.552 1.00 0.00 H new ATOM 0 HB THR A 76 32.502 3.141 16.384 1.00 0.00 H new ATOM 0 HG1 THR A 76 30.077 3.906 17.489 1.00 0.00 H new ATOM 0 HG21 THR A 76 33.238 4.647 18.099 1.00 0.00 H new ATOM 0 HG22 THR A 76 33.580 5.209 16.445 1.00 0.00 H new ATOM 0 HG23 THR A 76 32.247 5.936 17.375 1.00 0.00 H new ATOM 1215 N GLU A 77 30.320 2.214 15.111 1.00 0.00 N ATOM 1216 CA GLU A 77 29.412 1.127 14.840 1.00 0.00 C ATOM 1217 C GLU A 77 27.999 1.421 15.323 1.00 0.00 C ATOM 1218 O GLU A 77 27.704 1.995 16.358 1.00 0.00 O ATOM 1219 CB GLU A 77 29.945 -0.179 15.414 1.00 0.00 C ATOM 1220 CG GLU A 77 30.963 -0.790 14.432 1.00 0.00 C ATOM 1221 CD GLU A 77 31.898 -1.766 15.064 1.00 0.00 C ATOM 1222 OE1 GLU A 77 32.614 -1.497 16.030 1.00 0.00 O ATOM 1223 OE2 GLU A 77 31.867 -2.937 14.466 1.00 0.00 O ATOM 0 H GLU A 77 31.235 1.897 15.430 1.00 0.00 H new ATOM 0 HA GLU A 77 29.349 1.017 13.757 1.00 0.00 H new ATOM 0 HB2 GLU A 77 30.417 0.001 16.380 1.00 0.00 H new ATOM 0 HB3 GLU A 77 29.124 -0.876 15.585 1.00 0.00 H new ATOM 0 HG2 GLU A 77 30.423 -1.288 13.626 1.00 0.00 H new ATOM 0 HG3 GLU A 77 31.543 0.013 13.978 1.00 0.00 H new ATOM 1230 N LEU A 78 27.068 0.983 14.492 1.00 0.00 N ATOM 1231 CA LEU A 78 25.630 1.136 14.723 1.00 0.00 C ATOM 1232 C LEU A 78 24.991 0.200 13.725 1.00 0.00 C ATOM 1233 O LEU A 78 25.167 0.315 12.520 1.00 0.00 O ATOM 1234 CB LEU A 78 25.382 2.573 14.176 1.00 0.00 C ATOM 1235 CG LEU A 78 24.034 3.273 14.350 1.00 0.00 C ATOM 1236 CD1 LEU A 78 23.776 3.965 15.666 1.00 0.00 C ATOM 1237 CD2 LEU A 78 23.909 4.214 13.163 1.00 0.00 C ATOM 0 H LEU A 78 27.288 0.501 13.620 1.00 0.00 H new ATOM 0 HA LEU A 78 25.282 0.963 15.741 1.00 0.00 H new ATOM 0 HB2 LEU A 78 26.135 3.218 14.629 1.00 0.00 H new ATOM 0 HB3 LEU A 78 25.588 2.545 13.106 1.00 0.00 H new ATOM 0 HG LEU A 78 23.258 2.508 14.378 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.785 4.418 15.651 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.831 3.238 16.476 1.00 0.00 H new ATOM 0 HD13 LEU A 78 24.526 4.740 15.823 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.962 4.751 13.223 1.00 0.00 H new ATOM 0 HD22 LEU A 78 24.733 4.928 13.176 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.942 3.639 12.238 1.00 0.00 H new ATOM 1249 N THR A 79 24.245 -0.734 14.289 1.00 0.00 N ATOM 1250 CA THR A 79 23.586 -1.686 13.444 1.00 0.00 C ATOM 1251 C THR A 79 22.262 -1.948 14.088 1.00 0.00 C ATOM 1252 O THR A 79 22.202 -2.371 15.224 1.00 0.00 O ATOM 1253 CB THR A 79 24.434 -2.973 13.367 1.00 0.00 C ATOM 1254 OG1 THR A 79 24.273 -3.879 12.275 1.00 0.00 O ATOM 1255 CG2 THR A 79 25.741 -3.015 14.139 1.00 0.00 C ATOM 0 H THR A 79 24.090 -0.845 15.291 1.00 0.00 H new ATOM 0 HA THR A 79 23.456 -1.323 12.424 1.00 0.00 H new ATOM 0 HB THR A 79 23.786 -3.534 14.041 1.00 0.00 H new ATOM 0 HG1 THR A 79 24.887 -4.635 12.384 1.00 0.00 H new ATOM 0 HG21 THR A 79 26.222 -3.981 13.987 1.00 0.00 H new ATOM 0 HG22 THR A 79 26.399 -2.222 13.784 1.00 0.00 H new ATOM 0 HG23 THR A 79 25.541 -2.872 15.201 1.00 0.00 H new ATOM 1263 N GLY A 80 21.197 -1.698 13.374 1.00 0.00 N ATOM 1264 CA GLY A 80 19.910 -1.940 13.967 1.00 0.00 C ATOM 1265 C GLY A 80 18.857 -2.161 12.868 1.00 0.00 C ATOM 1266 O GLY A 80 19.228 -2.747 11.871 1.00 0.00 O ATOM 0 H GLY A 80 21.190 -1.341 12.419 1.00 0.00 H new ATOM 0 HA2 GLY A 80 19.958 -2.814 14.617 1.00 0.00 H new ATOM 0 HA3 GLY A 80 19.623 -1.094 14.592 1.00 0.00 H new ATOM 1270 N THR A 81 17.651 -1.702 13.104 1.00 0.00 N ATOM 1271 CA THR A 81 16.623 -1.881 12.122 1.00 0.00 C ATOM 1272 C THR A 81 15.665 -0.759 12.176 1.00 0.00 C ATOM 1273 O THR A 81 15.619 -0.070 13.163 1.00 0.00 O ATOM 1274 CB THR A 81 15.778 -3.143 12.369 1.00 0.00 C ATOM 1275 OG1 THR A 81 14.888 -2.865 13.416 1.00 0.00 O ATOM 1276 CG2 THR A 81 16.633 -4.364 12.688 1.00 0.00 C ATOM 0 H THR A 81 17.366 -1.212 13.952 1.00 0.00 H new ATOM 0 HA THR A 81 17.143 -1.951 11.167 1.00 0.00 H new ATOM 0 HB THR A 81 15.234 -3.392 11.458 1.00 0.00 H new ATOM 0 HG1 THR A 81 14.335 -3.654 13.593 1.00 0.00 H new ATOM 0 HG21 THR A 81 15.988 -5.227 12.854 1.00 0.00 H new ATOM 0 HG22 THR A 81 17.303 -4.567 11.853 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.220 -4.172 13.586 1.00 0.00 H new ATOM 1284 N TRP A 82 14.942 -0.619 11.113 1.00 0.00 N ATOM 1285 CA TRP A 82 13.964 0.441 11.020 1.00 0.00 C ATOM 1286 C TRP A 82 12.668 -0.362 10.898 1.00 0.00 C ATOM 1287 O TRP A 82 12.668 -1.466 10.396 1.00 0.00 O ATOM 1288 CB TRP A 82 14.131 1.251 9.748 1.00 0.00 C ATOM 1289 CG TRP A 82 15.120 2.360 9.838 1.00 0.00 C ATOM 1290 CD1 TRP A 82 16.441 2.213 9.814 1.00 0.00 C ATOM 1291 CD2 TRP A 82 14.895 3.772 9.959 1.00 0.00 C ATOM 1292 NE1 TRP A 82 17.149 3.364 9.904 1.00 0.00 N ATOM 1293 CE2 TRP A 82 16.191 4.349 9.999 1.00 0.00 C ATOM 1294 CE3 TRP A 82 13.769 4.594 10.042 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 16.401 5.719 10.112 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 14.023 5.953 10.154 1.00 0.00 C ATOM 1297 CH2 TRP A 82 15.289 6.518 10.187 1.00 0.00 C ATOM 0 H TRP A 82 15.002 -1.220 10.291 1.00 0.00 H new ATOM 0 HA TRP A 82 14.023 1.145 11.850 1.00 0.00 H new ATOM 0 HB2 TRP A 82 14.432 0.580 8.944 1.00 0.00 H new ATOM 0 HB3 TRP A 82 13.163 1.668 9.470 1.00 0.00 H new ATOM 0 HD1 TRP A 82 16.915 1.246 9.729 1.00 0.00 H new ATOM 0 HE1 TRP A 82 18.163 3.476 9.902 1.00 0.00 H new ATOM 0 HE3 TRP A 82 12.765 4.197 10.020 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 17.397 6.136 10.140 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 13.175 6.618 10.220 1.00 0.00 H new ATOM 0 HH2 TRP A 82 15.399 7.589 10.272 1.00 0.00 H new ATOM 1308 N THR A 83 11.607 0.240 11.372 1.00 0.00 N ATOM 1309 CA THR A 83 10.327 -0.414 11.313 1.00 0.00 C ATOM 1310 C THR A 83 9.187 0.591 11.287 1.00 0.00 C ATOM 1311 O THR A 83 9.219 1.677 11.915 1.00 0.00 O ATOM 1312 CB THR A 83 10.256 -1.389 12.509 1.00 0.00 C ATOM 1313 OG1 THR A 83 9.045 -2.102 12.503 1.00 0.00 O ATOM 1314 CG2 THR A 83 10.450 -0.589 13.797 1.00 0.00 C ATOM 0 H THR A 83 11.603 1.167 11.797 1.00 0.00 H new ATOM 0 HA THR A 83 10.218 -0.977 10.386 1.00 0.00 H new ATOM 0 HB THR A 83 11.049 -2.134 12.435 1.00 0.00 H new ATOM 0 HG1 THR A 83 9.022 -2.714 13.268 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.403 -1.261 14.654 1.00 0.00 H new ATOM 0 HG22 THR A 83 11.422 -0.096 13.776 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.664 0.161 13.881 1.00 0.00 H new ATOM 1322 N MET A 84 8.138 0.210 10.535 1.00 0.00 N ATOM 1323 CA MET A 84 7.022 1.111 10.462 1.00 0.00 C ATOM 1324 C MET A 84 6.163 0.962 11.705 1.00 0.00 C ATOM 1325 O MET A 84 5.434 -0.021 11.852 1.00 0.00 O ATOM 1326 CB MET A 84 6.158 0.713 9.269 1.00 0.00 C ATOM 1327 CG MET A 84 5.088 1.714 8.906 1.00 0.00 C ATOM 1328 SD MET A 84 3.501 0.863 8.754 1.00 0.00 S ATOM 1329 CE MET A 84 2.785 1.639 7.285 1.00 0.00 C ATOM 0 H MET A 84 8.057 -0.660 10.009 1.00 0.00 H new ATOM 0 HA MET A 84 7.390 2.133 10.371 1.00 0.00 H new ATOM 0 HB2 MET A 