USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1184 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 THR OG1 : rot 100:sc= -0.745 USER MOD Set 1.2: A 140 LYS NZ :NH3+ 169:sc= -3.18! (180deg=-2.56) USER MOD Set 2.1: A 56 ASN : amide:sc= 0 K(o=-3.7,f=-7.7!) USER MOD Set 2.2: A 120 GLN : amide:sc= -3.72! C(o=-3.7!,f=-5.4!) USER MOD Set 3.1: A 83 MET CE :methyl -164:sc= -1.23 (180deg=-1.46!) USER MOD Set 3.2: A 85 TYR OH : rot 180:sc= -0.899 USER MOD Set 4.1: A 55 GLN : amide:sc= -3.69! C(o=-14!,f=-11!) USER MOD Set 4.2: A 114 GLN : amide:sc= -10.8! C(o=-14!,f=-11!) USER MOD Set 5.1: A 38 GLN : amide:sc= -3.03! C(o=-2.1!,f=-4!) USER MOD Set 5.2: A 44 SER OG : rot 18:sc= 0.898! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= 0.0143 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.846 K(o=-0.85,f=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 9 LYS NZ :NH3+ 176:sc= -2.01 (180deg=-2.14) USER MOD Single : A 11 LYS NZ :NH3+ -140:sc= 0.552 (180deg=-0.619) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 159:sc= -0.0432 (180deg=-0.455) USER MOD Single : A 30 TYR OH : rot 30:sc= -3.16! USER MOD Single : A 35 THR OG1 : rot 180:sc=-0.00484 USER MOD Single : A 40 ASN : amide:sc= -0.811 K(o=-0.81,f=-2.3!) USER MOD Single : A 49 ASN : amide:sc= -1.12 K(o=-1.1,f=-1.9!) USER MOD Single : A 51 SER OG : rot -160:sc= -0.807 USER MOD Single : A 58 SER OG : rot 38:sc= -0.611 USER MOD Single : A 62 HIS : no HE2:sc= -3.24 K(o=-3.2,f=-8!) USER MOD Single : A 63 THR OG1 : rot -72:sc= 0.451 USER MOD Single : A 69 ASN : amide:sc= -2.73! K(o=-2.7!,f=-0.98) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -11.6! C(o=-12!,f=-9.4!) USER MOD Single : A 73 THR OG1 : rot 100:sc= 0.865 USER MOD Single : A 74 ASN : amide:sc= -0.71 K(o=-0.71,f=-9.3!) USER MOD Single : A 76 LYS NZ :NH3+ 140:sc= 1 (180deg=-1.77) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -120:sc= -0.0909 USER MOD Single : A 87 LYS NZ :NH3+ 145:sc= -0.0289 (180deg=-0.5) USER MOD Single : A 90 ASN : amide:sc= -7.01! K(o=-7!,f=-1.1) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.461 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 172:sc= -0.317 (180deg=-0.366) USER MOD Single : A 98 THR OG1 : rot -77:sc= 0.0408 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.114) USER MOD Single : A 106 THR OG1 : rot -90:sc= -1.35 USER MOD Single : A 115 LYS NZ :NH3+ 156:sc= -0.307 (180deg=-1.21!) USER MOD Single : A 117 LYS NZ :NH3+ -168:sc=-0.000135 (180deg=-0.138) USER MOD Single : A 119 LYS NZ :NH3+ 163:sc= -0.0024 (180deg=-0.355) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 CYS SG : rot 5:sc= 0.0854 USER MOD Single : A 129 TYR OH : rot 143:sc= -0.895 USER MOD Single : A 130 ASN : amide:sc= -2.26 K(o=-2.3,f=-3!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0073 USER MOD Single : A 138 LYS NZ :NH3+ 159:sc= -1.57! (180deg=-2.26) USER MOD Single : A 145 THR OG1 : rot 30:sc=0.000662 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.904 3.307 11.737 1.00 0.00 N ATOM 2 CA MET A 1 19.658 4.052 12.076 1.00 0.00 C ATOM 3 C MET A 1 18.807 4.224 10.815 1.00 0.00 C ATOM 4 O MET A 1 19.318 4.466 9.738 1.00 0.00 O ATOM 5 CB MET A 1 20.024 5.427 12.637 1.00 0.00 C ATOM 6 CG MET A 1 18.780 6.079 13.243 1.00 0.00 C ATOM 7 SD MET A 1 18.380 5.271 14.813 1.00 0.00 S ATOM 8 CE MET A 1 19.381 6.338 15.876 1.00 0.00 C ATOM 0 H1 MET A 1 21.671 3.606 12.372 1.00 0.00 H new ATOM 0 H2 MET A 1 20.740 2.286 11.849 1.00 0.00 H new ATOM 0 H3 MET A 1 21.172 3.508 10.752 1.00 0.00 H new ATOM 0 HA MET A 1 19.092 3.494 12.822 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.801 5.327 13.395 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.429 6.058 11.846 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.955 7.143 13.403 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.940 5.995 12.554 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.282 6.015 16.912 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.426 6.275 15.574 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.038 7.369 15.783 1.00 0.00 H new ATOM 20 N GLN A 2 17.513 4.102 10.938 1.00 0.00 N ATOM 21 CA GLN A 2 16.632 4.261 9.746 1.00 0.00 C ATOM 22 C GLN A 2 16.448 5.748 9.446 1.00 0.00 C ATOM 23 O GLN A 2 15.547 6.387 9.952 1.00 0.00 O ATOM 24 CB GLN A 2 15.268 3.628 10.030 1.00 0.00 C ATOM 25 CG GLN A 2 15.456 2.168 10.451 1.00 0.00 C ATOM 26 CD GLN A 2 14.126 1.609 10.961 1.00 0.00 C ATOM 27 OE1 GLN A 2 14.106 0.682 11.746 1.00 0.00 O ATOM 28 NE2 GLN A 2 13.008 2.138 10.547 1.00 0.00 N ATOM 0 H GLN A 2 17.028 3.899 11.812 1.00 0.00 H new ATOM 0 HA GLN A 2 17.090 3.769 8.888 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.756 4.181 10.818 1.00 0.00 H new ATOM 0 HB3 GLN A 2 14.639 3.683 9.142 1.00 0.00 H new ATOM 0 HG2 GLN A 2 15.811 1.578 9.606 1.00 0.00 H new ATOM 0 HG3 GLN A 2 16.215 2.098 11.230 1.00 0.00 H new ATOM 0 HE21 GLN A 2 13.025 2.916 9.888 1.00 0.00 H new ATOM 0 HE22 GLN A 2 12.116 1.773 10.882 1.00 0.00 H new ATOM 37 N ALA A 3 17.298 6.309 8.625 1.00 0.00 N ATOM 38 CA ALA A 3 17.176 7.759 8.290 1.00 0.00 C ATOM 39 C ALA A 3 16.289 7.926 7.055 1.00 0.00 C ATOM 40 O ALA A 3 16.611 7.459 5.980 1.00 0.00 O ATOM 41 CB ALA A 3 18.565 8.329 7.998 1.00 0.00 C ATOM 0 H ALA A 3 18.073 5.824 8.172 1.00 0.00 H new ATOM 0 HA ALA A 3 16.731 8.291 9.131 1.00 0.00 H new ATOM 0 HB1 ALA A 3 18.480 9.388 7.753 1.00 0.00 H new ATOM 0 HB2 ALA A 3 19.199 8.210 8.876 1.00 0.00 H new ATOM 0 HB3 ALA A 3 19.007 7.796 7.156 1.00 0.00 H new ATOM 47 N LYS A 4 15.174 8.590 7.202 1.00 0.00 N ATOM 48 CA LYS A 4 14.261 8.791 6.041 1.00 0.00 C ATOM 49 C LYS A 4 15.085 9.237 4.809 1.00 0.00 C ATOM 50 O LYS A 4 15.616 10.329 4.795 1.00 0.00 O ATOM 51 CB LYS A 4 13.237 9.878 6.400 1.00 0.00 C ATOM 52 CG LYS A 4 13.906 10.945 7.270 1.00 0.00 C ATOM 53 CD LYS A 4 13.018 12.190 7.330 1.00 0.00 C ATOM 54 CE LYS A 4 13.685 13.253 8.204 1.00 0.00 C ATOM 55 NZ LYS A 4 13.025 14.569 7.975 1.00 0.00 N ATOM 0 H LYS A 4 14.856 9.003 8.079 1.00 0.00 H new ATOM 0 HA LYS A 4 13.744 7.860 5.807 1.00 0.00 H new ATOM 0 HB2 LYS A 4 12.839 10.331 5.492 1.00 0.00 H new ATOM 0 HB3 LYS A 4 12.394 9.437 6.932 1.00 0.00 H new ATOM 0 HG2 LYS A 4 14.073 10.557 8.275 1.00 0.00 H new ATOM 0 HG3 LYS A 4 14.883 11.202 6.861 1.00 0.00 H new ATOM 0 HD2 LYS A 4 12.854 12.581 6.326 1.00 0.00 H new ATOM 0 HD3 LYS A 4 12.040 11.932 7.736 1.00 0.00 H new ATOM 0 HE2 LYS A 4 13.610 12.974 9.255 1.00 0.00 H new ATOM 0 HE3 LYS A 4 14.747 13.320 7.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 13.478 15.293 8.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 13.118 14.835 6.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 12.017 14.500 8.222 1.00 0.00 H new ATOM 69 N PRO A 5 15.202 8.415 3.780 1.00 0.00 N ATOM 70 CA PRO A 5 15.985 8.779 2.560 1.00 0.00 C ATOM 71 C PRO A 5 15.202 9.727 1.635 1.00 0.00 C ATOM 72 O PRO A 5 14.519 10.622 2.093 1.00 0.00 O ATOM 73 CB PRO A 5 16.252 7.414 1.911 1.00 0.00 C ATOM 74 CG PRO A 5 15.055 6.596 2.257 1.00 0.00 C ATOM 75 CD PRO A 5 14.615 7.062 3.651 1.00 0.00 C ATOM 0 HA PRO A 5 16.900 9.329 2.781 1.00 0.00 H new ATOM 0 HB2 PRO A 5 16.372 7.504 0.831 1.00 0.00 H new ATOM 0 HB3 PRO A 5 17.166 6.963 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 5 14.258 6.741 1.527 1.00 0.00 H new ATOM 0 HG3 PRO A 5 15.296 5.533 2.259 1.00 0.00 H new ATOM 0 HD2 PRO A 5 13.529 7.088 3.738 1.00 0.00 H new ATOM 0 HD3 PRO A 5 14.981 6.393 4.429 1.00 0.00 H new ATOM 83 N GLN A 6 15.307 9.560 0.347 1.00 0.00 N ATOM 84 CA GLN A 6 14.587 10.472 -0.587 1.00 0.00 C ATOM 85 C GLN A 6 13.071 10.294 -0.451 1.00 0.00 C ATOM 86 O GLN A 6 12.464 9.485 -1.125 1.00 0.00 O ATOM 87 CB GLN A 6 15.008 10.157 -2.024 1.00 0.00 C ATOM 88 CG GLN A 6 14.292 11.105 -2.988 1.00 0.00 C ATOM 89 CD GLN A 6 14.868 10.934 -4.396 1.00 0.00 C ATOM 90 OE1 GLN A 6 15.970 10.449 -4.559 1.00 0.00 O ATOM 91 NE2 GLN A 6 14.163 11.315 -5.426 1.00 0.00 N ATOM 0 H GLN A 6 15.861 8.830 -0.101 1.00 0.00 H new ATOM 0 HA GLN A 6 14.842 11.503 -0.340 1.00 0.00 H new ATOM 0 HB2 GLN A 6 16.088 10.263 -2.129 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.764 9.123 -2.267 1.00 0.00 H new ATOM 0 HG2 GLN A 6 13.222 10.895 -2.993 1.00 0.00 H new ATOM 0 HG3 GLN A 6 14.413 12.136 -2.657 1.00 0.00 H new ATOM 0 HE21 GLN A 6 13.238 11.722 -5.288 1.00 0.00 H new ATOM 0 HE22 GLN A 6 14.537 11.206 -6.369 1.00 0.00 H new ATOM 100 N ILE A 7 12.455 11.070 0.407 1.00 0.00 N ATOM 101 CA ILE A 7 10.972 10.993 0.596 1.00 0.00 C ATOM 102 C ILE A 7 10.465 12.412 0.897 1.00 0.00 C ATOM 103 O ILE A 7 10.486 12.843 2.032 1.00 0.00 O ATOM 104 CB ILE A 7 10.622 10.100 1.800 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.260 8.710 1.644 1.00 0.00 C ATOM 106 CG2 ILE A 7 9.093 9.960 1.896 1.00 0.00 C ATOM 107 CD1 ILE A 7 11.039 7.897 2.922 1.00 0.00 C ATOM 0 H ILE A 7 12.923 11.762 0.992 1.00 0.00 H new ATOM 0 HA ILE A 7 10.515 10.577 -0.302 1.00 0.00 H new ATOM 0 HB ILE A 7 11.011 10.559 2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.822 8.192 0.791 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.327 8.809 1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.838 9.328 2.747 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.645 10.945 2.028 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.711 9.507 0.981 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.492 6.912 2.809 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.498 8.413 3.765 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.970 7.786 3.102 1.00 0.00 H new ATOM 119 N PRO A 8 10.020 13.145 -0.099 1.00 0.00 N ATOM 120 CA PRO A 8 9.519 14.538 0.103 1.00 0.00 C ATOM 121 C PRO A 8 8.545 14.646 1.282 1.00 0.00 C ATOM 122 O PRO A 8 8.072 13.655 1.800 1.00 0.00 O ATOM 123 CB PRO A 8 8.822 14.868 -1.223 1.00 0.00 C ATOM 124 CG PRO A 8 9.529 14.032 -2.241 1.00 0.00 C ATOM 125 CD PRO A 8 9.943 12.746 -1.519 1.00 0.00 C ATOM 0 HA PRO A 8 10.325 15.229 0.349 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.759 14.628 -1.182 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.901 15.929 -1.458 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.877 13.812 -3.086 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.400 14.554 -2.638 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.214 11.950 -1.671 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.901 12.375 -1.882 1.00 0.00 H new ATOM 133 N LYS A 9 8.247 15.850 1.702 1.00 0.00 N ATOM 134 CA LYS A 9 7.304 16.057 2.846 1.00 0.00 C ATOM 135 C LYS A 9 6.041 16.747 2.330 1.00 0.00 C ATOM 136 O LYS A 9 5.035 16.817 3.008 1.00 0.00 O ATOM 137 CB LYS A 9 7.975 16.947 3.898 1.00 0.00 C ATOM 138 CG LYS A 9 9.038 16.143 4.674 1.00 0.00 C ATOM 139 CD LYS A 9 8.388 15.371 5.846 1.00 0.00 C ATOM 140 CE LYS A 9 8.427 16.215 7.128 1.00 0.00 C ATOM 141 NZ LYS A 9 8.018 17.614 6.818 1.00 0.00 N ATOM 0 H LYS A 9 8.621 16.708 1.297 1.00 0.00 H new ATOM 0 HA LYS A 9 7.044 15.097 3.292 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.439 17.807 3.415 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.226 17.335 4.588 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.535 15.444 4.002 1.00 0.00 H new ATOM 0 HG3 LYS A 9 9.804 16.817 5.056 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.356 15.122 5.598 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.914 14.430 6.006 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.760 15.788 7.877 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.431 16.204 7.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.979 18.167 7.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.709 18.042 6.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.079 17.610 6.370 1.00 0.00 H new ATOM 155 N ASP A 10 6.087 17.259 1.130 1.00 0.00 N ATOM 156 CA ASP A 10 4.894 17.947 0.565 1.00 0.00 C ATOM 157 C ASP A 10 3.872 16.903 0.111 1.00 0.00 C ATOM 158 O ASP A 10 4.058 16.228 -0.881 1.00 0.00 O ATOM 159 CB ASP A 10 5.316 18.796 -0.633 1.00 0.00 C ATOM 160 CG ASP A 10 4.166 19.718 -1.037 1.00 0.00 C ATOM 161 OD1 ASP A 10 3.065 19.504 -0.556 1.00 0.00 O ATOM 162 OD2 ASP A 10 4.403 20.622 -1.821 1.00 0.00 O ATOM 0 H ASP A 10 6.901 17.230 0.516 1.00 0.00 H new ATOM 0 HA ASP A 10 4.449 18.587 1.327 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.197 19.386 -0.381 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.591 18.153 -1.469 1.00 0.00 H new ATOM 167 N LYS A 11 2.795 16.768 0.832 1.00 0.00 N ATOM 168 CA LYS A 11 1.760 15.772 0.448 1.00 0.00 C ATOM 169 C LYS A 11 1.262 16.065 -0.970 1.00 0.00 C ATOM 170 O LYS A 11 0.480 15.322 -1.527 1.00 0.00 O ATOM 171 CB LYS A 11 0.593 15.861 1.433 1.00 0.00 C ATOM 172 CG LYS A 11 1.126 15.928 2.889 1.00 0.00 C ATOM 173 CD LYS A 11 0.268 15.049 3.805 1.00 0.00 C ATOM 174 CE LYS A 11 0.765 15.165 5.248 1.00 0.00 C ATOM 175 NZ LYS A 11 2.054 14.432 5.393 1.00 0.00 N ATOM 0 H LYS A 11 2.587 17.307 1.673 1.00 0.00 H new ATOM 0 HA LYS A 11 2.187 14.770 0.474 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.008 16.744 1.217 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.059 14.995 1.316 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.164 15.595 2.920 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.111 16.959 3.243 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -0.776 15.355 3.745 1.00 0.00 H new ATOM 0 HD3 LYS A 11 0.315 14.011 3.477 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.899 16.214 5.514 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.023 14.755 5.