84 6.804 0.561 8.404 1.00 0.00 H new ATOM 0 HB3 MET A 84 5.683 -0.244 9.484 1.00 0.00 H new ATOM 0 HG2 MET A 84 5.026 2.490 9.669 1.00 0.00 H new ATOM 0 HG3 MET A 84 5.340 2.209 7.968 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.806 1.203 7.084 1.00 0.00 H new ATOM 0 HE2 MET A 84 2.677 2.710 7.455 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.439 1.472 6.430 1.00 0.00 H new ATOM 1339 N GLU A 85 6.215 1.908 12.616 1.00 0.00 N ATOM 1340 CA GLU A 85 5.440 1.856 13.814 1.00 0.00 C ATOM 1341 C GLU A 85 4.003 2.220 13.489 1.00 0.00 C ATOM 1342 O GLU A 85 3.671 2.531 12.345 1.00 0.00 O ATOM 1343 CB GLU A 85 6.112 2.289 15.126 1.00 0.00 C ATOM 1344 CG GLU A 85 7.220 1.306 15.493 1.00 0.00 C ATOM 1345 CD GLU A 85 6.597 0.100 16.096 1.00 0.00 C ATOM 1346 OE1 GLU A 85 6.387 0.239 17.393 1.00 0.00 O ATOM 1347 OE2 GLU A 85 6.330 -0.887 15.433 1.00 0.00 O ATOM 0 H GLU A 85 6.804 2.737 12.536 1.00 0.00 H new ATOM 0 HA GLU A 85 5.379 0.831 14.180 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.525 3.292 15.019 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.373 2.332 15.926 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.794 1.034 14.607 1.00 0.00 H new ATOM 0 HG3 GLU A 85 7.916 1.764 16.195 1.00 0.00 H new ATOM 1354 N GLY A 86 3.177 2.166 14.550 1.00 0.00 N ATOM 1355 CA GLY A 86 1.767 2.469 14.484 1.00 0.00 C ATOM 1356 C GLY A 86 1.695 3.942 14.186 1.00 0.00 C ATOM 1357 O GLY A 86 1.763 4.783 15.082 1.00 0.00 O ATOM 0 H GLY A 86 3.492 1.905 15.484 1.00 0.00 H new ATOM 0 HA2 GLY A 86 1.275 1.885 13.706 1.00 0.00 H new ATOM 0 HA3 GLY A 86 1.269 2.232 15.424 1.00 0.00 H new ATOM 1361 N ASN A 87 1.555 4.267 12.892 1.00 0.00 N ATOM 1362 CA ASN A 87 1.464 5.633 12.410 1.00 0.00 C ATOM 1363 C ASN A 87 2.796 6.395 12.295 1.00 0.00 C ATOM 1364 O ASN A 87 2.699 7.630 12.201 1.00 0.00 O ATOM 1365 CB ASN A 87 0.387 6.415 13.174 1.00 0.00 C ATOM 1366 CG ASN A 87 -0.640 7.270 12.387 1.00 0.00 C ATOM 1367 OD1 ASN A 87 -1.688 6.754 12.006 1.00 0.00 O ATOM 1368 ND2 ASN A 87 -0.108 8.418 12.018 1.00 0.00 N ATOM 0 H ASN A 87 1.502 3.570 12.149 1.00 0.00 H new ATOM 0 HA ASN A 87 1.152 5.545 11.369 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -0.175 5.697 13.771 1.00 0.00 H new ATOM 0 HB3 ASN A 87 0.898 7.079 13.871 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -0.581 9.001 11.328 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.777 8.723 12.423 1.00 0.00 H new ATOM 1375 N LYS A 88 3.931 5.699 12.307 1.00 0.00 N ATOM 1376 CA LYS A 88 5.239 6.354 12.204 1.00 0.00 C ATOM 1377 C LYS A 88 6.206 5.349 11.673 1.00 0.00 C ATOM 1378 O LYS A 88 5.866 4.192 11.440 1.00 0.00 O ATOM 1379 CB LYS A 88 5.835 6.505 13.585 1.00 0.00 C ATOM 1380 CG LYS A 88 5.152 7.516 14.441 1.00 0.00 C ATOM 1381 CD LYS A 88 3.922 6.891 15.037 1.00 0.00 C ATOM 1382 CE LYS A 88 3.767 7.137 16.539 1.00 0.00 C ATOM 1383 NZ LYS A 88 4.696 6.239 17.262 1.00 0.00 N ATOM 0 H LYS A 88 3.974 4.683 12.387 1.00 0.00 H new ATOM 0 HA LYS A 88 5.103 7.275 11.637 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.804 5.539 14.089 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.885 6.779 13.487 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.822 7.858 15.230 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.883 8.391 13.850 1.00 0.00 H new ATOM 0 HD2 LYS A 88 3.043 7.280 14.523 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.948 5.817 14.856 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.985 8.178 16.777 1.00 0.00 H new ATOM 0 HE3 LYS A 88 2.739 6.948 16.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.602 6.394 18.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.466 5.249 17.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.673 6.442 16.969 1.00 0.00 H new ATOM 1397 N LEU A 89 7.414 5.807 11.487 1.00 0.00 N ATOM 1398 CA LEU A 89 8.519 5.010 10.975 1.00 0.00 C ATOM 1399 C LEU A 89 9.553 5.078 12.090 1.00 0.00 C ATOM 1400 O LEU A 89 9.613 6.097 12.767 1.00 0.00 O ATOM 1401 CB LEU A 89 8.974 5.646 9.623 1.00 0.00 C ATOM 1402 CG LEU A 89 9.444 4.867 8.387 1.00 0.00 C ATOM 1403 CD1 LEU A 89 10.895 5.160 8.026 1.00 0.00 C ATOM 1404 CD2 LEU A 89 9.296 3.369 8.581 1.00 0.00 C ATOM 0 H LEU A 89 7.674 6.772 11.690 1.00 0.00 H new ATOM 0 HA LEU A 89 8.298 3.967 10.747 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.138 6.260 9.287 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.789 6.326 9.873 1.00 0.00 H new ATOM 0 HG LEU A 89 8.802 5.203 7.572 1.00 0.00 H new ATOM 0 HD11 LEU A 89 11.174 4.583 7.145 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.010 6.223 7.815 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.540 4.884 8.860 1.00 0.00 H new ATOM 0 HD21 LEU A 89 9.639 2.851 7.685 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.894 3.052 9.435 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.249 3.127 8.762 1.00 0.00 H new ATOM 1416 N VAL A 90 10.351 4.049 12.298 1.00 0.00 N ATOM 1417 CA VAL A 90 11.322 4.174 13.379 1.00 0.00 C ATOM 1418 C VAL A 90 12.608 3.506 12.836 1.00 0.00 C ATOM 1419 O VAL A 90 12.519 2.782 11.836 1.00 0.00 O ATOM 1420 CB VAL A 90 10.870 3.654 14.750 1.00 0.00 C ATOM 1421 CG1 VAL A 90 9.344 3.581 14.933 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.494 2.328 15.190 1.00 0.00 C ATOM 0 H VAL A 90 10.357 3.172 11.777 1.00 0.00 H new ATOM 0 HA VAL A 90 11.481 5.225 13.623 1.00 0.00 H new ATOM 0 HB VAL A 90 11.261 4.431 15.408 1.00 0.00 H new ATOM 0 HG11 VAL A 90 9.115 3.203 15.929 1.00 0.00 H new ATOM 0 HG12 VAL A 90 8.915 4.576 14.815 1.00 0.00 H new ATOM 0 HG13 VAL A 90 8.919 2.912 14.185 1.00 0.00 H new ATOM 0 HG21 VAL A 90 11.107 2.052 16.171 1.00 0.00 H new ATOM 0 HG22 VAL A 90 11.243 1.551 14.469 1.00 0.00 H new ATOM 0 HG23 VAL A 90 12.577 2.436 15.244 1.00 0.00 H new ATOM 1432 N GLY A 91 13.703 3.811 13.546 1.00 0.00 N ATOM 1433 CA GLY A 91 15.060 3.355 13.304 1.00 0.00 C ATOM 1434 C GLY A 91 15.807 3.118 14.606 1.00 0.00 C ATOM 1435 O GLY A 91 16.146 4.071 15.315 1.00 0.00 O ATOM 0 H GLY A 91 13.650 4.426 14.358 1.00 0.00 H new ATOM 0 HA2 GLY A 91 15.037 2.433 12.723 1.00 0.00 H new ATOM 0 HA3 GLY A 91 15.593 4.095 12.707 1.00 0.00 H new ATOM 1439 N LYS A 92 16.088 1.889 14.971 1.00 0.00 N ATOM 1440 CA LYS A 92 16.792 1.615 16.188 1.00 0.00 C ATOM 1441 C LYS A 92 18.207 1.290 15.698 1.00 0.00 C ATOM 1442 O LYS A 92 18.410 1.042 14.524 1.00 0.00 O ATOM 1443 CB LYS A 92 16.291 0.403 16.921 1.00 0.00 C ATOM 1444 CG LYS A 92 15.185 0.856 17.890 1.00 0.00 C ATOM 1445 CD LYS A 92 14.707 -0.257 18.781 1.00 0.00 C ATOM 1446 CE LYS A 92 13.552 -0.977 18.114 1.00 0.00 C ATOM 1447 NZ LYS A 92 13.332 -2.320 18.665 1.00 0.00 N ATOM 0 H LYS A 92 15.834 1.061 14.433 1.00 0.00 H new ATOM 0 HA LYS A 92 16.692 2.453 16.878 1.00 0.00 H new ATOM 0 HB2 LYS A 92 15.903 -0.334 16.218 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.104 -0.075 17.468 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.559 1.674 18.505 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.343 1.246 17.318 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.521 -0.955 18.977 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.392 0.144 19.744 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.643 -0.386 18.232 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.746 -1.054 17.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.532 -2.769 18.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.188 -2.895 18.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.120 -2.248 19.681 1.00 0.00 H new ATOM 1461 N PHE A 93 19.154 1.303 16.618 1.00 0.00 N ATOM 1462 CA PHE A 93 20.516 1.014 16.245 1.00 0.00 C ATOM 1463 C PHE A 93 21.315 0.651 17.477 1.00 0.00 C ATOM 1464 O PHE A 93 21.476 1.495 18.356 1.00 0.00 O ATOM 1465 CB PHE A 93 21.126 2.351 15.768 1.00 0.00 C ATOM 1466 CG PHE A 93 20.471 2.918 14.545 1.00 0.00 C ATOM 1467 CD1 PHE A 93 19.351 3.731 14.760 1.00 0.00 C ATOM 1468 CD2 PHE A 93 20.909 2.682 13.256 1.00 0.00 C ATOM 1469 CE1 PHE A 93 18.666 4.300 13.693 1.00 0.00 C ATOM 1470 CE2 PHE A 93 20.260 3.237 12.147 1.00 0.00 C ATOM 1471 CZ PHE A 93 19.153 4.030 12.417 1.00 0.00 C ATOM 0 H PHE A 93 19.006 1.506 17.606 1.00 0.00 H new ATOM 0 HA PHE A 93 20.537 0.214 15.505 1.00 0.00 H new ATOM 0 HB2 PHE A 93 21.056 3.079 16.576 1.00 0.00 H new ATOM 0 HB3 PHE A 93 22.186 2.202 15.564 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.015 3.918 15.769 1.00 0.00 H new ATOM 0 HD2 PHE A 93 21.774 2.054 13.100 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.797 4.922 13.846 1.00 0.00 H new ATOM 0 HE2 PHE A 93 20.601 3.058 11.138 1.00 0.00 H new ATOM 0 HZ PHE A 93 18.633 4.468 11.578 1.00 0.00 H new ATOM 1481 N LYS A 94 21.790 -0.577 17.518 1.00 0.00 N ATOM 1482 CA LYS A 94 22.567 -1.052 18.627 1.00 0.00 C ATOM 1483 C LYS A 94 24.032 -0.793 18.281 1.00 0.00 C ATOM 1484 O LYS A 94 24.448 -0.926 17.141 1.00 0.00 O ATOM 1485 CB LYS A 94 22.289 -2.510 18.903 1.00 0.00 C ATOM 1486 CG LYS A 94 20.998 -2.593 19.699 1.00 0.00 C ATOM 1487 CD LYS A 94 20.860 -3.904 20.438 1.00 0.00 C ATOM 1488 CE LYS A 94 20.650 -3.624 21.927 1.00 0.00 C ATOM 1489 NZ LYS A 94 19.223 -3.663 22.268 1.00 0.00 N ATOM 0 H LYS A 94 21.645 -1.267 16.781 1.00 0.00 H new ATOM 0 HA LYS A 94 22.304 -0.528 19.546 1.00 0.00 H new ATOM 0 HB2 LYS A 94 22.199 -3.065 17.969 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.112 -2.957 19.461 1.00 0.00 H new ATOM 0 HG2 LYS A 94 20.961 -1.771 20.414 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.150 -2.468 19.025 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.019 -4.472 20.041 1.00 0.00 H new ATOM 0 HD3 LYS A 94 21.753 -4.512 20.293 1.00 0.00 H new ATOM 0 HE2 LYS A 94 21.191 -4.362 22.520 1.00 0.00 H new ATOM 0 HE3 LYS A 94 21.062 -2.647 22.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.086 -3.291 23.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 18.688 -3.081 21.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.882 -4.645 22.225 1.00 0.00 H new ATOM 1503 N ARG A 95 24.760 -0.430 19.303 1.00 0.00 N ATOM 1504 CA ARG A 95 26.157 -0.156 19.127 1.00 0.00 C ATOM 1505 C ARG A 95 26.942 -1.422 19.299 1.00 0.00 C ATOM 1506 O ARG A 95 26.770 -2.165 20.273 1.00 0.00 O ATOM 1507 CB ARG A 95 26.503 0.751 20.294 1.00 0.00 C ATOM 1508 CG ARG A 95 27.818 1.441 19.980 1.00 0.00 C ATOM 1509 CD ARG A 95 27.423 2.877 20.182 1.00 0.00 C ATOM 1510 NE ARG A 95 28.509 3.679 19.728 1.00 0.00 N ATOM 1511 CZ ARG A 95 29.484 4.197 20.428 1.00 0.00 C ATOM 1512 NH1 ARG A 95 29.591 4.029 21.736 1.00 0.00 N ATOM 1513 NH2 ARG A 95 30.391 4.918 19.781 1.00 0.00 N ATOM 0 H ARG A 95 24.412 -0.319 20.255 1.00 0.00 H new ATOM 0 HA ARG A 95 26.374 0.270 18.147 1.00 0.00 H new ATOM 0 HB2 ARG A 95 25.715 1.487 20.451 1.00 0.00 H new ATOM 0 HB3 ARG A 95 26.587 0.173 21.214 1.00 0.00 H new ATOM 0 HG2 ARG A 95 28.620 1.132 20.651 1.00 0.00 H new ATOM 0 HG3 ARG A 95 28.159 1.243 18.964 1.00 0.00 H new ATOM 0 HD2 ARG A 95 26.515 3.108 19.626 1.00 0.00 H new ATOM 0 HD3 ARG A 95 27.212 3.074 21.233 1.00 0.00 H new ATOM 0 HE ARG A 95 28.528 3.874 18.727 1.00 0.00 H new ATOM 0 HH11 ARG A 95 28.896 3.477 22.238 1.00 0.00 H new ATOM 0 HH12 ARG A 95 30.369 4.452 22.243 1.00 0.00 H new ATOM 0 HH21 ARG A 95 30.312 5.051 18.773 1.00 0.00 H new ATOM 0 HH22 ARG A 95 31.167 5.339 20.292 1.00 0.00 H new ATOM 1527 N VAL A 96 27.820 -1.708 18.374 1.00 0.00 N ATOM 1528 CA VAL A 96 28.652 -2.902 18.410 1.00 0.00 C ATOM 1529 C VAL A 96 29.732 -2.848 19.505 1.00 0.00 C ATOM 1530 O VAL A 96 30.072 -3.874 20.071 1.00 0.00 O ATOM 1531 CB VAL A 96 29.265 -3.074 17.012 1.00 0.00 C ATOM 1532 CG1 VAL A 96 30.284 -4.194 16.940 1.00 0.00 C ATOM 1533 CG2 VAL A 96 28.109 -3.207 15.998 1.00 0.00 C ATOM 0 H VAL A 96 27.987 -1.116 17.560 1.00 0.00 H new ATOM 0 HA VAL A 96 28.038 -3.764 18.669 1.00 0.00 H new ATOM 0 HB VAL A 96 29.853 -2.192 16.758 1.00 0.00 H new ATOM 0 HG11 VAL A 96 30.678 -4.262 15.926 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.099 -3.989 17.634 1.00 0.00 H new ATOM 0 HG13 VAL A 96 29.808 -5.137 17.208 1.00 0.00 H new ATOM 0 HG21 VAL A 96 28.517 -3.331 14.995 1.00 0.00 H new ATOM 0 HG22 VAL A 96 27.501 -4.075 16.252 1.00 0.00 H new ATOM 0 HG23 VAL A 96 27.492 -2.309 16.030 1.00 0.00 H new ATOM 1543 N ASP A 97 30.241 -1.651 19.771 1.00 0.00 N ATOM 1544 CA ASP A 97 31.261 -1.483 20.783 1.00 0.00 C ATOM 1545 C ASP A 97 30.720 -1.063 22.148 1.00 0.00 C ATOM 1546 O ASP A 97 31.503 -1.044 23.136 1.00 0.00 O ATOM 1547 CB ASP A 97 32.524 -0.739 20.290 1.00 0.00 C ATOM 1548 CG ASP A 97 33.587 -0.630 21.340 1.00 0.00 C ATOM 1549 OD1 ASP A 97 34.306 -1.533 21.647 1.00 0.00 O ATOM 1550 OD2 ASP A 97 33.668 0.530 21.896 1.00 0.00 O ATOM 0 H ASP A 97 29.962 -0.791 19.300 1.00 0.00 H new ATOM 0 HA ASP A 97 31.641 -2.486 20.978 1.00 0.00 H new ATOM 0 HB2 ASP A 97 32.930 -1.259 19.423 1.00 0.00 H new ATOM 0 HB3 ASP A 97 32.244 0.261 19.959 1.00 0.00 H new ATOM 1555 N ASN A 98 29.444 -0.731 22.238 1.00 0.00 N ATOM 1556 CA ASN A 98 28.858 -0.315 23.492 1.00 0.00 C ATOM 1557 C ASN A 98 27.748 -1.203 23.966 1.00 0.00 C ATOM 1558 O ASN A 98 27.513 -1.320 25.150 1.00 0.00 O ATOM 1559 CB ASN A 98 28.434 1.154 23.400 1.00 0.00 C ATOM 1560 CG ASN A 98 27.640 1.587 24.623 1.00 0.00 C ATOM 1561 OD1 ASN A 98 26.522 2.275 24.380 1.00 0.00 O flip ATOM 1562 ND2 ASN A 98 28.029 1.306 25.766 1.00 0.00 N flip ATOM 0 H ASN A 98 28.795 -0.743 21.452 1.00 0.00 H new ATOM 0 HA ASN A 98 29.626 -0.414 24.259 1.00 0.00 H new ATOM 0 HB2 ASN A 98 29.319 1.783 23.299 1.00 0.00 H new ATOM 0 HB3 ASN A 98 27.832 1.304 22.504 1.00 0.00 H new ATOM 0 HD21 ASN A 98 28.892 0.777 25.896 1.00 0.00 H new ATOM 0 HD22 ASN A 98 27.486 1.603 26.577 1.00 0.00 H new ATOM 1569 N GLY A 99 27.072 -1.824 22.997 1.00 0.00 N ATOM 1570 CA GLY A 99 25.972 -2.711 23.312 1.00 0.00 C ATOM 1571 C GLY A 99 24.638 -2.068 23.718 1.00 0.00 C ATOM 1572 O GLY A 99 23.748 -2.752 24.197 1.00 0.00 O ATOM 0 H GLY A 99 27.271 -1.725 22.001 