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 2.067 13.929 6.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.153 13.747 4.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 2.843 15.108 5.360 1.00 0.00 H new ATOM 189 N SER A 12 1.710 17.150 -1.555 1.00 0.00 N ATOM 190 CA SER A 12 1.267 17.509 -2.940 1.00 0.00 C ATOM 191 C SER A 12 2.379 17.184 -3.941 1.00 0.00 C ATOM 192 O SER A 12 2.499 17.815 -4.973 1.00 0.00 O ATOM 193 CB SER A 12 0.956 19.006 -2.998 1.00 0.00 C ATOM 194 OG SER A 12 0.049 19.336 -1.953 1.00 0.00 O ATOM 0 H SER A 12 2.366 17.805 -1.131 1.00 0.00 H new ATOM 0 HA SER A 12 0.375 16.936 -3.194 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.874 19.585 -2.895 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.524 19.263 -3.965 1.00 0.00 H new ATOM 0 HG SER A 12 -0.152 20.295 -1.985 1.00 0.00 H new ATOM 200 N LYS A 13 3.191 16.200 -3.651 1.00 0.00 N ATOM 201 CA LYS A 13 4.292 15.830 -4.594 1.00 0.00 C ATOM 202 C LYS A 13 4.539 14.321 -4.521 1.00 0.00 C ATOM 203 O LYS A 13 4.497 13.721 -3.465 1.00 0.00 O ATOM 204 CB LYS A 13 5.576 16.584 -4.219 1.00 0.00 C ATOM 205 CG LYS A 13 5.418 18.091 -4.519 1.00 0.00 C ATOM 206 CD LYS A 13 6.790 18.740 -4.756 1.00 0.00 C ATOM 207 CE LYS A 13 7.584 18.778 -3.449 1.00 0.00 C ATOM 208 NZ LYS A 13 8.942 19.333 -3.710 1.00 0.00 N ATOM 0 H LYS A 13 3.140 15.636 -2.803 1.00 0.00 H new ATOM 0 HA LYS A 13 4.004 16.102 -5.609 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.796 16.438 -3.162 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.420 16.181 -4.779 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.788 18.229 -5.397 1.00 0.00 H new ATOM 0 HG3 LYS A 13 4.916 18.583 -3.686 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.342 18.178 -5.510 1.00 0.00 H new ATOM 0 HD3 LYS A 13 6.661 19.751 -5.142 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.064 19.391 -2.713 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.664 17.775 -3.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.483 19.359 -2.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.437 18.731 -4.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.856 20.297 -4.091 1.00 0.00 H new ATOM 222 N VAL A 14 4.783 13.707 -5.647 1.00 0.00 N ATOM 223 CA VAL A 14 5.022 12.236 -5.671 1.00 0.00 C ATOM 224 C VAL A 14 6.234 11.872 -4.811 1.00 0.00 C ATOM 225 O VAL A 14 7.021 12.714 -4.428 1.00 0.00 O ATOM 226 CB VAL A 14 5.288 11.789 -7.114 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.569 10.281 -7.150 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.064 12.098 -7.979 1.00 0.00 C ATOM 0 H VAL A 14 4.827 14.165 -6.557 1.00 0.00 H new ATOM 0 HA VAL A 14 4.140 11.734 -5.274 1.00 0.00 H new ATOM 0 HB VAL A 14 6.155 12.326 -7.500 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.757 9.970 -8.178 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.443 10.059 -6.538 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.706 9.741 -6.760 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.253 11.780 -9.004 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.198 11.564 -7.588 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.868 13.170 -7.962 1.00 0.00 H new ATOM 238 N ALA A 15 6.389 10.607 -4.529 1.00 0.00 N ATOM 239 CA ALA A 15 7.546 10.127 -3.717 1.00 0.00 C ATOM 240 C ALA A 15 8.036 8.810 -4.327 1.00 0.00 C ATOM 241 O ALA A 15 9.213 8.515 -4.335 1.00 0.00 O ATOM 242 CB ALA A 15 7.099 9.899 -2.267 1.00 0.00 C ATOM 0 H ALA A 15 5.751 9.872 -4.833 1.00 0.00 H new ATOM 0 HA ALA A 15 8.348 10.865 -3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.945 9.549 -1.676 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.728 10.835 -1.849 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.306 9.151 -2.244 1.00 0.00 H new ATOM 248 N GLY A 16 7.131 8.024 -4.849 1.00 0.00 N ATOM 249 CA GLY A 16 7.527 6.732 -5.475 1.00 0.00 C ATOM 250 C GLY A 16 6.408 6.262 -6.406 1.00 0.00 C ATOM 251 O GLY A 16 5.517 7.016 -6.744 1.00 0.00 O ATOM 0 H GLY A 16 6.131 8.224 -4.868 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.455 6.854 -6.034 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.715 5.983 -4.705 1.00 0.00 H new ATOM 255 N TYR A 17 6.437 5.020 -6.826 1.00 0.00 N ATOM 256 CA TYR A 17 5.363 4.520 -7.738 1.00 0.00 C ATOM 257 C TYR A 17 5.123 3.033 -7.512 1.00 0.00 C ATOM 258 O TYR A 17 6.027 2.226 -7.596 1.00 0.00 O ATOM 259 CB TYR A 17 5.778 4.724 -9.197 1.00 0.00 C ATOM 260 CG TYR A 17 6.203 6.152 -9.427 1.00 0.00 C ATOM 261 CD1 TYR A 17 7.488 6.568 -9.059 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.316 7.057 -10.022 1.00 0.00 C ATOM 263 CE1 TYR A 17 7.887 7.891 -9.285 1.00 0.00 C ATOM 264 CE2 TYR A 17 5.715 8.381 -10.246 1.00 0.00 C ATOM 265 CZ TYR A 17 7.001 8.797 -9.879 1.00 0.00 C ATOM 266 OH TYR A 17 7.394 10.100 -10.103 1.00 0.00 O ATOM 0 H TYR A 17 7.152 4.336 -6.579 1.00 0.00 H new ATOM 0 HA TYR A 17 4.451 5.077 -7.524 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.597 4.049 -9.447 1.00 0.00 H new ATOM 0 HB3 TYR A 17 4.947 4.474 -9.857 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.172 5.869 -8.601 1.00 0.00 H new ATOM 0 HD2 TYR A 17 4.326 6.735 -10.308 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.878 8.212 -9.001 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.031 9.081 -10.702 1.00 0.00 H new ATOM 0 HH TYR A 17 6.660 10.595 -10.523 1.00 0.00 H new ATOM 276 N ILE A 18 3.897 2.660 -7.260 1.00 0.00 N ATOM 277 CA ILE A 18 3.576 1.218 -7.067 1.00 0.00 C ATOM 278 C ILE A 18 3.073 0.680 -8.404 1.00 0.00 C ATOM 279 O ILE A 18 2.392 1.375 -9.132 1.00 0.00 O ATOM 280 CB ILE A 18 2.483 1.074 -6.002 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.189 -0.413 -5.751 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.206 1.764 -6.486 1.00 0.00 C ATOM 283 CD1 ILE A 18 3.430 -1.115 -5.179 1.00 0.00 C ATOM 0 H ILE A 18 3.102 3.294 -7.179 1.00 0.00 H new ATOM 0 HA ILE A 18 4.455 0.664 -6.737 1.00 0.00 H new ATOM 0 HB ILE A 18 2.825 1.536 -5.076 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.354 -0.513 -5.057 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.889 -0.893 -6.682 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.428 1.662 -5.729 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.407 2.821 -6.660 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.872 1.301 -7.414 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.206 -2.168 -5.007 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.254 -1.031 -5.887 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.712 -0.645 -4.237 1.00 0.00 H new ATOM 295 N GLU A 19 3.406 -0.535 -8.753 1.00 0.00 N ATOM 296 CA GLU A 19 2.946 -1.078 -10.067 1.00 0.00 C ATOM 297 C GLU A 19 2.666 -2.576 -9.953 1.00 0.00 C ATOM 298 O GLU A 19 3.322 -3.294 -9.226 1.00 0.00 O ATOM 299 CB GLU A 19 4.033 -0.840 -11.122 1.00 0.00 C ATOM 300 CG GLU A 19 4.636 0.555 -10.936 1.00 0.00 C ATOM 301 CD GLU A 19 5.636 0.834 -12.060 1.00 0.00 C ATOM 302 OE1 GLU A 19 5.275 0.637 -13.209 1.00 0.00 O ATOM 303 OE2 GLU A 19 6.744 1.243 -11.754 1.00 0.00 O ATOM 0 H GLU A 19 3.972 -1.171 -8.191 1.00 0.00 H new ATOM 0 HA GLU A 19 2.028 -0.569 -10.360 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.811 -1.598 -11.034 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.609 -0.933 -12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.847 1.307 -10.942 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.133 0.622 -9.968 1.00 0.00 H new ATOM 310 N ILE A 20 1.688 -3.045 -10.682 1.00 0.00 N ATOM 311 CA ILE A 20 1.334 -4.491 -10.651 1.00 0.00 C ATOM 312 C ILE A 20 0.767 -4.867 -12.034 1.00 0.00 C ATOM 313 O ILE A 20 -0.091 -4.178 -12.549 1.00 0.00 O ATOM 314 CB ILE A 20 0.271 -4.718 -9.561 1.00 0.00 C ATOM 315 CG1 ILE A 20 0.881 -4.365 -8.194 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.191 -6.191 -9.561 1.00 0.00 C ATOM 317 CD1 ILE A 20 -0.008 -4.887 -7.059 1.00 0.00 C ATOM 0 H ILE A 20 1.113 -2.478 -11.305 1.00 0.00 H new ATOM 0 HA ILE A 20 2.205 -5.107 -10.428 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.594 -4.085 -9.759 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.878 -4.798 -8.111 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.994 -3.284 -8.108 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.943 -6.337 -8.785 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.620 -6.438 -10.532 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.663 -6.840 -9.366 1.00 0.00 H new ATOM 0 HD11 ILE A 20 0.439 -4.629 -6.099 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.996 -4.434 -7.133 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -0.099 -5.970 -7.137 1.00 0.00 H new ATOM 329 N PRO A 21 1.226 -5.941 -12.644 1.00 0.00 N ATOM 330 CA PRO A 21 0.720 -6.364 -13.984 1.00 0.00 C ATOM 331 C PRO A 21 -0.657 -7.029 -13.887 1.00 0.00 C ATOM 332 O PRO A 21 -1.586 -6.663 -14.579 1.00 0.00 O ATOM 333 CB PRO A 21 1.777 -7.365 -14.461 1.00 0.00 C ATOM 334 CG PRO A 21 2.300 -7.980 -13.204 1.00 0.00 C ATOM 335 CD PRO A 21 2.259 -6.873 -12.144 1.00 0.00 C ATOM 0 HA PRO A 21 0.584 -5.522 -14.663 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.343 -8.117 -15.121 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.570 -6.869 -15.021 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.690 -8.832 -12.903 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.316 -8.349 -13.344 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.999 -7.269 -11.162 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.226 -6.381 -12.043 1.00 0.00 H new ATOM 343 N ASP A 22 -0.791 -8.001 -13.028 1.00 0.00 N ATOM 344 CA ASP A 22 -2.102 -8.690 -12.876 1.00 0.00 C ATOM 345 C ASP A 22 -3.202 -7.647 -12.684 1.00 0.00 C ATOM 346 O ASP A 22 -4.341 -7.859 -13.051 1.00 0.00 O ATOM 347 CB ASP A 22 -2.054 -9.609 -11.654 1.00 0.00 C ATOM 348 CG ASP A 22 -3.256 -10.553 -11.675 1.00 0.00 C ATOM 349 OD1 ASP A 22 -4.359 -10.071 -11.877 1.00 0.00 O ATOM 350 OD2 ASP A 22 -3.054 -11.741 -11.489 1.00 0.00 O ATOM 0 H ASP A 22 -0.047 -8.348 -12.423 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.310 -9.281 -13.768 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.128 -10.183 -11.655 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.061 -9.016 -10.740 1.00 0.00 H new ATOM 355 N ALA A 23 -2.866 -6.518 -12.112 1.00 0.00 N ATOM 356 CA ALA A 23 -3.879 -5.440 -11.884 1.00 0.00 C ATOM 357 C ALA A 23 -3.573 -4.263 -12.811 1.00 0.00 C ATOM 358 O ALA A 23 -4.227 -3.241 -12.765 1.00 0.00 O ATOM 359 CB ALA A 23 -3.800 -4.978 -10.427 1.00 0.00 C ATOM 0 H ALA A 23 -1.924 -6.294 -11.790 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.880 -5.819 -12.092 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.536 -4.192 -10.254 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.006 -5.820 -9.767 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.802 -4.592 -10.221 1.00 0.00 H new ATOM 365 N ASP A 24 -2.579 -4.405 -13.652 1.00 0.00 N ATOM 366 CA ASP A 24 -2.209 -3.305 -14.596 1.00 0.00 C ATOM 367 C ASP A 24 -2.241 -1.959 -13.866 1.00 0.00 C ATOM 368 O ASP A 24 -2.706 -0.964 -14.386 1.00 0.00 O ATOM 369 CB ASP A 24 -3.190 -3.287 -15.773 1.00 0.00 C ATOM 370 CG ASP A 24 -4.565 -2.803 -15.306 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.344 -3.630 -14.864 1.00 0.00 O ATOM 372 OD2 ASP A 24 -4.814 -1.612 -15.400 1.00 0.00 O ATOM 0 H ASP A 24 -2.003 -5.243 -13.726 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.201 -3.477 -14.973 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.814 -2.633 -16.560 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.274 -4.286 -16.202 1.00 0.00 H new ATOM 377 N ILE A 25 -1.754 -1.930 -12.655 1.00 0.00 N ATOM 378 CA ILE A 25 -1.751 -0.666 -11.858 1.00 0.00 C ATOM 379 C ILE A 25 -0.403 0.050 -12.014 1.00 0.00 C ATOM 380 O ILE A 25 0.627 -0.562 -12.214 1.00 0.00 O ATOM 381 CB ILE A 25 -2.039 -1.036 -10.382 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.554 -0.993 -10.140 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.338 -0.078 -9.410 1.00 0.00 C ATOM 384 CD1 ILE A 25 -3.878 -1.642 -8.800 1.00 0.00 C ATOM 0 H ILE A 25 -1.353 -2.737 -12.177 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.519 0.022 -12.212 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.652 -2.039 -10.200 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.904 0.039 -10.149 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.075 -1.514 -10.943 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.564 -0.370 -8.385 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.261 -0.121 -9.570 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.690 0.939 -9.584 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.954 -1.610 -8.631 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.543 -2.679 -8.807 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.369 -1.102 -8.002 1.00 0.00 H new ATOM 396 N LYS A 26 -0.423 1.353 -11.921 1.00 0.00 N ATOM 397 CA LYS A 26 0.822 2.156 -12.049 1.00 0.00 C ATOM 398 C LYS A 26 0.496 3.571 -11.577 1.00 0.00 C ATOM 399 O LYS A 26 0.157 4.432 -12.365 1.00 0.00 O ATOM 400 CB LYS A 26 1.285 2.177 -13.511 1.00 0.00 C ATOM 401 CG LYS A 26 0.069 2.259 -14.437 1.00 0.00 C ATOM 402 CD LYS A 26 0.526 2.622 -15.851 1.00 0.00 C ATOM 403 CE LYS A 26 -0.696 2.776 -16.757 1.00 0.00 C ATOM 404 NZ LYS A 26 -1.478 3.972 -16.335 1.00 0.00 N ATOM 0 H LYS A 26 -1.267 1.902 -11.759 1.00 0.00 H new ATOM 0 HA LYS A 26 1.625 1.726 -11.450 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.942 3.030 -13.682 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.863 1.280 -13.732 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.458 1.305 -14.448 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.633 3.007 -14.067 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.098 3.550 -15.833 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.186 1.848 -16.241 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.382 2.881 -17.795 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -1.318 1.883 -16.