1.00 0.00 H new ATOM 0 HA2 GLY A 99 25.790 -3.343 22.443 1.00 0.00 H new ATOM 0 HA3 GLY A 99 26.290 -3.367 24.122 1.00 0.00 H new ATOM 1576 N LYS A 100 24.555 -0.770 23.513 1.00 0.00 N ATOM 1577 CA LYS A 100 23.355 -0.029 23.847 1.00 0.00 C ATOM 1578 C LYS A 100 22.594 0.330 22.570 1.00 0.00 C ATOM 1579 O LYS A 100 23.156 0.475 21.510 1.00 0.00 O ATOM 1580 CB LYS A 100 23.580 1.207 24.710 1.00 0.00 C ATOM 1581 CG LYS A 100 24.190 0.800 26.025 1.00 0.00 C ATOM 1582 CD LYS A 100 24.102 2.017 26.937 1.00 0.00 C ATOM 1583 CE LYS A 100 23.648 1.683 28.371 1.00 0.00 C ATOM 1584 NZ LYS A 100 24.501 2.318 29.394 1.00 0.00 N ATOM 0 H LYS A 100 25.305 -0.205 23.116 1.00 0.00 H new ATOM 0 HA LYS A 100 22.759 -0.696 24.470 1.00 0.00 H new ATOM 0 HB2 LYS A 100 24.236 1.908 24.195 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.634 1.721 24.880 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.655 -0.047 26.455 1.00 0.00 H new ATOM 0 HG3 LYS A 100 25.226 0.489 25.892 1.00 0.00 H new ATOM 0 HD2 LYS A 100 25.078 2.501 26.977 1.00 0.00 H new ATOM 0 HD3 LYS A 100 23.407 2.736 26.503 1.00 0.00 H new ATOM 0 HE2 LYS A 100 22.617 2.009 28.508 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.661 0.602 28.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 24.155 2.063 30.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.481 1.988 29.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.469 3.351 29.280 1.00 0.00 H new ATOM 1598 N GLU A 101 21.269 0.468 22.713 1.00 0.00 N ATOM 1599 CA GLU A 101 20.307 0.793 21.699 1.00 0.00 C ATOM 1600 C GLU A 101 19.970 2.259 21.605 1.00 0.00 C ATOM 1601 O GLU A 101 19.463 2.797 22.578 1.00 0.00 O ATOM 1602 CB GLU A 101 18.998 0.064 22.108 1.00 0.00 C ATOM 1603 CG GLU A 101 17.742 0.399 21.292 1.00 0.00 C ATOM 1604 CD GLU A 101 16.613 0.779 22.229 1.00 0.00 C ATOM 1605 OE1 GLU A 101 16.753 1.385 23.275 1.00 0.00 O ATOM 1606 OE2 GLU A 101 15.453 0.379 21.791 1.00 0.00 O ATOM 0 H GLU A 101 20.825 0.341 23.623 1.00 0.00 H new ATOM 0 HA GLU A 101 20.727 0.500 20.737 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.171 -1.010 22.042 1.00 0.00 H new ATOM 0 HB3 GLU A 101 18.795 0.290 23.155 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.950 1.220 20.606 1.00 0.00 H new ATOM 0 HG3 GLU A 101 17.451 -0.458 20.685 1.00 0.00 H new ATOM 1613 N LEU A 102 20.271 2.784 20.435 1.00 0.00 N ATOM 1614 CA LEU A 102 20.095 4.148 19.952 1.00 0.00 C ATOM 1615 C LEU A 102 18.775 4.078 19.160 1.00 0.00 C ATOM 1616 O LEU A 102 18.757 3.310 18.189 1.00 0.00 O ATOM 1617 CB LEU A 102 21.291 4.520 19.057 1.00 0.00 C ATOM 1618 CG LEU A 102 21.431 5.867 18.316 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.874 6.232 17.993 1.00 0.00 C ATOM 1620 CD2 LEU A 102 20.682 5.928 17.002 1.00 0.00 C ATOM 0 H LEU A 102 20.694 2.201 19.713 1.00 0.00 H new ATOM 0 HA LEU A 102 20.053 4.906 20.735 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.179 4.423 19.681 1.00 0.00 H new ATOM 0 HB3 LEU A 102 21.352 3.745 18.293 1.00 0.00 H new ATOM 0 HG LEU A 102 21.001 6.571 19.029 1.00 0.00 H new ATOM 0 HD11 LEU A 102 22.899 7.189 17.473 1.00 0.00 H new ATOM 0 HD12 LEU A 102 23.446 6.306 18.918 1.00 0.00 H new ATOM 0 HD13 LEU A 102 23.310 5.462 17.357 1.00 0.00 H new ATOM 0 HD21 LEU A 102 20.830 6.906 16.544 1.00 0.00 H new ATOM 0 HD22 LEU A 102 21.057 5.153 16.333 1.00 0.00 H new ATOM 0 HD23 LEU A 102 19.619 5.769 17.182 1.00 0.00 H new ATOM 1632 N ILE A 103 17.752 4.829 19.566 1.00 0.00 N ATOM 1633 CA ILE A 103 16.545 4.723 18.805 1.00 0.00 C ATOM 1634 C ILE A 103 16.362 6.028 18.068 1.00 0.00 C ATOM 1635 O ILE A 103 16.924 7.064 18.363 1.00 0.00 O ATOM 1636 CB ILE A 103 15.336 4.408 19.670 1.00 0.00 C ATOM 1637 CG1 ILE A 103 14.090 4.217 18.820 1.00 0.00 C ATOM 1638 CG2 ILE A 103 15.164 5.347 20.849 1.00 0.00 C ATOM 1639 CD1 ILE A 103 12.872 3.797 19.632 1.00 0.00 C ATOM 0 H ILE A 103 17.743 5.469 20.361 1.00 0.00 H new ATOM 0 HA ILE A 103 16.628 3.890 18.107 1.00 0.00 H new ATOM 0 HB ILE A 103 15.524 3.448 20.151 1.00 0.00 H new ATOM 0 HG12 ILE A 103 13.868 5.147 18.297 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.289 3.463 18.058 1.00 0.00 H new ATOM 0 HG21 ILE A 103 14.280 5.058 21.418 1.00 0.00 H new ATOM 0 HG22 ILE A 103 16.043 5.290 21.490 1.00 0.00 H new ATOM 0 HG23 ILE A 103 15.044 6.368 20.487 1.00 0.00 H new ATOM 0 HD11 ILE A 103 12.016 3.677 18.968 1.00 0.00 H new ATOM 0 HD12 ILE A 103 13.078 2.851 20.134 1.00 0.00 H new ATOM 0 HD13 ILE A 103 12.650 4.562 20.376 1.00 0.00 H new ATOM 1651 N ALA A 104 15.552 6.036 17.033 1.00 0.00 N ATOM 1652 CA ALA A 104 15.259 7.171 16.202 1.00 0.00 C ATOM 1653 C ALA A 104 13.833 6.983 15.653 1.00 0.00 C ATOM 1654 O ALA A 104 13.418 5.819 15.500 1.00 0.00 O ATOM 1655 CB ALA A 104 16.283 7.369 15.085 1.00 0.00 C ATOM 0 H ALA A 104 15.053 5.198 16.735 1.00 0.00 H new ATOM 0 HA ALA A 104 15.320 8.083 16.796 1.00 0.00 H new ATOM 0 HB1 ALA A 104 16.009 8.241 14.491 1.00 0.00 H new ATOM 0 HB2 ALA A 104 17.271 7.522 15.520 1.00 0.00 H new ATOM 0 HB3 ALA A 104 16.300 6.486 14.447 1.00 0.00 H new ATOM 1661 N VAL A 105 13.068 8.014 15.350 1.00 0.00 N ATOM 1662 CA VAL A 105 11.712 7.896 14.833 1.00 0.00 C ATOM 1663 C VAL A 105 11.363 9.052 13.918 1.00 0.00 C ATOM 1664 O VAL A 105 11.338 10.214 14.327 1.00 0.00 O ATOM 1665 CB VAL A 105 10.744 7.814 16.056 1.00 0.00 C ATOM 1666 CG1 VAL A 105 9.423 8.549 15.831 1.00 0.00 C ATOM 1667 CG2 VAL A 105 10.330 6.381 16.284 1.00 0.00 C ATOM 0 H VAL A 105 13.376 8.980 15.458 1.00 0.00 H new ATOM 0 HA VAL A 105 11.620 6.996 14.225 1.00 0.00 H new ATOM 0 HB VAL A 105 11.296 8.257 16.885 1.00 0.00 H new ATOM 0 HG11 VAL A 105 8.797 8.453 16.718 1.00 0.00 H new ATOM 0 HG12 VAL A 105 9.621 9.604 15.640 1.00 0.00 H new ATOM 0 HG13 VAL A 105 8.907 8.116 14.974 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.655 6.329 17.138 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.822 6.003 15.396 1.00 0.00 H new ATOM 0 HG23 VAL A 105 11.213 5.774 16.482 1.00 0.00 H new ATOM 1677 N ARG A 106 11.098 8.680 12.688 1.00 0.00 N ATOM 1678 CA ARG A 106 10.747 9.666 11.685 1.00 0.00 C ATOM 1679 C ARG A 106 9.251 9.892 11.854 1.00 0.00 C ATOM 1680 O ARG A 106 8.425 9.201 11.257 1.00 0.00 O ATOM 1681 CB ARG A 106 10.823 9.068 10.312 1.00 0.00 C ATOM 1682 CG ARG A 106 12.232 9.177 9.772 1.00 0.00 C ATOM 1683 CD ARG A 106 12.385 8.296 8.564 1.00 0.00 C ATOM 1684 NE ARG A 106 13.796 8.340 8.159 1.00 0.00 N ATOM 1685 CZ ARG A 106 14.426 7.520 7.338 1.00 0.00 C ATOM 1686 NH1 ARG A 106 13.817 6.475 6.745 1.00 0.00 N ATOM 1687 NH2 ARG A 106 15.695 7.674 7.053 1.00 0.00 N ATOM 0 H ARG A 106 11.117 7.715 12.357 1.00 0.00 H new ATOM 0 HA ARG A 106 11.393 10.538 11.791 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.519 8.022 10.346 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.130 9.581 9.645 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.451 10.212 9.509 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.949 