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -2.079 4.290 -17.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.076 3.726 -15.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.826 4.736 -16.067 1.00 0.00 H new ATOM 418 N GLU A 27 0.546 3.803 -10.290 1.00 0.00 N ATOM 419 CA GLU A 27 0.185 5.147 -9.747 1.00 0.00 C ATOM 420 C GLU A 27 1.210 5.588 -8.680 1.00 0.00 C ATOM 421 O GLU A 27 1.897 4.769 -8.103 1.00 0.00 O ATOM 422 CB GLU A 27 -1.207 5.017 -9.107 1.00 0.00 C ATOM 423 CG GLU A 27 -2.301 5.309 -10.142 1.00 0.00 C ATOM 424 CD GLU A 27 -2.314 6.803 -10.470 1.00 0.00 C ATOM 425 OE1 GLU A 27 -2.812 7.563 -9.657 1.00 0.00 O ATOM 426 OE2 GLU A 27 -1.826 7.161 -11.529 1.00 0.00 O ATOM 0 H GLU A 27 0.823 3.116 -9.589 1.00 0.00 H new ATOM 0 HA GLU A 27 0.185 5.893 -10.542 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.337 4.012 -8.705 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.295 5.709 -8.270 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.122 4.729 -11.048 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.273 5.003 -9.754 1.00 0.00 H new ATOM 433 N PRO A 28 1.304 6.880 -8.419 1.00 0.00 N ATOM 434 CA PRO A 28 2.252 7.440 -7.406 1.00 0.00 C ATOM 435 C PRO A 28 1.709 7.375 -5.969 1.00 0.00 C ATOM 436 O PRO A 28 0.523 7.240 -5.745 1.00 0.00 O ATOM 437 CB PRO A 28 2.386 8.897 -7.849 1.00 0.00 C ATOM 438 CG PRO A 28 1.034 9.237 -8.376 1.00 0.00 C ATOM 439 CD PRO A 28 0.524 7.963 -9.062 1.00 0.00 C ATOM 0 HA PRO A 28 3.188 6.882 -7.372 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.665 9.544 -7.017 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.154 9.013 -8.614 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.366 9.543 -7.571 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.086 10.067 -9.080 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.547 7.829 -8.911 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.693 7.993 -10.138 1.00 0.00 H new ATOM 447 N VAL A 29 2.585 7.496 -5.000 1.00 0.00 N ATOM 448 CA VAL A 29 2.162 7.474 -3.561 1.00 0.00 C ATOM 449 C VAL A 29 2.713 8.730 -2.874 1.00 0.00 C ATOM 450 O VAL A 29 3.876 9.056 -3.004 1.00 0.00 O ATOM 451 CB VAL A 29 2.730 6.226 -2.875 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.893 5.005 -3.260 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.179 6.008 -3.318 1.00 0.00 C ATOM 0 H VAL A 29 3.588 7.611 -5.146 1.00 0.00 H new ATOM 0 HA VAL A 29 1.074 7.453 -3.492 1.00 0.00 H new ATOM 0 HB VAL A 29 2.698 6.364 -1.794 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.297 4.118 -2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.862 5.156 -2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.923 4.870 -4.341 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.579 5.120 -2.828 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.213 5.873 -4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.778 6.876 -3.042 1.00 0.00 H new ATOM 463 N TYR A 30 1.889 9.452 -2.154 1.00 0.00 N ATOM 464 CA TYR A 30 2.381 10.693 -1.481 1.00 0.00 C ATOM 465 C TYR A 30 2.999 10.341 -0.112 1.00 0.00 C ATOM 466 O TYR A 30 2.563 9.412 0.543 1.00 0.00 O ATOM 467 CB TYR A 30 1.211 11.661 -1.260 1.00 0.00 C ATOM 468 CG TYR A 30 0.309 11.674 -2.475 1.00 0.00 C ATOM 469 CD1 TYR A 30 0.777 12.196 -3.686 1.00 0.00 C ATOM 470 CD2 TYR A 30 -0.997 11.174 -2.386 1.00 0.00 C ATOM 471 CE1 TYR A 30 -0.060 12.216 -4.808 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.833 11.193 -3.505 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.365 11.714 -4.719 1.00 0.00 C ATOM 474 OH TYR A 30 -2.189 11.734 -5.825 1.00 0.00 O ATOM 0 H TYR A 30 0.903 9.237 -2.004 1.00 0.00 H new ATOM 0 HA TYR A 30 3.135 11.159 -2.115 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.643 11.362 -0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.591 12.665 -1.069 1.00 0.00 H new ATOM 0 HD1 TYR A 30 1.783 12.583 -3.755 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -1.358 10.773 -1.450 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.301 12.619 -5.743 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.839 10.807 -3.435 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.647 11.659 -6.638 1.00 0.00 H new ATOM 484 N PRO A 31 3.990 11.092 0.332 1.00 0.00 N ATOM 485 CA PRO A 31 4.643 10.864 1.655 1.00 0.00 C ATOM 486 C PRO A 31 3.790 11.416 2.802 1.00 0.00 C ATOM 487 O PRO A 31 4.007 12.516 3.269 1.00 0.00 O ATOM 488 CB PRO A 31 5.948 11.651 1.533 1.00 0.00 C ATOM 489 CG PRO A 31 5.591 12.800 0.657 1.00 0.00 C ATOM 490 CD PRO A 31 4.610 12.235 -0.372 1.00 0.00 C ATOM 0 HA PRO A 31 4.787 9.807 1.879 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.305 11.986 2.507 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.741 11.045 1.094 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.136 13.606 1.232 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.475 13.214 0.172 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.867 12.976 -0.667 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.121 11.917 -1.281 1.00 0.00 H new ATOM 498 N GLY A 32 2.816 10.675 3.255 1.00 0.00 N ATOM 499 CA GLY A 32 1.963 11.193 4.360 1.00 0.00 C ATOM 500 C GLY A 32 1.114 10.077 4.961 1.00 0.00 C ATOM 501 O GLY A 32 1.255 8.921 4.617 1.00 0.00 O ATOM 0 H GLY A 32 2.576 9.745 2.912 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.591 11.634 5.134 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.316 11.986 3.984 1.00 0.00 H new ATOM 505 N PRO A 33 0.233 10.435 5.860 1.00 0.00 N ATOM 506 CA PRO A 33 -0.668 9.470 6.536 1.00 0.00 C ATOM 507 C PRO A 33 -1.889 9.152 5.677 1.00 0.00 C ATOM 508 O PRO A 33 -2.637 10.029 5.301 1.00 0.00 O ATOM 509 CB PRO A 33 -1.066 10.206 7.816 1.00 0.00 C ATOM 510 CG PRO A 33 -1.065 11.655 7.434 1.00 0.00 C ATOM 511 CD PRO A 33 -0.004 11.814 6.331 1.00 0.00 C ATOM 0 HA PRO A 33 -0.196 8.506 6.725 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.048 9.889 8.167 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.360 10.008 8.623 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.047 11.962 7.075 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.829 12.283 8.293 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.360 12.455 5.525 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.909 12.266 6.718 1.00 0.00 H new ATOM 519 N ALA A 34 -2.076 7.905 5.355 1.00 0.00 N ATOM 520 CA ALA A 34 -3.239 7.507 4.501 1.00 0.00 C ATOM 521 C ALA A 34 -4.515 8.233 4.954 1.00 0.00 C ATOM 522 O ALA A 34 -5.281 7.720 5.746 1.00 0.00 O ATOM 523 CB ALA A 34 -3.446 5.987 4.601 1.00 0.00 C ATOM 0 H ALA A 34 -1.472 7.136 5.646 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.030 7.785 3.468 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.292 5.693 3.980 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.548 5.474 4.256 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.644 5.714 5.637 1.00 0.00 H new ATOM 529 N THR A 35 -4.751 9.413 4.437 1.00 0.00 N ATOM 530 CA THR A 35 -5.983 10.184 4.803 1.00 0.00 C ATOM 531 C THR A 35 -6.913 10.226 3.581 1.00 0.00 C ATOM 532 O THR A 35 -6.457 10.176 2.455 1.00 0.00 O ATOM 533 CB THR A 35 -5.592 11.616 5.196 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.573 12.084 4.323 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.078 11.637 6.639 1.00 0.00 C ATOM 0 H THR A 35 -4.137 9.881 3.770 1.00 0.00 H new ATOM 0 HA THR A 35 -6.488 9.707 5.643 1.00 0.00 H new ATOM 0 HB THR A 35 -6.466 12.262 5.117 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.324 12.998 4.572 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.802 12.656 6.912 1.00 0.00 H new ATOM 0 HG22 THR A 35 -5.860 11.281 7.309 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.205 10.990 6.724 1.00 0.00 H new ATOM 543 N PRO A 36 -8.206 10.315 3.787 1.00 0.00 N ATOM 544 CA PRO A 36 -9.191 10.354 2.664 1.00 0.00 C ATOM 545 C PRO A 36 -9.094 11.656 1.858 1.00 0.00 C ATOM 546 O PRO A 36 -9.161 11.650 0.644 1.00 0.00 O ATOM 547 CB PRO A 36 -10.554 10.238 3.368 1.00 0.00 C ATOM 548 CG PRO A 36 -10.318 10.760 4.748 1.00 0.00 C ATOM 549 CD PRO A 36 -8.876 10.390 5.099 1.00 0.00 C ATOM 0 HA PRO A 36 -9.017 9.560 1.937 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.317 10.820 2.850 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -10.901 9.205 3.390 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.464 11.839 4.787 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.018 10.318 5.457 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.415 11.140 5.742 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.824 9.440 5.630 1.00 0.00 H new ATOM 557 N GLU A 37 -8.938 12.768 2.519 1.00 0.00 N ATOM 558 CA GLU A 37 -8.837 14.060 1.783 1.00 0.00 C ATOM 559 C GLU A 37 -7.583 14.049 0.908 1.00 0.00 C ATOM 560 O GLU A 37 -7.477 14.789 -0.050 1.00 0.00 O ATOM 561 CB GLU A 37 -8.756 15.218 2.780 1.00 0.00 C ATOM 562 CG GLU A 37 -7.571 15.001 3.721 1.00 0.00 C ATOM 563 CD GLU A 37 -7.578 16.077 4.808 1.00 0.00 C ATOM 564 OE1 GLU A 37 -7.205 17.199 4.507 1.00 0.00 O ATOM 565 OE2 GLU A 37 -7.957 15.760 5.924 1.00 0.00 O ATOM 0 H GLU A 37 -8.876 12.839 3.535 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.719 14.189 1.155 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.643 16.162 2.248 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.681 15.284 3.353 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.629 14.011 4.174 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.637 15.041 3.161 1.00 0.00 H new ATOM 572 N GLN A 38 -6.627 13.213 1.228 1.00 0.00 N ATOM 573 CA GLN A 38 -5.376 13.150 0.417 1.00 0.00 C ATOM 574 C GLN A 38 -5.486 12.007 -0.595 1.00 0.00 C ATOM 575 O GLN A 38 -5.430 12.215 -1.790 1.00 0.00 O ATOM 576 CB GLN A 38 -4.184 12.894 1.346 1.00 0.00 C ATOM 577 CG GLN A 38 -2.867 13.236 0.619 1.00 0.00 C ATOM 578 CD GLN A 38 -1.735 12.359 1.156 1.00 0.00 C ATOM 579 OE1 GLN A 38 -0.831 12.838 1.810 1.00 0.00 O ATOM 580 NE2 GLN A 38 -1.755 11.081 0.904 1.00 0.00 N ATOM 0 H GLN A 38 -6.661 12.570 2.019 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.233 14.093 -0.111 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.279 13.498 2.248 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.175 11.851 1.661 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.982 13.080 -0.454 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.624 14.289 0.764 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.516 10.681 0.354 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -1.010 10.480 1.256 1.00 0.00 H new ATOM 589 N LEU A 39 -5.643 10.800 -0.119 1.00 0.00 N ATOM 590 CA LEU A 39 -5.760 9.631 -1.038 1.00 0.00 C ATOM 591 C LEU A 39 -6.717 9.967 -2.178 1.00 0.00 C ATOM 592 O LEU A 39 -6.700 9.342 -3.220 1.00 0.00 O ATOM 593 CB LEU A 39 -6.309 8.434 -0.263 1.00 0.00 C ATOM 594 CG LEU A 39 -5.274 7.928 0.754 1.00 0.00 C ATOM 595 CD1 LEU A 39 -5.981 7.145 1.866 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.256 7.007 0.065 1.00 0.00 C ATOM 0 H LEU A 39 -5.695 10.573 0.874 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.777 9.392 -1.445 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.226 8.718 0.254 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.568 7.633 -0.956 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.755 8.788 1.178 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.244 6.788 2.585 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.695 7.795 2.371 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.508 6.294 1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.529 6.656 0.797 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.774 6.152 -0.370 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.741 7.558 -0.722 1.00 0.00 H new ATOM 608 N ASN A 40 -7.543 10.956 -1.999 1.00 0.00 N ATOM 609 CA ASN A 40 -8.480 11.329 -3.088 1.00 0.00 C ATOM 610 C ASN A 40 -7.639 11.814 -4.261 1.00 0.00 C ATOM 611 O ASN A 40 -8.025 11.725 -5.410 1.00 0.00 O ATOM 612 CB ASN A 40 -9.398 12.460 -2.603 1.00 0.00 C ATOM 613 CG ASN A 40 -10.634 11.876 -1.908 1.00 0.00 C ATOM 614 OD1 ASN A 40 -11.082 10.796 -2.242 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.208 12.550 -0.949 1.00 0.00 N ATOM 0 H ASN A 40 -7.609 11.519 -1.151 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.098 10.481 -3.383 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.856 13.108 -1.914 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.704 13.078 -3.447 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.031 12.171 -0.481 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -10.834 13.456 -0.668 1.00 0.00 H new ATOM 622 N ARG A 41 -6.476 12.310 -3.964 1.00 0.00 N ATOM 623 CA ARG A 41 -5.568 12.792 -5.032 1.00 0.00 C ATOM 624 C ARG A 41 -4.870 11.583 -5.644 1.00 0.00 C ATOM 625 O ARG A 41 -4.362 11.634 -6.746 1.00 0.00 O ATOM 626 CB ARG A 41 -4.529 13.736 -4.424 1.00 0.00 C ATOM 627 CG ARG A 41 -5.244 14.930 -3.776 1.00 0.00 C ATOM 628 CD ARG A 41 -4.287 15.664 -2.827 1.00 0.00 C ATOM 629 NE ARG A 41 -5.070 16.552 -1.903 1.00 0.00 N ATOM 630 CZ ARG A 41 -5.898 17.456 -2.358 1.00 0.00 C ATOM 631 NH1 ARG A 41 -5.928 17.750 -3.627 1.00 0.00 N ATOM 632 NH2 ARG A 41 -6.659 18.111 -1.523 1.00 0.00 N ATOM 0 H ARG A 41 -6.112 12.403 -3.016 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.129 13.328 -5.798 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.932 13.208 -3.680 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.842 14.084 -5.195 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.600 15.613 -4.547 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -6.120 14.585 -3.227 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.708 14.943 -2.250 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.575 16.258 -3.401 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.953 16.447 -0.895 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -5.302 17.273 -4.276 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -6.578 18.457 -3.972 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.605 17.916 -0.523 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.307 18.818 -1.871 1.00 0.00 H new ATOM 646 N GLY A 42 -4.854 10.487 -4.933 1.00 0.00 N ATOM 647 CA GLY A 42 -4.199 9.263 -5.476 1.00 0.00 C ATOM 648 C GLY A 42 -3.915 8.265 -4.344 1.00 0.00 C ATOM 649 O GLY A 42 -4.679 8.133 -3.411 1.00 0.00 O ATOM 0 H GLY A 42 -5.264 10.387 -4.004 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.841 8.800 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.268 9.531 -5.976 1.00 0.00 H new ATOM 653 N VAL A 43 -2.814 7.560 -4.427 1.00 0.00 N ATOM 654 CA VAL A 43 -2.459 6.564 -3.365 1.00 0.00 C ATOM 655 C VAL A 43 -1.526 7.236 -2.345 1.00 0.00 C ATOM 656 O VAL A 43 -0.947 8.270 -2.611 1.00 0.00 O ATOM 657 CB VAL A 43 -1.733 5.377 -4.014 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.699 4.184 -3.059 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.449 4.967 -5.301 1.00 0.00 C ATOM 0 H VAL A 43 -2.140 7.631 -5.190 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.361 6.212 -2.864 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.712 5.683 -4.242 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.181 3.352 -3.535 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.174 4.464 -2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.718 3.885 -2.814 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.927 4.124 -5.755 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.474 4.678 -5.071 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.456 5.806 -5.996 1.00 0.00 H new ATOM 669 N SER A 44 -1.367 6.652 -1.187 1.00 0.00 N ATOM 670 CA SER A 44 -0.462 7.252 -0.162 1.00 0.00 C ATOM 671 C SER A 44 -0.034 6.168 0.827 1.00 0.00 C ATOM 672 O SER A 44 -0.716 5.181 1.011 1.00 0.00 O ATOM 673 CB SER A 44 -1.196 8.366 0.583 1.00 0.00 C ATOM 674 OG SER A 44 -0.241 9.230 1.185 1.00 0.00 O ATOM 0 H SER A 44 -1.825 5.785 -0.906 1.00 0.00 H new ATOM 0 HA SER A 44 0.418 7.669 -0.651 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.828 8.926 -0.106 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.851 7.942 1.344 1.00 0.00 H new ATOM 0 HG SER A 44 0.634 9.093 0.766 1.00 0.00 H new ATOM 680 N PHE A 45 1.089 6.340 1.469 1.00 0.00 N ATOM 681 CA PHE A 45 1.537 5.305 2.444 1.00 0.00 C ATOM 682 C PHE A 45 0.488 5.157 3.546 1.00 0.00 C ATOM 683 O PHE A 45 -0.376 5.995 3.710 1.00 0.00 O ATOM 684 CB PHE A 45 2.874 5.712 3.062 1.00 0.00 C ATOM 685 CG PHE A 45 3.976 5.507 2.047 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.322 4.214 1.638 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.649 6.609 1.515 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.343 4.026 0.699 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.669 6.425 0.577 1.00 0.00 C ATOM 690 CZ PHE A 45 6.017 5.133 0.167 1.00 0.00 C ATOM 0 H PHE A 45 1.710 7.142 1.363 1.00 0.00 H new ATOM 0 HA PHE A 45 1.660 4.354 1.925 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.841 6.756 3.374 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.071 5.118 3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.801 3.361 2.047 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.381 7.607 1.829 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.611 3.028 0.385 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.188 7.280 0.169 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.804 4.989 -0.559 1.00 0.00 H new ATOM 700 N ALA A 46 0.560 4.100 4.310 1.00 0.00 N ATOM 701 CA ALA A 46 -0.430 3.907 5.406 1.00 0.00 C ATOM 702 C ALA A 46 -0.054 4.802 6.585 1.00 0.00 C ATOM 703 O ALA A 46 -0.863 5.082 7.449 1.00 0.00 O ATOM 704 CB ALA A 46 -0.426 2.447 5.855 1.00 0.00 C ATOM 0 H ALA A 46 1.261 3.364 4.222 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.425 4.169 5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.152 2.311 6.657 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.691 1.807 5.013 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.567 2.180 6.216 1.00 0.00 H new ATOM 710 N GLU A 47 1.176 5.248 6.632 1.00 0.00 N ATOM 711 CA GLU A 47 1.621 6.124 7.760 1.00 0.00 C ATOM 712 C GLU A 47 2.569 7.213 7.244 1.00 0.00 C ATOM 713 O GLU A 47 3.274 7.035 6.269 1.00 0.00 O ATOM 714 CB GLU A 47 2.348 5.273 8.796 1.00 0.00 C ATOM 715 CG GLU A 47 1.343 4.366 9.509 1.00 0.00 C ATOM 716 CD GLU A 47 2.044 3.631 10.654 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.908 2.819 10.369 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.703 3.894 11.795 1.00 0.00 O ATOM 0 H GLU A 47 1.893 5.043 5.936 1.00 0.00 H new ATOM 0 HA GLU A 47 0.749 6.598 8.210 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.117 4.671 8.312 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.852 5.914 9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.513 4.958 9.896 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.922 3.648 8.805 1.00 0.00 H new ATOM 725 N GLU A 48 2.575 8.345 7.895 1.00 0.00 N ATOM 726 CA GLU A 48 3.452 9.477 7.468 1.00 0.00 C ATOM 727 C GLU A 48 4.939 9.113 7.578 1.00 0.00 C ATOM 728 O GLU A 48 5.747 9.543 6.779 1.00 0.00 O ATOM 729 CB GLU A 48 3.176 10.683 8.368 1.00 0.00 C ATOM 730 CG GLU A 48 4.107 11.833 7.979 1.00 0.00 C ATOM 731 CD GLU A 48 3.605 13.134 8.606 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.660 13.697 8.079 1.00 0.00 O ATOM 733 OE2 GLU A 48 4.174 13.546 9.604 1.00 0.00 O ATOM 0 H GLU A 48 2.002 8.537 8.716 1.00 0.00 H new ATOM 0 HA GLU A 48 3.230 9.705 6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.136 10.994 8.269 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.330 10.413 9.413 1.00 0.00 H new ATOM 0 HG2 GLU A 48 5.122 11.623 8.317 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.146 11.932 6.894 1.00 0.00 H new ATOM 740 N ASN A 49 5.318 8.361 8.576 1.00 0.00 N ATOM 741 CA ASN A 49 6.766 8.020 8.750 1.00 0.00 C ATOM 742 C ASN A 49 7.147 6.799 7.908 1.00 0.00 C ATOM 743 O ASN A 49 8.234 6.272 8.032 1.00 0.00 O ATOM 744 CB ASN A 49 7.034 7.715 10.224 1.00 0.00 C ATOM 745 CG ASN A 49 8.523 7.421 10.422 1.00 0.00 C ATOM 746 OD1 ASN A 49 8.932 6.277 10.441 1.00 0.00 O ATOM 747 ND2 ASN A 49 9.356 8.414 10.572 1.00 0.00 N ATOM 0 H ASN A 49 4.692 7.967 9.278 1.00 0.00 H new ATOM 0 HA ASN A 49 7.365 8.869 8.421 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.734 8.562 10.842 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.438 6.860 10.544 1.00 0.00 H new ATOM 0 HD21 ASN A 49 10.350 8.230 10.705 1.00 0.00 H new ATOM 0 HD22 ASN A 49 9.013 9.374 10.556 1.00 0.00 H new ATOM 754 N GLU A 50 6.280 6.349 7.049 1.00 0.00 N ATOM 755 CA GLU A 50 6.627 5.171 6.207 1.00 0.00 C ATOM 756 C GLU A 50 7.782 5.536 5.275 1.00 0.00 C ATOM 757 O GLU A 50 7.824 6.610 4.708 1.00 0.00 O ATOM 758 CB GLU A 50 5.409 4.752 5.377 1.00 0.00 C ATOM 759 CG GLU A 50 5.607 3.325 4.861 1.00 0.00 C ATOM 760 CD GLU A 50 5.478 2.340 6.024 1.00 0.00 C ATOM 761 OE1 GLU A 50 4.487 2.417 6.732 1.00 0.00 O ATOM 762 OE2 GLU A 50 6.372 1.526 6.188 1.00 0.00 O ATOM 0 H GLU A 50 5.352 6.742 6.893 1.00 0.00 H new ATOM 0 HA GLU A 50 6.925 4.342 6.849 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.506 4.808 5.984 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.273 5.437 4.540 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.866 3.098 4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.588 3.228 4.395 1.00 0.00 H new ATOM 769 N SER A 51 8.716 4.644 5.111 1.00 0.00 N ATOM 770 CA SER A 51 9.875 4.910 4.217 1.00 0.00 C ATOM 771 C SER A 51 10.317 3.598 3.573 1.00 0.00 C ATOM 772 O SER A 51 9.886 2.531 3.962 1.00 0.00 O ATOM 773 CB SER A 51 11.032 5.489 5.034 1.00 0.00 C ATOM 774 OG SER A 51 12.253 5.250 4.349 1.00 0.00 O ATOM 0 H SER A 51 8.726 3.730 5.564 1.00 0.00 H new ATOM 0 HA SER A 51 9.587 5.624 3.445 1.00 0.00 H new ATOM 0 HB2 SER A 51 10.888 6.559 5.183 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.060 5.031 6.023 1.00 0.00 H new ATOM 0 HG SER A 51 13.001 5.320 4.979 1.00 0.00 H new ATOM 780 N LEU A 52 11.181 3.663 2.600 1.00 0.00 N ATOM 781 CA LEU A 52 11.651 2.413 1.945 1.00 0.00 C ATOM 782 C LEU A 52 12.579 1.686 2.919 1.00 0.00 C ATOM 783 O LEU A 52 12.953 0.549 2.711 1.00 0.00 O ATOM 784 CB LEU A 52 12.402 2.750 0.635 1.00 0.00 C ATOM 785 CG LEU A 52 12.987 4.179 0.704 1.00 0.00 C ATOM 786 CD1 LEU A 52 14.220 4.282 -0.205 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.934 5.206 0.244 1.00 0.00 C ATOM 0 H LEU A 52 11.581 4.526 2.231 1.00 0.00 H new ATOM 0 HA LEU A 52 10.803 1.776 1.693 1.00 0.00 H new ATOM 0 HB2 LEU A 52 13.203 2.029 0.472 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.722 2.669 -0.213 1.00 0.00 H new ATOM 0 HG LEU A 52 13.272 4.390 1.735 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.628 5.291 -0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 52 14.975 3.568 0.124 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.934 4.060 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.357 6.209 0.297 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.639 4.990 -0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 52 11.060 5.146 0.892 1.00 0.00 H new ATOM 799 N ASP A 53 12.946 2.339 3.986 1.00 0.00 N ATOM 800 CA ASP A 53 13.843 1.697 4.983 1.00 0.00 C ATOM 801 C ASP A 53 13.012 0.807 5.908 1.00 0.00 C ATOM 802 O ASP A 53 13.490 -0.182 6.425 1.00 0.00 O ATOM 803 CB ASP A 53 14.546 2.776 5.807 1.00 0.00 C ATOM 804 CG ASP A 53 15.413 3.636 4.884 1.00 0.00 C ATOM 805 OD1 ASP A 53 15.142 3.650 3.694 1.00 0.00 O ATOM 806 OD2 ASP A 53 16.332 4.264 5.382 1.00 0.00 O ATOM 0 H ASP A 53 12.662 3.293 4.210 1.00 0.00 H new ATOM 0 HA ASP A 53 14.590 1.093 4.468 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.810 3.398 6.316 1.00 0.00 H new ATOM 0 HB3 ASP A 53 15.163 2.316 6.579 1.00 0.00 H new ATOM 811 N ASP A 54 11.770 1.150 6.122 1.00 0.00 N ATOM 812 CA ASP A 54 10.917 0.321 7.014 1.00 0.00 C ATOM 813 C ASP A 54 10.725 -1.070 6.400 