8.885 10.539 1.00 0.00 H new ATOM 0 HD2 ARG A 106 12.084 7.274 8.795 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.743 8.642 7.754 1.00 0.00 H new ATOM 0 HE ARG A 106 14.355 9.093 8.559 1.00 0.00 H new ATOM 0 HH11 ARG A 106 12.830 6.292 6.924 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.343 5.867 6.117 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.221 8.442 7.469 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.157 7.026 6.415 1.00 0.00 H new ATOM 1701 N GLU A 107 8.945 10.873 12.677 1.00 0.00 N ATOM 1702 CA GLU A 107 7.585 11.234 12.964 1.00 0.00 C ATOM 1703 C GLU A 107 6.932 12.134 11.914 1.00 0.00 C ATOM 1704 O GLU A 107 6.796 13.345 11.968 1.00 0.00 O ATOM 1705 CB GLU A 107 7.491 11.805 14.351 1.00 0.00 C ATOM 1706 CG GLU A 107 6.073 11.972 14.907 1.00 0.00 C ATOM 1707 CD GLU A 107 6.235 12.441 16.308 1.00 0.00 C ATOM 1708 OE1 GLU A 107 7.208 12.997 16.778 1.00 0.00 O ATOM 1709 OE2 GLU A 107 5.147 12.177 17.014 1.00 0.00 O ATOM 0 H GLU A 107 9.639 11.440 13.164 1.00 0.00 H new ATOM 0 HA GLU A 107 6.999 10.316 12.917 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.053 11.161 15.028 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.981 12.779 14.357 1.00 0.00 H new ATOM 0 HG2 GLU A 107 5.505 12.692 14.318 1.00 0.00 H new ATOM 0 HG3 GLU A 107 5.527 11.030 14.872 1.00 0.00 H new ATOM 1716 N ILE A 108 6.492 11.462 10.859 1.00 0.00 N ATOM 1717 CA ILE A 108 5.857 12.236 9.818 1.00 0.00 C ATOM 1718 C ILE A 108 4.611 12.968 10.251 1.00 0.00 C ATOM 1719 O ILE A 108 3.550 12.375 10.321 1.00 0.00 O ATOM 1720 CB ILE A 108 5.760 11.495 8.500 1.00 0.00 C ATOM 1721 CG1 ILE A 108 7.158 11.339 7.888 1.00 0.00 C ATOM 1722 CG2 ILE A 108 4.737 12.104 7.576 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.142 12.011 6.530 1.00 0.00 C ATOM 0 H ILE A 108 6.557 10.455 10.709 1.00 0.00 H new ATOM 0 HA ILE A 108 6.542 13.057 9.608 1.00 0.00 H new ATOM 0 HB ILE A 108 5.383 10.488 8.681 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.911 11.794 8.532 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.418 10.285 7.790 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.705 11.538 6.645 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.756 12.078 8.051 1.00 0.00 H new ATOM 0 HG23 ILE A 108 5.009 13.138 7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 108 8.124 11.918 6.066 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.395 11.533 5.896 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.895 13.066 6.649 1.00 0.00 H new ATOM 1735 N SER A 109 4.764 14.259 10.534 1.00 0.00 N ATOM 1736 CA SER A 109 3.680 15.118 10.969 1.00 0.00 C ATOM 1737 C SER A 109 3.275 15.836 9.677 1.00 0.00 C ATOM 1738 O SER A 109 3.851 16.883 9.435 1.00 0.00 O ATOM 1739 CB SER A 109 4.050 16.050 12.103 1.00 0.00 C ATOM 1740 OG SER A 109 3.001 16.074 13.056 1.00 0.00 O ATOM 0 H SER A 109 5.661 14.740 10.465 1.00 0.00 H new ATOM 0 HA SER A 109 2.856 14.561 11.415 1.00 0.00 H new ATOM 0 HB2 SER A 109 4.976 15.718 12.573 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.230 17.054 11.719 1.00 0.00 H new ATOM 0 HG SER A 109 3.241 16.676 13.791 1.00 0.00 H new ATOM 1746 N GLY A 110 2.331 15.232 8.949 1.00 0.00 N ATOM 1747 CA GLY A 110 1.803 15.734 7.696 1.00 0.00 C ATOM 1748 C GLY A 110 2.904 15.945 6.664 1.00 0.00 C ATOM 1749 O GLY A 110 3.629 14.991 6.420 1.00 0.00 O ATOM 0 H GLY A 110 1.905 14.350 9.234 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.067 15.032 7.304 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.283 16.676 7.871 1.00 0.00 H new ATOM 1753 N ASN A 111 3.026 17.127 6.083 1.00 0.00 N ATOM 1754 CA ASN A 111 4.083 17.329 5.089 1.00 0.00 C ATOM 1755 C ASN A 111 5.483 17.223 5.681 1.00 0.00 C ATOM 1756 O ASN A 111 6.370 16.978 4.887 1.00 0.00 O ATOM 1757 CB ASN A 111 3.941 18.491 4.085 1.00 0.00 C ATOM 1758 CG ASN A 111 2.537 18.819 3.505 1.00 0.00 C ATOM 1759 OD1 ASN A 111 1.674 17.956 3.587 1.00 0.00 O ATOM 1760 ND2 ASN A 111 2.378 20.109 3.235 1.00 0.00 N ATOM 0 H ASN A 111 2.434 17.937 6.268 1.00 0.00 H new ATOM 0 HA ASN A 111 3.918 16.472 4.436 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.315 19.392 4.570 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.603 18.283 3.245 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.444 20.483 3.066 1.00 0.00 H new ATOM 0 HD22 ASN A 111 3.190 20.726 3.196 1.00 0.00 H new ATOM 1767 N GLU A 112 5.588 17.412 7.021 1.00 0.00 N ATOM 1768 CA GLU A 112 6.857 17.327 7.680 1.00 0.00 C ATOM 1769 C GLU A 112 7.192 15.980 8.297 1.00 0.00 C ATOM 1770 O GLU A 112 6.322 15.338 8.836 1.00 0.00 O ATOM 1771 CB GLU A 112 7.101 18.429 8.715 1.00 0.00 C ATOM 1772 CG GLU A 112 7.112 19.776 8.005 1.00 0.00 C ATOM 1773 CD GLU A 112 5.825 20.520 8.222 1.00 0.00 C ATOM 1774 OE1 GLU A 112 5.268 20.485 9.304 1.00 0.00 O ATOM 1775 OE2 GLU A 112 5.430 21.154 7.160 1.00 0.00 O ATOM 0 H GLU A 112 4.801 17.621 7.635 1.00 0.00 H new ATOM 0 HA GLU A 112 7.539 17.472 6.842 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.322 18.410 9.477 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.050 18.264 9.226 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.946 20.375 8.370 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.271 19.625 6.937 1.00 0.00 H new ATOM 1782 N LEU A 113 8.453 15.598 8.196 1.00 0.00 N ATOM 1783 CA LEU A 113 9.047 14.350 8.711 1.00 0.00 C ATOM 1784 C LEU A 113 9.769 14.886 9.946 1.00 0.00 C ATOM 1785 O LEU A 113 10.174 16.046 9.854 1.00 0.00 O ATOM 1786 CB LEU A 113 10.059 13.758 7.716 1.00 0.00 C ATOM 1787 CG LEU A 113 11.120 12.692 8.099 1.00 0.00 C ATOM 1788 CD1 LEU A 113 11.883 12.412 6.795 1.00 0.00 C ATOM 1789 CD2 LEU A 113 12.127 13.372 9.002 1.00 0.00 C ATOM 0 H LEU A 113 9.144 16.180 7.724 1.00 0.00 H new ATOM 0 HA LEU A 113 8.330 13.550 8.896 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.473 13.329 6.903 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.610 14.602 7.301 1.00 0.00 H new ATOM 0 HG LEU A 113 10.678 11.809 8.561 1.00 0.00 H new ATOM 0 HD11 LEU A 113 12.655 11.665 6.979 1.00 0.00 H new ATOM 0 HD12 LEU A 113 11.190 12.039 6.041 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.346 13.333 6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 113 12.894 12.656 9.296 1.00 0.00 H new ATOM 0 HD22 LEU A 113 12.591 14.202 8.469 1.00 0.00 H new ATOM 0 HD23 LEU A 113 11.622 13.749 9.892 1.00 0.00 H new ATOM 1801 N ILE A 114 9.930 14.122 11.010 1.00 0.00 N ATOM 1802 CA ILE A 114 10.621 14.668 12.155 1.00 0.00 C ATOM 1803 C ILE A 114 11.346 13.460 12.750 1.00 0.00 C ATOM 1804 O ILE A 114 10.677 12.691 13.433 1.00 0.00 O ATOM 1805 CB ILE A 114 9.626 15.067 13.196 1.00 0.00 C ATOM 1806 CG1 ILE A 114 8.726 16.240 12.778 1.00 0.00 C ATOM 1807 CG2 ILE A 114 10.188 15.182 14.611 1.00 0.00 C ATOM 1808 CD1 ILE A 114 7.684 16.526 13.848 1.00 0.00 C ATOM 0 H ILE A 114 9.605 13.160 11.103 1.00 0.00 H new ATOM 0 HA ILE A 114 11.251 15.514 11.880 1.00 0.00 H new ATOM 0 HB ILE A 114 8.955 