1.00 0.00 C ATOM 814 O ASP A 54 9.913 -1.257 5.515 1.00 0.00 O ATOM 815 CB ASP A 54 9.554 0.995 7.180 1.00 0.00 C ATOM 816 CG ASP A 54 9.739 2.365 7.834 1.00 0.00 C ATOM 817 OD1 ASP A 54 10.874 2.728 8.094 1.00 0.00 O ATOM 818 OD2 ASP A 54 8.741 3.029 8.063 1.00 0.00 O ATOM 0 H ASP A 54 11.312 1.967 5.718 1.00 0.00 H new ATOM 0 HA ASP A 54 11.400 0.222 7.986 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.071 1.106 6.209 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.901 0.373 7.792 1.00 0.00 H new ATOM 823 N GLN A 55 11.453 -2.053 6.865 1.00 0.00 N ATOM 824 CA GLN A 55 11.288 -3.429 6.305 1.00 0.00 C ATOM 825 C GLN A 55 9.798 -3.773 6.259 1.00 0.00 C ATOM 826 O GLN A 55 9.382 -4.693 5.584 1.00 0.00 O ATOM 827 CB GLN A 55 12.041 -4.448 7.177 1.00 0.00 C ATOM 828 CG GLN A 55 11.405 -4.555 8.570 1.00 0.00 C ATOM 829 CD GLN A 55 11.412 -3.188 9.257 1.00 0.00 C ATOM 830 OE1 GLN A 55 12.452 -2.576 9.407 1.00 0.00 O ATOM 831 NE2 GLN A 55 10.289 -2.678 9.683 1.00 0.00 N ATOM 0 H GLN A 55 12.151 -1.964 7.604 1.00 0.00 H new ATOM 0 HA GLN A 55 11.702 -3.466 5.297 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.031 -5.424 6.693 1.00 0.00 H new ATOM 0 HB3 GLN A 55 13.085 -4.150 7.272 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.382 -4.922 8.484 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.954 -5.277 9.174 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.416 -3.191 9.558 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.284 -1.767 10.141 1.00 0.00 H new ATOM 840 N ASN A 56 8.994 -3.021 6.971 1.00 0.00 N ATOM 841 CA ASN A 56 7.518 -3.265 6.988 1.00 0.00 C ATOM 842 C ASN A 56 6.819 -2.121 6.257 1.00 0.00 C ATOM 843 O ASN A 56 6.618 -1.055 6.802 1.00 0.00 O ATOM 844 CB ASN A 56 7.029 -3.316 8.437 1.00 0.00 C ATOM 845 CG ASN A 56 5.534 -3.642 8.464 1.00 0.00 C ATOM 846 OD1 ASN A 56 5.146 -4.781 8.299 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.673 -2.682 8.665 1.00 0.00 N ATOM 0 H ASN A 56 9.302 -2.239 7.548 1.00 0.00 H new ATOM 0 HA ASN A 56 7.293 -4.211 6.496 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.586 -4.070 8.993 1.00 0.00 H new ATOM 0 HB3 ASN A 56 7.212 -2.360 8.927 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.674 -2.888 8.684 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.999 -1.725 8.804 1.00 0.00 H new ATOM 854 N ILE A 57 6.447 -2.331 5.021 1.00 0.00 N ATOM 855 CA ILE A 57 5.763 -1.248 4.251 1.00 0.00 C ATOM 856 C ILE A 57 4.251 -1.435 4.340 1.00 0.00 C ATOM 857 O ILE A 57 3.753 -2.540 4.421 1.00 0.00 O ATOM 858 CB ILE A 57 6.180 -1.321 2.780 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.704 -1.091 2.647 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.401 -0.270 1.974 1.00 0.00 C ATOM 861 CD1 ILE A 57 8.047 0.408 2.623 1.00 0.00 C ATOM 0 H ILE A 57 6.587 -3.204 4.512 1.00 0.00 H new ATOM 0 HA ILE A 57 6.044 -0.282 4.669 1.00 0.00 H new ATOM 0 HB ILE A 57 5.949 -2.311 2.386 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.219 -1.570 3.479 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.066 -1.563 1.734 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.698 -0.322 0.926 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.332 -0.466 2.059 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.620 0.724 2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.126 0.533 2.529 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.551 0.881 1.775 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.707 0.874 3.548 1.00 0.00 H new ATOM 873 N SER A 58 3.519 -0.357 4.312 1.00 0.00 N ATOM 874 CA SER A 58 2.034 -0.449 4.381 1.00 0.00 C ATOM 875 C SER A 58 1.438 0.672 3.528 1.00 0.00 C ATOM 876 O SER A 58 1.506 1.833 3.877 1.00 0.00 O ATOM 877 CB SER A 58 1.581 -0.305 5.834 1.00 0.00 C ATOM 878 OG SER A 58 2.322 0.734 6.459 1.00 0.00 O ATOM 0 H SER A 58 3.889 0.591 4.244 1.00 0.00 H new ATOM 0 HA SER A 58 1.696 -1.415 4.005 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.515 -0.081 5.874 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.729 -1.244 6.367 1.00 0.00 H new ATOM 0 HG SER A 58 2.465 1.463 5.820 1.00 0.00 H new ATOM 884 N ILE A 59 0.875 0.327 2.394 1.00 0.00 N ATOM 885 CA ILE A 59 0.286 1.360 1.481 1.00 0.00 C ATOM 886 C ILE A 59 -1.236 1.234 1.457 1.00 0.00 C ATOM 887 O ILE A 59 -1.796 0.248 1.891 1.00 0.00 O ATOM 888 CB ILE A 59 0.837 1.137 0.068 1.00 0.00 C ATOM 889 CG1 ILE A 59 2.354 1.359 0.075 1.00 0.00 C ATOM 890 CG2 ILE A 59 0.180 2.118 -0.909 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.965 0.766 -1.197 1.00 0.00 C ATOM 0 H ILE A 59 0.798 -0.633 2.059 1.00 0.00 H new ATOM 0 HA ILE A 59 0.551 2.355 1.838 1.00 0.00 H new ATOM 0 HB ILE A 59 0.616 0.118 -0.248 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.576 2.425 0.134 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.796 0.892 0.955 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.576 1.954 -1.911 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -0.898 1.959 -0.915 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.394 3.140 -0.597 1.00 0.00 H new ATOM 0 HD11 ILE A 59 4.043 0.925 -1.191 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.756 -0.303 -1.237 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.532 1.254 -2.070 1.00 0.00 H new ATOM 903 N ALA A 60 -1.909 2.230 0.942 1.00 0.00 N ATOM 904 CA ALA A 60 -3.401 2.188 0.872 1.00 0.00 C ATOM 905 C ALA A 60 -3.865 2.985 -0.349 1.00 0.00 C ATOM 906 O ALA A 60 -3.340 4.041 -0.641 1.00 0.00 O ATOM 907 CB ALA A 60 -3.992 2.802 2.145 1.00 0.00 C ATOM 0 H ALA A 60 -1.486 3.078 0.564 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.738 1.155 0.785 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.080 2.771 2.093 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.654 2.236 3.013 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.663 3.837 2.236 1.00 0.00 H new ATOM 913 N GLY A 61 -4.843 2.493 -1.073 1.00 0.00 N ATOM 914 CA GLY A 61 -5.322 3.235 -2.286 1.00 0.00 C ATOM 915 C GLY A 61 -6.827 3.028 -2.475 1.00 0.00 C ATOM 916 O GLY A 61 -7.396 2.067 -1.996 1.00 0.00 O ATOM 0 H GLY A 61 -5.328 1.617 -0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.105 4.298 -2.180 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.786 2.887 -3.169 1.00 0.00 H new ATOM 920 N HIS A 62 -7.476 3.922 -3.179 1.00 0.00 N ATOM 921 CA HIS A 62 -8.952 3.761 -3.401 1.00 0.00 C ATOM 922 C HIS A 62 -9.206 2.631 -4.401 1.00 0.00 C ATOM 923 O HIS A 62 -8.293 1.988 -4.875 1.00 0.00 O ATOM 924 CB HIS A 62 -9.576 5.040 -3.972 1.00 0.00 C ATOM 925 CG HIS A 62 -9.463 6.176 -2.996 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.570 6.697 -2.343 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.394 6.921 -2.576 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.144 7.715 -1.574 1.00 0.00 C ATOM 929 NE2 HIS A 62 -8.826 7.893 -1.678 1.00 0.00 N ATOM 0 H HIS A 62 -7.057 4.748 -3.606 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.404 3.538 -2.434 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -9.079 5.306 -4.905 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.625 4.863 -4.209 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -11.532 6.368 -2.430 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.372 6.777 -2.893 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -10.790 8.314 -0.949 1.00 0.00 H new ATOM 937 N THR A 63 -10.448 2.407 -4.742 1.00 0.00 N ATOM 938 CA THR A 63 -10.782 1.342 -5.730 1.00 0.00 C ATOM 939 C THR A 63 -12.211 1.565 -6.234 1.00 0.00 C ATOM 940 O THR A 63 -13.147 0.945 -5.770 1.00 0.00 O ATOM 941 CB THR A 63 -10.681 -0.045 -5.076 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.592 -0.931 -5.712 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.031 0.050 -3.593 1.00 0.00 C ATOM 0 H THR A 63 -11.250 2.920 -4.375 1.00 0.00 H new ATOM 0 HA THR A 63 -10.078 1.388 -6.561 1.00 0.00 H new ATOM 0 HB THR A 63 -9.662 -0.417 -5.183 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.509 -0.694 -5.460 1.00 0.00 H new ATOM 0 HG21 THR A 63 -10.957 -0.938 -3.138 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.338 0.731 -3.098 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.049 0.425 -3.483 1.00 0.00 H new ATOM 951 N PHE A 64 -12.385 2.453 -7.180 1.00 0.00 N ATOM 952 CA PHE A 64 -13.754 2.727 -7.715 1.00 0.00 C ATOM 953 C PHE A 64 -14.059 1.759 -8.860 1.00 0.00 C ATOM 954 O PHE A 64 -13.346 1.695 -9.839 1.00 0.00 O ATOM 955 CB PHE A 64 -13.816 4.165 -8.233 1.00 0.00 C ATOM 956 CG PHE A 64 -13.854 5.121 -7.062 1.00 0.00 C ATOM 957 CD1 PHE A 64 -15.026 5.259 -6.310 1.00 0.00 C ATOM 958 CD2 PHE A 64 -12.717 5.867 -6.729 1.00 0.00 C ATOM 959 CE1 PHE A 64 -15.063 6.143 -5.224 1.00 0.00 C ATOM 960 CE2 PHE A 64 -12.753 6.751 -5.643 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.926 6.889 -4.892 1.00 0.00 C ATOM 0 H PHE A 64 -11.637 3.001 -7.606 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.489 2.592 -6.922 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.949 4.375 -8.860 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.700 4.301 -8.856 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -15.903 4.683 -6.567 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -11.812 5.761 -7.309 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -15.968 6.249 -4.644 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -11.876 7.326 -5.385 1.00 0.00 H new ATOM 0 HZ PHE A 64 -13.954 7.572 -4.056 1.00 0.00 H new ATOM 971 N ILE A 65 -15.112 1.000 -8.739 1.00 0.00 N ATOM 972 CA ILE A 65 -15.468 0.021 -9.809 1.00 0.00 C ATOM 973 C ILE A 65 -15.687 0.731 -11.139 1.00 0.00 C ATOM 974 O ILE A 65 -15.546 0.146 -12.194 1.00 0.00 O ATOM 975 CB ILE A 65 -16.763 -0.698 -9.420 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.708 -1.098 -7.945 1.00 0.00 C ATOM 977 CG2 ILE A 65 -16.932 -1.946 -10.286 1.00 0.00 C ATOM 978 CD1 ILE A 65 -15.383 -1.805 -7.651 1.00 0.00 C ATOM 0 H ILE A 65 -15.747 1.014 -7.941 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.649 -0.690 -9.915 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.610 -0.030 -9.578 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -16.807 -0.214 -7.315 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -17.543 -1.756 -7.705 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -17.854 -2.458 -10.010 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -16.978 -1.657 -11.336 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.085 -2.614 -10.131 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -15.347 -2.088 -6.599 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -15.302 -2.698 -8.270 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -14.555 -1.133 -7.874 1.00 0.00 H new ATOM 990 N ASP A 66 -16.057 1.977 -11.107 1.00 0.00 N ATOM 991 CA ASP A 66 -16.313 2.706 -12.375 1.00 0.00 C ATOM 992 C ASP A 66 -15.013 3.301 -12.902 1.00 0.00 C ATOM 993 O ASP A 66 -15.015 4.216 -13.700 1.00 0.00 O ATOM 994 CB ASP A 66 -17.342 3.812 -12.120 1.00 0.00 C ATOM 995 CG ASP A 66 -16.709 4.939 -11.299 1.00 0.00 C ATOM 996 OD1 ASP A 66 -16.628 4.792 -10.092 1.00 0.00 O ATOM 997 OD2 ASP A 66 -16.320 5.931 -11.893 1.00 0.00 O ATOM 0 H ASP A 66 -16.193 2.523 -10.256 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.705 2.017 -13.123 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.709 4.204 -13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -18.202 3.404 -11.590 1.00 0.00 H new ATOM 1002 N ARG A 67 -13.901 2.778 -12.467 1.00 0.00 N ATOM 1003 CA ARG A 67 -12.589 3.300 -12.944 1.00 0.00 C ATOM 1004 C ARG A 67 -11.551 2.172 -12.928 1.00 0.00 C ATOM 1005 O ARG A 67 -10.621 2.193 -12.146 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.132 4.437 -12.028 1.00 0.00 C ATOM 1007 CG ARG A 67 -13.126 5.598 -12.122 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.507 6.854 -11.513 1.00 0.00 C ATOM 1009 NE ARG A 67 -13.471 7.985 -11.624 1.00 0.00 N ATOM 1010 CZ ARG A 67 -13.290 9.065 -10.915 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -12.263 9.155 -10.116 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -14.134 10.056 -11.008 1.00 0.00 N ATOM 0 H ARG A 67 -13.844 2.009 -11.799 1.00 0.00 H new ATOM 0 HA ARG A 67 -12.694 3.676 -13.962 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -12.064 4.084 -10.999 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.136 4.773 -12.316 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -13.391 5.780 -13.164 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -14.048 5.344 -11.598 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -12.255 6.678 -10.467 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -11.578 7.101 -12.028 1.00 0.00 H new ATOM 0 HE ARG A 67 -14.271 7.915 -12.253 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -11.602 8.381 -10.046 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -12.121 9.999 -9.561 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -14.935 9.986 -11.635 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -13.992 10.900 -10.454 1.00 0.00 H new ATOM 1026 N PRO A 68 -11.717 1.193 -13.787 1.00 0.00 N ATOM 1027 CA PRO A 68 -10.794 0.012 -13.888 1.00 0.00 C ATOM 1028 C PRO A 68 -9.301 0.383 -13.940 1.00 0.00 C ATOM 1029 O PRO A 68 -8.455 -0.470 -14.123 1.00 0.00 O ATOM 1030 CB PRO A 68 -11.225 -0.662 -15.197 1.00 0.00 C ATOM 1031 CG PRO A 68 -12.668 -0.310 -15.344 1.00 0.00 C ATOM 1032 CD PRO A 68 -12.816 1.100 -14.767 1.00 0.00 C ATOM 0 HA PRO A 68 -10.874 -0.621 -13.005 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.640 -0.298 -16.042 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.083 -1.742 -15.153 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.972 -0.338 -16.390 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -13.300 -1.019 -14.809 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -12.727 1.861 -15.542 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.788 1.239 -14.293 1.00 0.00 H new ATOM 1040 N ASN A 69 -8.967 1.633 -13.776 1.00 0.00 N ATOM 1041 CA ASN A 69 -7.529 2.038 -13.811 1.00 0.00 C ATOM 1042 C ASN A 69 -7.324 3.194 -12.836 1.00 0.00 C ATOM 1043 O ASN A 69 -6.949 4.283 -13.220 1.00 0.00 O ATOM 1044 CB ASN A 69 -7.158 2.490 -15.225 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.052 3.661 -15.642 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -7.567 4.739 -15.926 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.345 3.494 -15.690 1.00 0.00 N ATOM 0 H ASN A 69 -9.627 2.394 -13.619 1.00 0.00 H new ATOM 0 HA ASN A 69 -6.898 1.195 -13.529 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -6.110 2.789 -15.259 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -7.276 1.663 -15.925 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -9.949 4.268 -15.966 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.752 2.589 -15.452 1.00 0.00 H new ATOM 1054 N TYR A 70 -7.580 2.969 -11.574 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.413 4.062 -10.575 1.00 0.00 C ATOM 1056 C TYR A 70 -7.102 3.482 -9.192 1.00 0.00 C ATOM 1057 O TYR A 70 -7.878 2.734 -8.629 1.00 0.00 O ATOM 1058 CB TYR A 70 -8.709 4.872 -10.505 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.494 6.109 -9.667 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -7.849 7.222 -10.218 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -8.942 6.145 -8.340 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -7.651 8.371 -9.443 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -8.743 7.294 -7.565 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.097 8.407 -8.116 1.00 0.00 C ATOM 1065 OH TYR A 70 -7.902 9.539 -7.352 1.00 0.00 O ATOM 0 H TYR A 70 -7.897 2.077 -11.194 1.00 0.00 H new ATOM 0 HA TYR A 70 -6.584 4.701 -10.880 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.028 5.153 -11.509 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.506 4.265 -10.075 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -7.504 7.195 -11.241 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -9.441 5.287 -7.915 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -7.154 9.230 -9.869 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -9.088 7.322 -6.542 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.272 9.397 -6.456 1.00 0.00 H new ATOM 1075 N GLN A 71 -5.981 3.850 -8.637 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.602 3.367 -7.277 1.00 0.00 C ATOM 1077 C GLN A 71 -5.636 1.827 -7.212 1.00 0.00 C ATOM 1078 O GLN A 71 -4.965 1.157 -7.972 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.568 3.982 -6.244 1.00 0.00 C ATOM 1080 CG GLN A 71 -6.273 5.496 -6.002 1.00 0.00 C ATOM 1081 CD GLN A 71 -5.482 6.131 -7.155 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -5.950 6.190 -8.274 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -4.307 6.636 -6.912 1.00 0.00 N ATOM 0 H GLN A 71 -5.301 4.473 -9.073 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.582 3.679 -7.052 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.595 3.863 -6.591 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.485 3.441 -5.302 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -7.214 6.030 -5.873 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -5.712 5.610 -5.074 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -3.915 6.586 -5.972 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.778 7.082 -7.662 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.378 1.255 -6.288 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.414 -0.240 -6.151 1.00 0.00 C ATOM 1094 C PHE A 72 -7.649 -0.808 -6.869 1.00 0.00 C ATOM 1095 O PHE A 72 -8.000 -1.955 -6.677 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.513 -0.618 -4.659 1.00 0.00 C ATOM 1097 CG PHE A 72 -5.162 -0.579 -3.964 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -4.193 0.380 -4.299 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -4.895 -1.508 -2.951 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -2.968 0.406 -3.619 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -3.670 -1.482 -2.276 1.00 0.00 C ATOM 1102 CZ PHE A 72 -2.707 -0.525 -2.609 1.00 0.00 C ATOM 0 H PHE A 72 -6.961 1.761 -5.622 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.505 -0.650 -6.592 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.197 0.067 -4.158 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.938 -1.618 -4.567 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.392 1.098 -5.081 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -5.638 -2.247 -2.690 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.224 1.146 -3.875 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.468 -2.202 -1.497 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.762 -0.505 -2.086 1.00 0.00 H new ATOM 1112 N THR A 73 -8.320 -0.027 -7.670 1.00 0.00 N ATOM 1113 CA THR A 73 -9.537 -0.553 -8.361 1.00 0.00 C ATOM 1114 C THR A 73 -9.252 -1.928 -8.964 1.00 0.00 C ATOM 1115 O THR A 73 -10.160 -2.683 -9.255 1.00 0.00 O ATOM 1116 CB THR A 73 -9.961 0.402 -9.478 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.274 1.673 -8.921 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.193 -0.171 -10.185 1.00 0.00 C ATOM 0 H THR A 73 -8.084 0.944 -7.876 1.00 0.00 H new ATOM 0 HA THR A 73 -10.338 -0.638 -7.627 1.00 0.00 H new ATOM 0 HB THR A 73 -9.149 0.516 -10.196 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.513 2.279 -9.040 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.502 0.504 -10.983 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.949 -1.145 -10.608 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.006 -0.280 -9.468 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.000 -2.257 -9.162 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.644 -3.583 -9.761 1.00 0.00 C ATOM 1128 C ASN A 74 -6.737 -4.362 -8.805 1.00 0.00 C ATOM 1129 O ASN A 74 -6.650 -5.572 -8.879 1.00 0.00 O ATOM 1130 CB ASN A 74 -6.920 -3.347 -11.087 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.907 -2.772 -12.104 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -8.883 -2.150 -11.736 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -7.694 -2.954 -13.379 1.00 0.00 N ATOM 0 H ASN A 74 -7.204 -1.662 -8.934 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.550 -4.164 -9.933 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.087 -2.660 -10.943 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.501 -4.282 -11.458 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.347 -2.574 -14.064 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -6.875 -3.476 -13.690 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.066 -3.696 -7.903 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.185 -4.438 -6.956 1.00 0.00 C ATOM 1142 C LEU A 75 -6.023 -5.489 -6.237 1.00 0.00 C ATOM 1143 O LEU A 75 -5.519 -6.498 -5.784 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.570 -3.476 -5.924 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.386 -4.150 -5.171 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.273 -3.121 -4.914 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -3.868 -4.724 -3.826 1.00 0.00 C ATOM 0 H LEU A 75 -6.089 -2.683 -7.782 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.375 -4.912 -7.510 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.220 -2.574 -6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.333 -3.168 -5.209 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.998 -4.960 -5.789 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.448 -3.601 -4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.915 -2.727 -5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.665 -2.305 -4.308 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.030 -5.193 -3.309 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.270 -3.919 -3.210 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.645 -5.467 -4.005 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.305 -5.266 -6.137 1.00 0.00 N ATOM 1160 CA LYS A 76 -8.175 -6.261 -5.459 1.00 0.00 C ATOM 1161 C LYS A 76 -8.386 -7.421 -6.424 1.00 0.00 C ATOM 1162 O LYS A 76 -8.843 -8.485 -6.059 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.523 -5.624 -5.111 1.00 0.00 C ATOM 1164 CG LYS A 76 -10.075 -4.887 -6.333 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.542 -4.525 -6.090 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.074 -3.722 -7.277 1.00 0.00 C ATOM 1167 NZ LYS A 76 -11.871 -4.498 -8.534 1.00 0.00 N ATOM 0 H LYS A 76 -7.784 -4.440 -6.495 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.711 -6.608 -4.536 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.227 -6.392 -4.789 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.404 -4.930 -4.279 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.493 -3.985 -6.521 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.986 -5.514 -7.220 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -12.133 -5.431 -5.956 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.637 -3.944 -5.173 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -13.133 -3.506 -7.138 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.559 -2.764 -7.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.703 -4.389 -9.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.027 -4.144 -9.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.741 -5.504 -8.304 1.00 0.00 H new ATOM 1181 N ALA A 77 -8.040 -7.208 -7.664 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.192 -8.270 -8.691 1.00 0.00 C ATOM 1183 C ALA A 77 -6.953 -9.165 -8.664 1.00 0.00 C ATOM 1184 O ALA A 77 -6.948 -10.260 -9.190 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.319 -7.605 -10.063 1.00 0.00 C ATOM 0 H ALA A 77 -7.653 -6.330 -8.011 1.00 0.00 H new ATOM 0 HA ALA A 77 -9.078 -8.872 -8.491 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.431 -8.371 -10.830 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.192 -6.952 -10.072 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.424 -7.017 -10.266 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.901 -8.696 -8.054 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.649 -9.500 -7.981 1.00 0.00 C ATOM 1193 C ALA A 78 -4.938 -10.852 -7.326 1.00 0.00 C ATOM 1194 O ALA A 78 -6.029 -11.105 -6.857 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.615 -8.740 -7.147 1.00 0.00 C ATOM 0 H ALA A 78 -5.854 -7.784 -7.600 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.264 -9.666 -8.987 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.695 -9.322 -7.089 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.406 -7.778 -7.615 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.006 -8.578 -6.142 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.964 -11.725 -7.289 1.00 0.00 N ATOM 1202 CA LYS A 79 -4.172 -13.065 -6.662 1.00 0.00 C ATOM 1203 C LYS A 79 -2.841 -13.564 -6.092 1.00 0.00 C ATOM 1204 O LYS A 79 -1.784 -13.111 -6.481 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.678 -14.052 -7.718 1.00 0.00 C ATOM 1206 CG LYS A 79 -6.139 -13.733 -8.061 1.00 0.00 C ATOM 1207 CD LYS A 79 -6.721 -14.829 -8.964 1.00 0.00 C ATOM 1208 CE LYS A 79 -6.219 -14.649 -10.401 1.00 0.00 C ATOM 1209 NZ LYS A 79 -6.957 -15.579 -11.302 1.00 0.00 N ATOM 0 H LYS A 79 -3.030 -11.567 -7.668 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.908 -12.985 -5.862 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.061 -13.989 -8.614 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.596 -15.073 -7.345 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -6.727 -13.655 -7.146 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -6.200 -12.767 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -6.432 -15.811 -8.590 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -7.810 -14.788 -8.943 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -6.367 -13.618 -10.723 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.149 -14.848 -10.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.618 -15.459 -12.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -6.794 -16.560 -10.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -7.975 -15.368 -11.260 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.884 -14.486 -5.166 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.619 -15.004 -4.568 1.00 0.00 C ATOM 1225 C LYS A 80 -0.668 -15.465 -5.677 1.00 0.00 C ATOM 1226 O LYS A 80 -0.644 -16.622 -6.050 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.929 -16.176 -3.631 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.643 -16.632 -2.925 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.995 -17.401 -1.648 1.00 0.00 C ATOM 1230 CE LYS A 80 -1.931 -18.561 -1.988 1.00 0.00 C ATOM 1231 NZ LYS A 80 -2.050 -19.465 -0.808 1.00 0.00 N ATOM 0 H LYS A 80 -3.740 -14.902 -4.799 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.142 -14.206 -3.998 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.673 -15.877 -2.893 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.357 -17.003 -4.198 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.057 -17.265 -3.591 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.025 -15.768 -2.681 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.087 -17.779 -1.178 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.472 -16.734 -0.930 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.913 -18.180 -2.268 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.547 -19.113 -2.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.687 -20.255 -1.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.111 -19.838 -0.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.435 -18.934 -0.001 1.00 0.00 H new ATOM 1245 N GLY A 81 0.114 -14.563 -6.202 1.00 0.00 N ATOM 1246 CA GLY A 81 1.072 -14.925 -7.286 1.00 0.00 C ATOM 1247 C GLY A 81 1.399 -13.669 -8.093 1.00 0.00 C ATOM 1248 O GLY A 81 2.426 -13.577 -8.732 1.00 0.00 O ATOM 0 H GLY A 81 0.131 -13.582 -5.924 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.982 -15.348 -6.860 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.639 -15.688 -7.933 1.00 0.00 H new ATOM 1252 N SER A 82 0.532 -12.692 -8.051 1.00 0.00 N ATOM 1253 CA SER A 82 0.785 -11.433 -8.792 1.00 0.00 C ATOM 1254 C SER A 82 1.982 -10.741 -8.162 1.00 0.00 C ATOM 1255 O SER A 82 1.982 -10.434 -6.985 1.00 0.00 O ATOM 1256 CB SER A 82 -0.440 -10.525 -8.698 1.00 0.00 C ATOM 1257 OG SER A 82 -0.067 -9.197 -9.039 1.00 0.00 O ATOM 0 H SER A 82 -0.345 -12.717 -7.530 1.00 0.00 H new ATOM 0 HA SER A 82 0.984 -11.649 -9.842 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.222 -10.879 -9.370 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.850 -10.552 -7.689 1.00 0.00 H new ATOM 0 HG SER A 82 -0.248 -8.602 -8.282 1.00 0.00 H new ATOM 1263 N MET A 83 3.014 -10.503 -8.915 1.00 0.00 N ATOM 1264 CA MET A 83 4.200 -9.843 -8.322 1.00 0.00 C ATOM 1265 C MET A 83 3.939 -8.347 -8.174 1.00 0.00 C ATOM 1266 O MET A 83 2.866 -7.861 -8.471 1.00 0.00 O ATOM 1267 CB MET A 83 5.428 -10.074 -9.209 1.00 0.00 C ATOM 1268 CG MET A 83 5.590 -11.571 -9.501 1.00 0.00 C ATOM 1269 SD MET A 83 7.318 -11.922 -9.912 1.00 0.00 S ATOM 1270 CE MET A 83 7.534 -10.600 -11.127 1.00 0.00 C ATOM 0 H MET A 83 3.087 -10.735 -9.906 1.00 0.00 H new ATOM 0 HA MET A 83 4.390 -10.271 -7.338 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.321 -9.522 -10.143 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.321 -9.693 -8.714 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.285 -12.157 -8.634 1.00 0.00 H new ATOM 0 HG3 MET A 83 4.942 -11.864 -10.327 1.00 0.00 H new ATOM 0 HE1 MET A 83 8.428 -10.793 -11.720 1.00 0.00 H new ATOM 0 HE2 MET A 83 6.664 -10.563 -11.783 1.00 0.00 H new ATOM 0 HE3 MET A 83 7.640 -9.646 -10.611 1.00 0.00 H new ATOM 1280 N VAL A 84 4.912 -7.613 -7.703 1.00 0.00 N ATOM 1281 CA VAL A 84 4.728 -6.144 -7.516 1.00 0.00 C ATOM 1282 C VAL A 84 6.047 -5.426 -7.799 1.00 0.00 C ATOM 1283 O VAL A 84 7.107 -6.015 -7.756 1.00 0.00 O ATOM 1284 CB VAL A 84 4.304 -5.877 -6.070 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.073 -4.377 -5.871 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.009 -6.645 -5.768 1.00 0.00 C ATOM 0 H VAL A 84 5.830 -7.969 -7.439 1.00 0.00 H new ATOM 0 HA VAL A 84 3.963 -5.777 -8.200 1.00 0.00 H new ATOM 0 HB VAL A 84 5.090 -6.212 -5.393 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.771 -4.189 -4.841 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.995 -3.836 -6.084 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.288 -4.037 -6.547 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.706 -6.456 -4.738 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.222 -6.312 -6.445 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.179 -7.713 -5.906 1.00 0.00 H new ATOM 1296 N TYR A 85 5.990 -4.152 -8.086 1.00 0.00 N ATOM 1297 CA TYR A 85 7.241 -3.386 -8.372 1.00 0.00 C ATOM 1298 C TYR A 85 7.106 -1.969 -7.816 1.00 0.00 C ATOM 1299 O TYR A 85 6.461 -1.120 -8.402 1.00 0.00 O ATOM 1300 CB TYR A 85 7.454 -3.305 -9.885 1.00 0.00 C ATOM 1301 CG TYR A 85 7.895 -4.646 -10.419 1.00 0.00 C ATOM 1302 CD1 TYR A 85 6.949 -5.655 -10.639 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.245 -4.879 -10.701 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.355 -6.897 -11.142 1.00 0.00 C ATOM 1305 CE2 TYR A 85 9.651 -6.120 -11.206 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.706 -7.129 -11.425 1.00 0.00 C ATOM 1307 OH TYR A 85 9.107 -8.351 -11.924 1.00 0.00 O ATOM 0 H TYR A 85 5.129 -3.607 -8.135 1.00 0.00 H new ATOM 0 HA TYR A 85 8.087 -3.890 -7.905 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.530 -2.996 -10.374 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.205 -2.549 -10.114 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.907 -5.475 -10.421 1.00 0.00 H new ATOM 0 HD2 TYR A 85 9.974 -4.101 -10.529 1.00 0.00 H new ATOM 0 HE1 TYR A 85 6.626 -7.676 -11.312 1.00 0.00 H new ATOM 0 HE2 TYR A 85 10.693 -6.299 -11.427 1.00 0.00 H new ATOM 0 HH TYR A 85 10.077 -8.344 -12.066 1.00 0.00 H new ATOM 1317 N PHE A 86 7.718 -1.700 -6.695 1.00 0.00 N ATOM 1318 CA PHE A 86 7.639 -0.330 -6.102 1.00 0.00 C ATOM 1319 C PHE A 86 8.867 0.469 -6.549 1.00 0.00 C ATOM 1320 O PHE A 86 9.984 0.160 -6.188 1.00 0.00 O ATOM 1321 CB PHE A 86 7.610 -0.440 -4.572 1.00 0.00 C ATOM 1322 CG PHE A 86 7.780 0.931 -3.949 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.865 1.951 -4.240 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.855 1.181 -3.083 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.024 3.218 -3.667 1.00 0.00 C ATOM 1326 CE2 PHE A 86 9.011 2.448 -2.510 1.00 0.00 C ATOM 1327 CZ PHE A 86 8.096 3.467 -2.802 1.00 0.00 C ATOM 0 H PHE A 86 8.271 -2.370 -6.161 1.00 0.00 H new ATOM 0 HA PHE A 86 6.733 0.176 -6.437 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.667 -0.881 -4.249 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.405 -1.104 -4.232 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.037 1.760 -4.906 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.562 0.396 -2.859 1.00 0.00 H new ATOM 0 HE1 PHE A 86 6.319 4.004 -3.892 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.838 2.640 -1.842 1.00 0.00 H new ATOM 0 HZ PHE A 86 8.217 4.445 -2.360 1.00 0.00 H new ATOM 1337 N LYS A 87 8.667 1.491 -7.343 1.00 0.00 N ATOM 1338 CA LYS A 87 9.822 2.310 -7.833 1.00 0.00 C ATOM 1339 C LYS A 87 9.905 3.612 -7.037 1.00 0.00 C ATOM 1340 O LYS A 87 8.909 4.243 -6.746 1.00 0.00 O ATOM 1341 CB LYS A 87 9.617 2.640 -9.313 1.00 0.00 C ATOM 1342 CG LYS A 87 10.911 3.222 -9.890 1.00 0.00 C ATOM 1343 CD LYS A 87 10.648 3.759 -11.298 1.00 0.00 C ATOM 1344 CE LYS A 87 11.877 4.527 -11.788 1.00 0.00 C ATOM 1345 NZ LYS A 87 13.077 3.645 -11.711 1.00 0.00 N ATOM 0 H LYS A 87 7.752 1.795 -7.675 1.00 0.00 H new ATOM 0 HA LYS A 87 10.745 1.745 -7.703 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.334 1.741 -9.861 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.801 3.354 -9.428 1.00 0.00 H new ATOM 0 HG2 LYS A 87 11.280 4.022 -9.248 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.685 2.455 -9.921 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.425 2.936 -11.977 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.776 4.413 -11.293 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.724 4.863 -12.814 1.00 0.00 H new ATOM 0 HE3 LYS A 87 12.028 5.419 -11.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.715 3.857 -12.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 13.574 3.813 -10.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 12.780 2.650 -11.761 1.00 0.00 H new ATOM 1359 N VAL A 88 11.093 4.018 -6.692 1.00 0.00 N ATOM 1360 CA VAL A 88 11.262 5.280 -5.923 1.00 0.00 C ATOM 1361 C VAL A 88 12.718 5.734 -6.043 1.00 0.00 C ATOM 1362 O VAL A 88 13.626 4.928 -6.092 1.00 0.00 O ATOM 1363 CB VAL A 88 10.904 5.036 -4.452 1.00 0.00 C ATOM 1364 CG1 VAL A 88 11.602 3.765 -3.956 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.346 6.237 -3.601 1.00 0.00 C ATOM 0 H VAL A 88 11.960 3.527 -6.911 1.00 0.00 H new ATOM 0 HA VAL A 88 10.604 6.054 -6.319 1.00 0.00 H new ATOM 0 HB VAL A 88 9.825 4.913 -4.361 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.346 3.594 -2.910 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.276 2.914 -4.554 1.00 0.00 H new ATOM 0 HG13 VAL A 88 12.682 3.882 -4.051 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.089 6.058 -2.557 1.00 0.00 H new ATOM 0 HG22 VAL A 88 12.424 6.370 -3.691 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.839 7.137 -3.950 1.00 0.00 H new ATOM 1375 N GLY A 89 12.950 7.017 -6.106 1.00 0.00 N ATOM 1376 CA GLY A 89 14.350 7.509 -6.237 1.00 0.00 C ATOM 1377 C GLY A 89 15.038 6.759 -7.379 1.00 0.00 C ATOM 1378 O GLY A 89 14.399 6.320 -8.315 1.00 0.00 O ATOM 0 H GLY A 89 12.234 7.743 -6.073 1.00 0.00 H new ATOM 0 HA2 GLY A 89 14.355 8.581 -6.434 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.892 7.354 -5.304 1.00 0.00 H new ATOM 1382 N ASN A 90 16.332 6.604 -7.312 1.00 0.00 N ATOM 1383 CA ASN A 90 17.057 5.875 -8.395 1.00 0.00 C ATOM 1384 C ASN A 90 17.181 4.398 -8.015 1.00 0.00 C ATOM 1385 O ASN A 90 18.268 3.867 -7.903 1.00 0.00 O ATOM 1386 CB ASN A 90 18.455 6.477 -8.565 1.00 0.00 C ATOM 1387 CG ASN A 90 19.256 6.287 -7.276 1.00 0.00 C ATOM 1388 OD1 ASN A 90 20.456 6.473 -7.260 1.00 0.00 O ATOM 1389 ND2 ASN A 90 18.638 5.922 -6.186 1.00 0.00 N ATOM 0 H ASN A 90 16.920 6.950 -6.554 1.00 0.00 H new ATOM 0 HA ASN A 90 16.506 5.966 -9.331 1.00 0.00 H new ATOM 0 HB2 ASN A 90 18.969 5.998 -9.398 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.379 7.538 -8.805 1.00 0.00 H new ATOM 0 HD21 ASN A 90 19.163 5.793 -5.321 1.00 0.00 H new ATOM 0 HD22 ASN A 90 17.630 5.766 -6.199 1.00 0.00 H new ATOM 1396 N GLU A 91 16.078 3.729 -7.812 1.00 0.00 N ATOM 1397 CA GLU A 91 16.143 2.288 -7.437 1.00 0.00 C ATOM 1398 C GLU A 91 14.744 1.673 -7.542 1.00 0.00 C ATOM 1399 O GLU A 91 13.751 2.371 -7.594 1.00 0.00 O ATOM 1400 CB GLU A 91 16.664 2.165 -5.997 1.00 0.00 C ATOM 1401 CG GLU A 91 17.225 0.760 -5.758 1.00 0.00 C ATOM 1402 CD GLU A 91 18.528 0.588 -6.544 1.00 0.00 C ATOM 1403 OE1 GLU A 91 19.176 1.589 -6.802 1.00 0.00 O ATOM 1404 OE2 GLU A 91 18.854 -0.540 -6.872 1.00 0.00 O ATOM 0 H GLU A 91 15.138 4.117 -7.889 1.00 0.00 H new ATOM 0 HA GLU A 91 16.817 1.759 -8.110 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.439 2.910 -5.818 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.858 2.368 -5.292 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.407 0.606 -4.694 1.00 0.00 H new ATOM 0 HG3 GLU A 91 16.499 0.009 -6.069 1.00 0.00 H new ATOM 1411 N THR A 92 14.659 0.369 -7.577 1.00 0.00 N ATOM 1412 CA THR A 92 13.329 -0.300 -7.681 1.00 0.00 C ATOM 1413 C THR A 92 13.347 -1.600 -6.878 1.00 0.00 C ATOM 1414 O THR A 92 14.376 -2.225 -6.706 1.00 0.00 O ATOM 1415 CB THR A 92 13.038 -0.617 -9.150 1.00 0.00 C ATOM 1416 OG1 THR A 92 13.088 0.581 -9.911 1.00 0.00 O ATOM 1417 CG2 THR A 92 11.650 -1.247 -9.272 1.00 0.00 C ATOM 0 H THR A 92 15.458 -0.264 -7.538 1.00 0.00 H new ATOM 0 HA THR A 92 12.557 0.360 -7.286 1.00 0.00 H new ATOM 0 HB THR A 92 13.785 -1.316 -9.527 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.903 0.379 -10.852 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.443 -1.472 -10.318 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.616 -2.167 -8.689 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.900 -0.551 -8.896 1.00 0.00 H new ATOM 1425 N ARG A 93 12.210 -2.013 -6.386 1.00 0.00 N ATOM 1426 CA ARG A 93 12.135 -3.277 -5.591 1.00 0.00 C ATOM 1427 C ARG A 93 10.835 -4.002 -5.954 1.00 0.00 C ATOM 