14.211 13.259 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.334 17.129 12.609 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.232 16.007 11.835 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.392 15.476 15.296 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.595 14.219 14.920 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.978 15.933 14.629 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.057 17.360 13.532 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.064 15.642 13.997 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.183 16.781 14.783 1.00 0.00 H new ATOM 1820 N GLN A 115 12.627 13.402 12.437 1.00 0.00 N ATOM 1821 CA GLN A 115 13.426 12.282 12.949 1.00 0.00 C ATOM 1822 C GLN A 115 13.607 12.658 14.396 1.00 0.00 C ATOM 1823 O GLN A 115 13.542 13.861 14.653 1.00 0.00 O ATOM 1824 CB GLN A 115 14.788 12.176 12.269 1.00 0.00 C ATOM 1825 CG GLN A 115 14.761 12.712 10.817 1.00 0.00 C ATOM 1826 CD GLN A 115 15.758 11.988 9.925 1.00 0.00 C ATOM 1827 OE1 GLN A 115 17.044 12.079 10.313 1.00 0.00 O flip ATOM 1828 NE2 GLN A 115 15.447 11.358 8.921 1.00 0.00 N flip ATOM 0 H GLN A 115 13.127 14.078 11.859 1.00 0.00 H new ATOM 0 HA GLN A 115 12.947 11.318 12.779 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.525 12.734 12.847 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.109 11.134 12.264 1.00 0.00 H new ATOM 0 HG2 GLN A 115 13.758 12.598 10.407 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.985 13.779 10.820 1.00 0.00 H new ATOM 0 HE21 GLN A 115 14.468 11.298 8.639 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.167 10.894 8.367 1.00 0.00 H new ATOM 1837 N THR A 116 13.813 11.712 15.289 1.00 0.00 N ATOM 1838 CA THR A 116 13.956 12.034 16.659 1.00 0.00 C ATOM 1839 C THR A 116 14.149 10.764 17.473 1.00 0.00 C ATOM 1840 O THR A 116 13.738 9.717 16.995 1.00 0.00 O ATOM 1841 CB THR A 116 12.676 12.719 17.198 1.00 0.00 C ATOM 1842 OG1 THR A 116 12.795 12.824 18.570 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.483 11.821 16.882 1.00 0.00 C ATOM 0 H THR A 116 13.882 10.718 15.072 1.00 0.00 H new ATOM 0 HA THR A 116 14.815 12.699 16.750 1.00 0.00 H new ATOM 0 HB THR A 116 12.541 13.702 16.747 1.00 0.00 H new ATOM 0 HG1 THR A 116 13.428 13.539 18.790 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.570 12.285 17.254 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.407 11.683 15.803 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.619 10.852 17.363 1.00 0.00 H new ATOM 1851 N TYR A 117 14.741 10.986 18.634 1.00 0.00 N ATOM 1852 CA TYR A 117 15.016 9.949 19.658 1.00 0.00 C ATOM 1853 C TYR A 117 16.430 9.916 20.089 1.00 0.00 C ATOM 1854 O TYR A 117 17.024 10.967 19.886 1.00 0.00 O ATOM 1855 CB TYR A 117 14.473 8.546 19.487 1.00 0.00 C ATOM 1856 CG TYR A 117 12.949 8.522 19.334 1.00 0.00 C ATOM 1857 CD1 TYR A 117 12.184 9.699 19.427 1.00 0.00 C ATOM 1858 CD2 TYR A 117 12.244 7.352 19.101 1.00 0.00 C ATOM 1859 CE1 TYR A 117 10.806 9.689 19.302 1.00 0.00 C ATOM 1860 CE2 TYR A 117 10.853 7.296 18.969 1.00 0.00 C ATOM 1861 CZ TYR A 117 10.149 8.477 19.074 1.00 0.00 C ATOM 1862 OH TYR A 117 8.785 8.472 18.958 1.00 0.00 O ATOM 0 H TYR A 117 15.059 11.914 18.914 1.00 0.00 H new ATOM 0 HA TYR A 117 14.377 10.336 20.452 1.00 0.00 H new ATOM 0 HB2 TYR A 117 14.930 8.087 18.610 1.00 0.00 H new ATOM 0 HB3 TYR A 117 14.758 7.942 20.348 1.00 0.00 H new ATOM 0 HD1 TYR A 117 12.687 10.639 19.601 1.00 0.00 H new ATOM 0 HD2 TYR A 117 12.801 6.430 19.017 1.00 0.00 H new ATOM 0 HE1 TYR A 117 10.244 10.608 19.380 1.00 0.00 H new ATOM 0 HE2 TYR A 117 10.347 6.359 18.791 1.00 0.00 H new ATOM 0 HH TYR A 117 8.486 9.322 18.572 1.00 0.00 H new ATOM 1872 N THR A 118 16.911 8.815 20.617 1.00 0.00 N ATOM 1873 CA THR A 118 18.261 8.899 21.115 1.00 0.00 C ATOM 1874 C THR A 118 19.193 7.772 20.781 1.00 0.00 C ATOM 1875 O THR A 118 19.046 6.918 19.912 1.00 0.00 O ATOM 1876 CB THR A 118 18.166 9.082 22.668 1.00 0.00 C ATOM 1877 OG1 THR A 118 19.347 9.553 23.239 1.00 0.00 O ATOM 1878 CG2 THR A 118 17.814 7.721 23.293 1.00 0.00 C ATOM 0 H THR A 118 16.434 7.918 20.710 1.00 0.00 H new ATOM 0 HA THR A 118 18.719 9.743 20.599 1.00 0.00 H new ATOM 0 HB THR A 118 17.399 9.831 22.866 1.00 0.00 H new ATOM 0 HG1 THR A 118 19.581 10.417 22.840 1.00 0.00 H new ATOM 0 HG21 THR A 118 17.743 7.825 24.376 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.859 7.375 22.898 1.00 0.00 H new ATOM 0 HG23 THR A 118 18.591 6.997 23.049 1.00 0.00 H new ATOM 1886 N TYR A 119 20.281 7.757 21.579 1.00 0.00 N ATOM 1887 CA TYR A 119 21.361 6.796 21.534 1.00 0.00 C ATOM 1888 C TYR A 119 21.303 6.007 22.840 1.00 0.00 C ATOM 1889 O TYR A 119 21.268 4.783 22.841 1.00 0.00 O ATOM 1890 CB TYR A 119 22.717 7.549 21.631 1.00 0.00 C ATOM 1891 CG TYR A 119 23.898 6.748 22.134 1.00 0.00 C ATOM 1892 CD1 TYR A 119 24.145 5.446 21.728 1.00 0.00 C ATOM 1893 CD2 TYR A 119 24.793 7.324 23.046 1.00 0.00 C ATOM 1894 CE1 TYR A 119 25.234 4.687 22.181 1.00 0.00 C ATOM 1895 CE2 TYR A 119 25.879 6.601 23.513 1.00 0.00 C ATOM 1896 CZ TYR A 119 26.105 5.291 23.089 1.00 0.00 C ATOM 1897 OH TYR A 119 27.181 4.582 23.557 1.00 0.00 O ATOM 0 H TYR A 119 20.420 8.460 22.305 1.00 0.00 H new ATOM 0 HA TYR A 119 21.277 6.193 20.630 1.00 0.00 H new ATOM 0 HB2 TYR A 119 22.964 7.937 20.643 1.00 0.00 H new ATOM 0 HB3 TYR A 119 22.584 8.409 22.287 1.00 0.00 H new ATOM 0 HD1 TYR A 119 23.462 4.992 21.025 1.00 0.00 H new ATOM 0 HD2 TYR A 119 24.635 8.337 23.387 1.00 0.00 H new ATOM 0 HE1 TYR A 119 25.392 3.674 21.840 1.00 0.00 H new ATOM 0 HE2 TYR A 119 26.560 7.058 24.215 1.00 0.00 H new ATOM 0 HH TYR A 119 26.875 3.912 24.203 1.00 0.00 H new ATOM 1907 N GLU A 120 21.301 6.763 23.905 1.00 0.00 N ATOM 1908 CA GLU A 120 21.246 6.302 25.253 1.00 0.00 C ATOM 1909 C GLU A 120 20.082 6.909 26.056 1.00 0.00 C ATOM 1910 O GLU A 120 19.228 6.159 26.558 1.00 0.00 O ATOM 1911 CB GLU A 120 22.657 6.558 25.855 1.00 0.00 C ATOM 1912 CG GLU A 120 23.402 5.305 26.350 1.00 0.00 C ATOM 1913 CD GLU A 120 24.616 5.574 27.225 1.00 0.00 C ATOM 1914 OE1 GLU A 120 24.755 6.520 27.991 1.00 0.00 O ATOM 1915 OE2 GLU A 120 25.589 4.689 27.121 1.00 0.00 O ATOM 0 H GLU A 120 21.340 7.780 23.843 1.00 0.00 H new ATOM 0 HA GLU A 120 21.017 5.237 25.297 1.00 0.00 H new ATOM 0 HB2 GLU A 120 23.271 7.051 25.101 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.557 7.253 26.689 1.00 0.00 H new ATOM 0 HG2 GLU A 120 22.702 4.684 26.909 1.00 0.00 H new ATOM 0 HG3 GLU A 120 23.721 4.726 25.483 1.00 0.00 H new ATOM 1922 N GLY A 121 19.999 8.255 26.219 1.00 0.00 N ATOM 1923 CA GLY A 121 18.941 8.946 26.970 1.00 0.00 C ATOM 1924 C GLY A 121 18.687 10.430 26.767 1.00 0.00 C ATOM 1925 O GLY A 121 18.019 11.106 27.550 1.00 0.00 O ATOM 0 H GLY A 121 20.685 8.896 25.820 1.00 0.00 H new ATOM 0 HA2 GLY A 121 18.006 8.429 26.756 1.00 0.00 H new ATOM 0 HA3 GLY A 121 19.151 8.799 28.029 1.00 0.00 H new ATOM 1929 N VAL A 122 19.203 10.991 25.706 1.00 0.00 N ATOM 1930 CA VAL A 122 19.066 12.407 25.321 1.00 0.00 C ATOM 1931 C VAL A 122 18.591 12.335 23.876 1.00 0.00 C ATOM 1932 O VAL A 122 19.418 12.060 23.004 1.00 0.00 O ATOM 1933 CB VAL A 122 20.405 13.124 25.333 1.00 0.00 C ATOM 1934 CG1 VAL A 122 20.319 14.534 24.776 1.00 0.00 C ATOM 1935 CG2 VAL A 122 20.870 13.319 26.769 1.00 0.00 C ATOM 0 H VAL A 122 19.764 10.461 25.039 1.00 0.00 H new ATOM 0 HA VAL A 122 18.404 12.943 26.001 1.00 0.00 H new ATOM 0 HB VAL A 122 21.073 12.507 24.732 1.00 0.00 H new ATOM 0 HG11 VAL A 122 21.304 14.999 24.809 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.969 14.497 23.744 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.621 15.120 25.375 1.00 0.00 H new ATOM 0 HG21 VAL A 122 21.831 13.834 26.774 1.00 0.00 H new ATOM 0 HG22 VAL A 122 20.136 13.915 27.311 1.00 0.00 H new ATOM 0 HG23 VAL A 122 20.976 12.348 27.252 1.00 0.00 H new ATOM 1945 N GLU A 123 17.305 12.558 23.620 1.00 0.00 N ATOM 1946 CA GLU A 123 16.845 12.450 22.249 1.00 0.00 C ATOM 1947 C GLU A 123 17.389 13.563 21.372 1.00 0.00 C ATOM 1948 O GLU A 123 18.208 14.382 21.740 1.00 0.00 O ATOM 1949 CB GLU A 123 15.340 12.542 22.151 1.00 0.00 C ATOM 1950 CG GLU A 123 14.879 13.985 22.524 1.00 0.00 C ATOM 1951 CD GLU A 123 14.099 14.668 21.424 1.00 0.00 C ATOM 1952 OE1 GLU A 123 14.371 14.587 20.219 1.00 0.00 O ATOM 1953 OE2 GLU A 123 13.098 15.353 21.973 1.00 0.00 O ATOM 0 H GLU A 123 16.596 12.803 24.311 1.00 0.00 H new ATOM 0 HA GLU A 123 17.204 11.478 21.910 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.015 12.296 21.140 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.877 11.817 22.820 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.264 13.941 23.423 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.755 14.587 22.766 1.00 0.00 H new ATOM 1960 N ALA A 124 16.910 13.603 20.135 1.00 0.00 N ATOM 1961 CA ALA A 124 17.367 14.627 19.234 1.00 0.00 C ATOM 1962 C ALA A 124 16.463 14.689 18.018 1.00 0.00 C ATOM 1963 O ALA A 124 16.742 13.891 17.133 1.00 0.00 O ATOM 1964 CB ALA A 124 18.784 14.258 18.787 1.00 0.00 C ATOM 0 H ALA A 124 16.224 12.953 19.750 1.00 0.00 H new ATOM 0 HA ALA A 124 17.355 15.597 19.731 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.159 15.018 18.101 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.437 14.202 19.658 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.767 13.291 18.283 1.00 0.00 H new ATOM 1970 N LYS A 125 15.460 15.581 18.010 1.00 0.00 N ATOM 1971 CA LYS A 125 14.525 15.767 16.927 1.00 0.00 C ATOM 1972 C LYS A 125 15.133 16.552 15.782 1.00 0.00 C ATOM 1973 O LYS A 125 15.896 17.487 16.089 1.00 0.00 O ATOM 1974 CB LYS A 125 13.439 16.771 17.324 1.00 0.00 C ATOM 1975 CG LYS A 125 12.100 16.256 17.733 1.00 0.00 C ATOM 1976 CD LYS A 125 11.962 16.435 19.248 1.00 0.00 C ATOM 1977 CE LYS A 125 10.511 16.766 19.574 1.00 0.00 C ATOM 1978 NZ LYS A 125 10.238 16.696 21.037 1.00 0.00 N ATOM 0 H LYS A 125 15.285 16.209 18.795 1.00 0.00 H new ATOM 0 HA LYS A 125 14.196 14.757 16.681 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.828 17.370 18.148 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.290 17.446 16.482 1.00 0.00 H new ATOM 0 HG2 LYS A 125 11.309 16.797 17.213 1.00 0.00 H new ATOM 0 HG3 LYS A 125 11.998 15.205 17.463 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.267 15.525 19.765 1.00 0.00 H new ATOM 0 HD3 LYS A 125 12.618 17.233 19.595 1.00 0.00 H new ATOM 0 HE2 LYS A 125 10.276 17.766 19.209 1.00 0.00 H new ATOM 0 HE3 LYS A 125 9.854 16.073 19.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 9.403 16.100 21.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.060 16.286 21.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 10.060 17.653 21.403 1.00 0.00 H new ATOM 1992 N ARG A 126 14.776 16.182 14.550 1.00 0.00 N ATOM 1993 CA ARG A 126 15.152 16.776 13.294 1.00 0.00 C ATOM 1994 C ARG A 126 13.828 16.976 12.550 1.00 0.00 C ATOM 1995 O ARG A 126 13.469 16.140 11.757 1.00 0.00 O ATOM 1996 CB ARG A 126 16.181 16.069 12.463 1.00 0.00 C ATOM 1997 CG ARG A 126 17.318 15.577 13.317 1.00 0.00 C ATOM 1998 CD ARG A 126 17.210 14.149 13.815 1.00 0.00 C ATOM 1999 NE ARG A 126 17.774 13.124 12.938 1.00 0.00 N ATOM 2000 CZ ARG A 126 17.796 11.825 13.170 1.00 0.00 C ATOM 2001 NH1 ARG A 126 17.298 11.473 14.392 1.00 0.00 N ATOM 2002 NH2 ARG A 126 18.357 10.845 12.459 1.00 0.00 N ATOM 0 H ARG A 126 14.158 15.383 14.409 1.00 0.00 H new ATOM 0 HA ARG A 126 15.691 17.701 13.499 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.720 15.228 11.945 1.00 0.00 H new ATOM 0 HB3 ARG A 126 16.562 16.745 11.697 1.00 0.00 H new ATOM 0 HG2 ARG A 126 18.242 15.672 12.746 1.00 0.00 H new ATOM 0 HG3 ARG A 126 17.408 16.236 14.181 1.00 0.00 H new ATOM 0 HD2 ARG A 126 17.705 14.084 14.784 1.00 0.00 H new ATOM 0 HD3 ARG A 126 16.157 13.920 13.979 1.00 0.00 H new ATOM 0 HE ARG A 126 18.190 13.443 12.063 1.00 0.00 H new ATOM 0 HH11 ARG A 126 16.953 12.192 15.028 1.00 0.00 H new ATOM 0 HH12 ARG A 126 17.271 10.491 14.668 1.00 0.00 H new ATOM 0 HH21 ARG A 126 18.859 11.062 11.598 1.00 0.00 H new ATOM 0 HH22 ARG A 126 18.284 9.878 12.777 1.00 0.00 H new ATOM 2016 N ILE A 127 13.225 18.126 12.912 1.00 0.00 N ATOM 2017 CA ILE A 127 11.932 18.499 12.298 1.00 0.00 C ATOM 2018 C ILE A 127 12.193 18.883 10.834 1.00 0.00 C ATOM 2019 O ILE A 127 12.520 20.046 10.562 1.00 0.00 O ATOM 2020 CB ILE A 127 11.258 19.711 12.907 1.00 0.00 C ATOM 2021 CG1 ILE A 127 11.123 19.651 14.416 1.00 0.00 C ATOM 2022 CG2 ILE A 127 9.941 19.909 12.172 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.639 18.322 14.924 1.00 0.00 C ATOM 0 H ILE A 127 13.591 18.788 13.596 1.00 0.00 H new ATOM 0 HA ILE A 127 11.284 17.635 12.445 1.00 0.00 H new ATOM 0 HB ILE A 127 11.889 20.589 12.771 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.090 19.873 14.868 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.432 20.429 14.742 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.422 20.776 12.582 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.137 20.071 11.112 1.00 0.00 H new ATOM 0 HG23 ILE A 127 9.319 19.022 12.295 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.566 18.353 16.011 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.658 18.106 14.501 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.341 17.542 14.629 1.00 0.00 H new ATOM 2035 N PHE A 128 12.052 17.887 9.941 1.00 0.00 N ATOM 2036 CA PHE A 128 12.299 18.141 8.560 1.00 0.00 C ATOM 2037 C PHE A 128 11.067 18.622 7.800 1.00 0.00 C ATOM 2038 O PHE A 128 9.915 18.314 8.065 1.00 0.00 O ATOM 2039 CB PHE A 128 13.059 17.068 7.706 1.00 0.00 C ATOM 2040 CG PHE A 128 13.608 17.768 6.468 1.00 0.00 C ATOM 2041 CD1 PHE A 128 14.545 18.764 6.662 1.00 0.00 C ATOM 2042 CD2 PHE A 128 13.174 17.469 5.194 1.00 0.00 C ATOM 2043 CE1 PHE A 128 15.102 19.494 5.627 1.00 0.00 C ATOM 2044 CE2 PHE A 128 13.728 18.219 4.162 1.00 0.00 C ATOM 2045 CZ PHE A 128 14.671 19.211 4.347 1.00 0.00 C ATOM 0 H PHE A 128 11.775 16.932 10.168 1.00 0.00 H new ATOM 0 HA PHE A 128 13.028 18.944 8.669 1.00 0.00 H new ATOM 0 HB2 PHE A 128 13.868 16.622 8.284 1.00 0.00 H new ATOM 0 HB3 PHE A 128 12.387 16.259 7.422 1.00 0.00 H new ATOM 0 HD1 PHE A 128 14.859 18.984 7.672 1.00 0.00 H new ATOM 0 HD2 PHE A 128 12.444 16.695 5.008 1.00 0.00 H new ATOM 0 HE1 PHE A 128 15.845 20.255 5.814 1.00 0.00 H new ATOM 0 HE2 PHE A 128 13.401 18.013 3.154 1.00 0.00 H new ATOM 0 HZ PHE A 128 15.065 19.757 3.503 1.00 0.00 H new ATOM 2055 N LYS A 129 11.412 19.453 6.812 1.00 0.00 N ATOM 2056 CA LYS A 129 10.453 20.112 5.971 1.00 0.00 C ATOM 2057 C LYS A 129 10.254 19.453 4.631 1.00 0.00 C ATOM 2058 O LYS A 129 9.833 20.195 3.727 1.00 0.00 O ATOM 2059 CB LYS A 129 11.150 21.453 5.685 1.00 0.00 C ATOM 2060 CG LYS A 129 11.690 22.135 6.902 1.00 0.00 C ATOM 2061 CD LYS A 129 10.886 23.398 7.239 1.00 0.00 C ATOM 2062 CE LYS A 129 11.183 24.464 6.184 1.00 0.00 C ATOM 2063 NZ LYS A 129 10.039 24.696 5.274 1.00 0.00 N ATOM 0 H LYS A 129 12.380 19.679 6.585 1.00 0.00 H new ATOM 0 HA LYS A 129 9.476 20.136 6.455 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.968 21.283 4.985 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.442 22.120 5.192 1.00 0.00 H new ATOM 0 HG2 LYS A 129 11.663 21.448 7.748 1.00 0.00 H new ATOM 0 HG3 LYS A 129 12.735 22.400 6.739 1.00 0.00 H new ATOM 0 HD2 LYS A 129 9.820 23.173 7.259 1.00 0.00 H new ATOM 0 HD3 LYS A 129 11.154 23.763 8.231 1.00 0.00 H new ATOM 0 HE2 LYS A 129 11.444 25.399 6.680 1.00 0.00 H new ATOM 0 HE3 LYS A 129 12.052 24.160 5.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 10.163 24.132 4.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.157 24.415 5.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 9.992 25.705 5.026 1.00 0.00 H new ATOM 2077 N LYS A 130 10.495 18.165 4.427 1.00 0.00 N ATOM 2078 CA LYS A 130 10.280 17.487 3.145 1.00 0.00 C ATOM 2079 C LYS A 130 10.750 18.216 1.913 1.00 0.00 C ATOM 2080 O LYS A 130 9.997 19.063 1.407 1.00 0.00 O ATOM 2081 CB LYS A 130 8.771 17.208 2.912 1.00 0.00 C ATOM 2082 CG LYS A 130 8.509 16.629 1.538 1.00 0.00 C ATOM 2083 CD LYS A 130 7.528 15.458 1.482 1.00 0.00 C ATOM 2084 CE LYS A 130 6.899 15.140 0.126 1.00 0.00 C ATOM 2085 NZ LYS A 130 6.569 13.726 -0.123 1.00 0.00 N ATOM 0 H LYS A 130 10.851 17.547 5.156 1.00 0.00 H new ATOM 0 HA LYS A 130 10.884 16.586 3.255 1.00 0.00 H new ATOM 0 HB2 LYS A 130 8.408 16.517 3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 130 8.208 18.134 3.029 1.00 0.00 H new ATOM 0 HG2 LYS A 130 8.132 17.425 0.896 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.459 16.302 1.116 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.047 14.565 1.832 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.723 15.657 2.190 1.00 0.00 H new ATOM 0 HE2 LYS A 130 5.986 15.727 0.026 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.581 15.475 -0.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.150 13.629 -1.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 7.435 13.152 -0.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 5.889 13.397 0.592 1.00 0.00 H new ATOM 2099 N GLU A 131 11.912 18.003 1.318 1.00 0.00 N ATOM 2100 CA GLU A 131 12.265 18.757 0.134 1.00 0.00 C ATOM 2101 C GLU A 131 13.368 19.773 0.361 1.00 0.00 C ATOM 2102 O GLU A 131 13.474 20.677 -0.463 1.00 0.00 O ATOM 2103 CB GLU A 131 11.323 19.093 -1.020 1.00 0.00 C ATOM 2104 CG GLU A 131 12.039 18.815 -2.344 1.00 0.00 C ATOM 2105 CD GLU A 131 11.298 19.305 -3.540 1.00 0.00 C ATOM 2106 OE1 GLU A 131 10.456 18.362 -3.952 1.00 0.00 O ATOM 2107 OE2 GLU A 131 11.433 20.406 -4.060 1.00 0.00 O ATOM 2108 OXT GLU A 131 14.077 19.638 1.342 1.00 0.00 O ATOM 0 H GLU A 131 12.611 17.329 1.629 1.00 0.00 H new ATOM 0 HA GLU A 131 12.591 17.855 -0.384 1.00 0.00 H new ATOM 0 HB2 GLU A 131 10.414 18.495 -0.951 1.00 0.00 H new ATOM 0 HB3 GLU A 131 11.021 20.139 -0.967 1.00 0.00 H new ATOM 0 HG2 GLU A 131 13.023 19.283 -2.320 1.00 0.00 H new ATOM 0 HG3 GLU A 131 12.199 17.741 -2.442 1.00 0.00 H new TER 2115 GLU A 131 HETATM 2116 C1 PLM A 132 18.858 7.199 7.707 1.00 0.00 C HETATM 2117 O1 PLM A 132 17.940 7.717 8.409 1.00 0.00 O HETATM 2118 O2 PLM A 132 19.503 7.856 6.846 1.00 0.00 O HETATM 2119 C2 PLM A 132 19.172 5.723 7.966 1.00 0.00 C HETATM 2120 C3 PLM A 132 20.085 5.420 9.182 1.00 0.00 C HETATM 2121 C4 PLM A 132 20.184 6.574 10.182 1.00 0.00 C HETATM 2122 C5 PLM A 132 20.959 7.789 9.646 1.00 0.00 C HETATM 2123 C6 PLM A 132 22.069 8.260 10.605 1.00 0.00 C HETATM 2124 C7 PLM A 132 23.195 8.976 9.858 1.00 0.00 C HETATM 2125 C8 PLM A 132 24.024 9.967 10.706 1.00 0.00 C HETATM 2126 C9 PLM A 132 25.042 10.764 9.873 1.00 0.00 C HETATM 2127 CA PLM A 132 25.901 11.760 10.686 1.00 0.00 C HETATM 2128 CB PLM A 132 26.326 13.031 9.931 1.00 0.00 C HETATM 2129 CC PLM A 132 27.234 13.973 10.732 1.00 0.00 C HETATM 2130 CD PLM A 132 28.580 13.328 11.117 1.00 0.00 C HETATM 2131 CE PLM A 132 29.544 14.208 11.927 1.00 0.00 C HETATM 2132 CF PLM A 132 30.181 13.555 13.171 1.00 0.00 C HETATM 2133 CG PLM A 132 29.154 12.782 14.009 1.00 0.00 C HETATM 0 HG3 PLM A 132 28.373 13.463 14.347 1.00 0.00 H new HETATM 0 HG2 PLM A 132 28.710 11.993 13.403 1.00 0.00 H new HETATM 0 HG1 PLM A 132 29.649 12.340 14.874 1.00 0.00 H new HETATM 0 HF2 PLM A 132 30.975 12.878 12.857 1.00 0.00 H new HETATM 0 HF1 PLM A 132 30.644 14.326 13.787 1.00 0.00 H new HETATM 0 HE2 PLM A 132 30.345 14.538 11.265 1.00 0.00 H new HETATM 0 HE1 PLM A 132 29.006 15.101 12.246 1.00 0.00 H new HETATM 0 HD2 PLM A 132 28.376 12.424 11.691 1.00 0.00 H new HETATM 0 HD1 PLM A 132 29.085 13.017 10.203 1.00 0.00 H new HETATM 0 HC2 PLM A 132 27.423 14.872 10.146 1.00 0.00 H new HETATM 0 HC1 PLM A 132 26.715 14.286 11.638 1.00 0.00 H new HETATM 0 HB2 PLM A 132 26.843 12.740 9.017 1.00 0.00 H new HETATM 0 HB1 PLM A 132 25.431 13.577 9.632 1.00 0.00 H new HETATM 0 HA2 PLM A 132 25.343 12.055 11.574 1.00 0.00 H new HETATM 0 HA1 PLM A 132 26.798 11.244 11.030 1.00 0.00 H new HETATM 0 H92 PLM A 132 25.705 10.063 9.366 1.00 0.00 H new HETATM 0 H91 PLM A 132 24.507 11.314 9.099 1.00 0.00 H new HETATM 0 H82 PLM A 132 23.349 10.661 11.207 1.00 0.00 H new HETATM 0 H81 PLM A 132 24.551 9.417 11.485 1.00 0.00 H new HETATM 0 H72 PLM A 132 23.869 8.226 9.444 1.00 0.00 H new HETATM 0 H71 PLM A 132 22.764 9.517 9.016 1.00 0.00 H new HETATM 0 H62 PLM A 132 21.644 8.930 11.352 1.00 0.00 H new HETATM 0 H61 PLM A 132 22.475 7.402 11.141 1.00 0.00 H new HETATM 0 H52 PLM A 132 21.401 7.536 8.682 1.00 0.00 H new HETATM 0 H51 PLM A 132 20.263 8.610 9.472 1.00 0.00 H new HETATM 0 H42 PLM A 132 19.179 6.889 10.461 1.00 0.00 H new HETATM 0 H41 PLM A 132 20.669 6.216 11.090 1.00 0.00 H new HETATM 0 H32 PLM A 132 19.707 4.537 9.697 1.00 0.00 H new HETATM 0 H31 PLM A 132 21.085 5.176 8.822 1.00 0.00 H new HETATM 0 H22 PLM A 132 18.230 5.192 8.104 1.00 0.00 H new HETATM 0 H21 PLM A 132 19.643 5.311 7.073 1.00 0.00 H new HETATM 0 H PLM A 132 17.303 7.023 8.678 1.00 0.00 H new