1428 O ARG A 93 9.908 -3.407 -6.467 1.00 0.00 O ATOM 1429 CB ARG A 93 12.148 -2.945 -4.084 1.00 0.00 C ATOM 1430 CG ARG A 93 11.404 -1.613 -3.818 1.00 0.00 C ATOM 1431 CD ARG A 93 12.398 -0.441 -3.764 1.00 0.00 C ATOM 1432 NE ARG A 93 13.010 -0.370 -2.408 1.00 0.00 N ATOM 1433 CZ ARG A 93 14.080 0.351 -2.214 1.00 0.00 C ATOM 1434 NH1 ARG A 93 14.610 1.011 -3.208 1.00 0.00 N ATOM 1435 NH2 ARG A 93 14.619 0.416 -1.028 1.00 0.00 N ATOM 0 H ARG A 93 11.321 -1.526 -6.501 1.00 0.00 H new ATOM 0 HA ARG A 93 12.991 -3.913 -5.816 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.675 -3.751 -3.523 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.176 -2.871 -3.730 1.00 0.00 H new ATOM 0 HG2 ARG A 93 10.669 -1.438 -4.603 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.857 -1.677 -2.877 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.174 -0.573 -4.518 1.00 0.00 H new ATOM 0 HD3 ARG A 93 11.887 0.494 -3.993 1.00 0.00 H new ATOM 0 HE ARG A 93 12.593 -0.884 -1.632 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.188 0.963 -4.135 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.446 1.575 -3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.204 -0.097 -0.250 1.00 0.00 H new ATOM 0 HH22 ARG A 93 15.455 0.980 -0.878 1.00 0.00 H new ATOM 1449 N LYS A 94 10.763 -5.284 -5.703 1.00 0.00 N ATOM 1450 CA LYS A 94 9.524 -6.049 -6.046 1.00 0.00 C ATOM 1451 C LYS A 94 9.247 -7.107 -4.977 1.00 0.00 C ATOM 1452 O LYS A 94 10.098 -7.439 -4.176 1.00 0.00 O ATOM 1453 CB LYS A 94 9.722 -6.740 -7.398 1.00 0.00 C ATOM 1454 CG LYS A 94 11.080 -7.440 -7.417 1.00 0.00 C ATOM 1455 CD LYS A 94 11.204 -8.275 -8.693 1.00 0.00 C ATOM 1456 CE LYS A 94 12.652 -8.737 -8.862 1.00 0.00 C ATOM 1457 NZ LYS A 94 12.727 -9.738 -9.965 1.00 0.00 N ATOM 0 H LYS A 94 11.508 -5.835 -5.276 1.00 0.00 H new ATOM 0 HA LYS A 94 8.679 -5.362 -6.095 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.925 -7.464 -7.569 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.666 -6.008 -8.204 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.882 -6.703 -7.372 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.185 -8.079 -6.540 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.540 -9.138 -8.642 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.896 -7.686 -9.557 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.294 -7.885 -9.085 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.016 -9.175 -7.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.711 -10.053 -10.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.127 -10.555 -9.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.395 -9.305 -10.850 1.00 0.00 H new ATOM 1471 N TYR A 95 8.055 -7.642 -4.970 1.00 0.00 N ATOM 1472 CA TYR A 95 7.691 -8.691 -3.968 1.00 0.00 C ATOM 1473 C TYR A 95 6.819 -9.744 -4.657 1.00 0.00 C ATOM 1474 O TYR A 95 6.603 -9.695 -5.853 1.00 0.00 O ATOM 1475 CB TYR A 95 6.896 -8.060 -2.810 1.00 0.00 C ATOM 1476 CG TYR A 95 7.567 -6.785 -2.339 1.00 0.00 C ATOM 1477 CD1 TYR A 95 7.558 -5.644 -3.158 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.193 -6.735 -1.079 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.176 -4.465 -2.723 1.00 0.00 C ATOM 1480 CE2 TYR A 95 8.809 -5.554 -0.652 1.00 0.00 C ATOM 1481 CZ TYR A 95 8.801 -4.421 -1.473 1.00 0.00 C ATOM 1482 OH TYR A 95 9.409 -3.257 -1.047 1.00 0.00 O ATOM 0 H TYR A 95 7.310 -7.396 -5.621 1.00 0.00 H new ATOM 0 HA TYR A 95 8.598 -9.147 -3.572 1.00 0.00 H new ATOM 0 HB2 TYR A 95 5.878 -7.844 -3.135 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.823 -8.767 -1.983 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.074 -5.676 -4.123 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.198 -7.608 -0.443 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.170 -3.588 -3.354 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.292 -5.517 0.313 1.00 0.00 H new ATOM 0 HH TYR A 95 9.794 -3.396 -0.157 1.00 0.00 H new ATOM 1492 N LYS A 96 6.308 -10.693 -3.915 1.00 0.00 N ATOM 1493 CA LYS A 96 5.438 -11.746 -4.526 1.00 0.00 C ATOM 1494 C LYS A 96 4.306 -12.077 -3.558 1.00 0.00 C ATOM 1495 O LYS A 96 4.528 -12.577 -2.473 1.00 0.00 O ATOM 1496 CB LYS A 96 6.259 -13.006 -4.809 1.00 0.00 C ATOM 1497 CG LYS A 96 5.386 -14.026 -5.546 1.00 0.00 C ATOM 1498 CD LYS A 96 6.266 -15.147 -6.105 1.00 0.00 C ATOM 1499 CE LYS A 96 5.384 -16.193 -6.792 1.00 0.00 C ATOM 1500 NZ LYS A 96 6.228 -17.061 -7.661 1.00 0.00 N ATOM 0 H LYS A 96 6.455 -10.785 -2.910 1.00 0.00 H new ATOM 0 HA LYS A 96 5.026 -11.377 -5.465 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.133 -12.757 -5.411 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.626 -13.432 -3.875 1.00 0.00 H new ATOM 0 HG2 LYS A 96 4.641 -14.440 -4.867 1.00 0.00 H new ATOM 0 HG3 LYS A 96 4.844 -13.538 -6.356 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.986 -14.739 -6.815 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.839 -15.610 -5.301 1.00 0.00 H new ATOM 0 HE2 LYS A 96 4.870 -16.798 -6.045 1.00 0.00 H new ATOM 0 HE3 LYS A 96 4.615 -15.701 -7.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 5.629 -17.772 -8.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.699 -16.478 -8.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.946 -17.540 -7.081 1.00 0.00 H new ATOM 1514 N MET A 97 3.091 -11.788 -3.939 1.00 0.00 N ATOM 1515 CA MET A 97 1.940 -12.077 -3.039 1.00 0.00 C ATOM 1516 C MET A 97 2.036 -13.517 -2.529 1.00 0.00 C ATOM 1517 O MET A 97 1.852 -14.461 -3.271 1.00 0.00 O ATOM 1518 CB MET A 97 0.631 -11.889 -3.810 1.00 0.00 C ATOM 1519 CG MET A 97 0.429 -10.407 -4.152 1.00 0.00 C ATOM 1520 SD MET A 97 -0.315 -9.558 -2.734 1.00 0.00 S ATOM 1521 CE MET A 97 -1.486 -8.524 -3.651 1.00 0.00 C ATOM 0 H MET A 97 2.847 -11.365 -4.834 1.00 0.00 H new ATOM 0 HA MET A 97 1.961 -11.393 -2.190 1.00 0.00 H new ATOM 0 HB2 MET A 97 0.650 -12.482 -4.724 1.00 0.00 H new ATOM 0 HB3 MET A 97 -0.207 -12.250 -3.213 1.00 0.00 H new ATOM 0 HG2 MET A 97 1.384 -9.947 -4.405 1.00 0.00 H new ATOM 0 HG3 MET A 97 -0.214 -10.309 -5.027 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.151 -8.018 -2.951 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.939 -7.782 -4.232 1.00 0.00 H new ATOM 0 HE3 MET A 97 -2.074 -9.149 -4.323 1.00 0.00 H new ATOM 1531 N THR A 98 2.321 -13.689 -1.264 1.00 0.00 N ATOM 1532 CA THR A 98 2.431 -15.064 -0.687 1.00 0.00 C ATOM 1533 C THR A 98 1.782 -15.080 0.699 1.00 0.00 C ATOM 1534 O THR A 98 2.055 -15.939 1.513 1.00 0.00 O ATOM 1535 CB THR A 98 3.908 -15.448 -0.558 1.00 0.00 C ATOM 1536 OG1 THR A 98 4.635 -14.350 -0.024 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.467 -15.809 -1.935 1.00 0.00 C ATOM 0 H THR A 98 2.483 -12.931 -0.601 1.00 0.00 H new ATOM 0 HA THR A 98 1.926 -15.776 -1.340 1.00 0.00 H new ATOM 0 HB THR A 98 4.003 -16.307 0.106 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.777 -13.680 -0.725 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.518 -16.082 -1.841 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.909 -16.651 -2.345 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.373 -14.952 -2.602 1.00 0.00 H new ATOM 1545 N SER A 99 0.924 -14.135 0.972 1.00 0.00 N ATOM 1546 CA SER A 99 0.257 -14.094 2.300 1.00 0.00 C ATOM 1547 C SER A 99 -0.877 -13.081 2.238 1.00 0.00 C ATOM 1548 O SER A 99 -0.674 -11.932 1.909 1.00 0.00 O ATOM 1549 CB SER A 99 1.266 -13.672 3.362 1.00 0.00 C ATOM 1550 OG SER A 99 0.593 -13.484 4.601 1.00 0.00 O ATOM 0 H SER A 99 0.657 -13.389 0.330 1.00 0.00 H new ATOM 0 HA SER A 99 -0.136 -15.078 2.555 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.040 -14.432 3.467 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.763 -12.750 3.062 1.00 0.00 H new ATOM 0 HG SER A 99 1.239 -13.214 5.287 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.079 -13.499 2.529 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.241 -12.562 2.466 1.00 0.00 C ATOM 1558 C ILE A 100 -4.122 -12.766 3.699 1.00 0.00 C ATOM 1559 O ILE A 100 -4.566 -13.861 3.983 1.00 0.00 O ATOM 1560 CB ILE A 100 -4.044 -12.858 1.195 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.222 -12.455 -0.035 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.350 -12.062 1.211 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.854 -13.055 -1.290 1.00 0.00 C ATOM 0 H ILE A 100 -2.309 -14.453 2.809 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.892 -11.530 2.445 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.269 -13.924 1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.182 -11.369 -0.119 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.195 -12.805 0.070 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.917 -12.276 0.305 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.938 -12.346 2.083 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.126 -10.996 1.256 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.270 -12.768 -2.164 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.871 -14.142 -1.205 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.873 -12.684 -1.397 1.00 0.00 H new ATOM 1575 N ARG A 101 -4.377 -11.719 4.433 1.00 0.00 N ATOM 1576 CA ARG A 101 -5.226 -11.849 5.646 1.00 0.00 C ATOM 1577 C ARG A 101 -6.696 -11.887 5.231 1.00 0.00 C ATOM 1578 O ARG A 101 -7.345 -12.910 5.312 1.00 0.00 O ATOM 1579 CB ARG A 101 -4.987 -10.649 6.572 1.00 0.00 C ATOM 1580 CG ARG A 101 -3.501 -10.559 6.951 1.00 0.00 C ATOM 1581 CD ARG A 101 -3.156 -11.587 8.039 1.00 0.00 C ATOM 1582 NE ARG A 101 -4.117 -11.479 9.171 1.00 0.00 N ATOM 1583 CZ ARG A 101 -4.219 -12.451 10.036 1.00 0.00 C ATOM 1584 NH1 ARG A 101 -3.477 -13.517 9.910 1.00 0.00 N ATOM 1585 NH2 ARG A 101 -5.064 -12.358 11.026 1.00 0.00 N ATOM 0 H ARG A 101 -4.033 -10.778 4.243 1.00 0.00 H new ATOM 0 HA ARG A 101 -4.970 -12.768 6.173 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -5.300 -9.730 6.076 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -5.594 -10.748 7.472 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -2.884 -10.734 6.069 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -3.271 -9.555 7.306 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.186 -12.593 7.621 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.140 -11.421 8.398 1.00 0.00 H new ATOM 0 HE ARG A 101 -4.696 -10.645 9.271 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -2.817 -13.591 9.136 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -3.557 -14.277 10.586 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -5.645 -11.525 11.124 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.143 -13.118 11.702 1.00 0.00 H new ATOM 1599 N ASP A 102 -7.238 -10.777 4.800 1.00 0.00 N ATOM 1600 CA ASP A 102 -8.677 -10.760 4.403 1.00 0.00 C ATOM 1601 C ASP A 102 -9.494 -11.371 5.543 1.00 0.00 C ATOM 1602 O ASP A 102 -10.651 -11.709 5.395 1.00 0.00 O ATOM 1603 CB ASP A 102 -8.872 -11.582 3.127 1.00 0.00 C ATOM 1604 CG ASP A 102 -8.230 -10.852 1.945 1.00 0.00 C ATOM 1605 OD1 ASP A 102 -7.310 -10.085 2.177 1.00 0.00 O ATOM 1606 OD2 ASP A 102 -8.668 -11.074 0.829 1.00 0.00 O ATOM 0 H ASP A 102 -6.749 -9.887 4.706 1.00 0.00 H new ATOM 0 HA ASP A 102 -9.003 -9.738 4.212 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.424 -12.569 3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.935 -11.735 2.939 1.00 0.00 H new ATOM 1611 N VAL A 103 -8.874 -11.508 6.680 1.00 0.00 N ATOM 1612 CA VAL A 103 -9.553 -12.091 7.867 1.00 0.00 C ATOM 1613 C VAL A 103 -10.527 -11.045 8.438 1.00 0.00 C ATOM 1614 O VAL A 103 -10.307 -9.858 8.305 1.00 0.00 O ATOM 1615 CB VAL A 103 -8.459 -12.457 8.887 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -9.056 -12.659 10.273 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -7.765 -13.752 8.454 1.00 0.00 C ATOM 0 H VAL A 103 -7.904 -11.234 6.839 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.125 -12.984 7.615 1.00 0.00 H new ATOM 0 HB VAL A 103 -7.741 -11.638 8.925 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.264 -12.917 10.976 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -9.544 -11.739 10.597 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.788 -13.466 10.240 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.991 -14.009 9.177 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.497 -14.558 8.404 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -7.312 -13.612 7.473 1.00 0.00 H new ATOM 1627 N LYS A 104 -11.609 -11.462 9.054 1.00 0.00 N ATOM 1628 CA LYS A 104 -12.569 -10.452 9.593 1.00 0.00 C ATOM 1629 C LYS A 104 -11.881 -9.619 10.692 1.00 0.00 C ATOM 1630 O LYS A 104 -11.665 -8.439 10.503 1.00 0.00 O ATOM 1631 CB LYS A 104 -13.872 -11.134 10.073 1.00 0.00 C ATOM 1632 CG LYS A 104 -14.657 -10.204 11.008 1.00 0.00 C ATOM 1633 CD LYS A 104 -16.021 -10.825 11.316 1.00 0.00 C ATOM 1634 CE LYS A 104 -16.677 -10.074 12.475 1.00 0.00 C ATOM 1635 NZ LYS A 104 -16.961 -8.672 12.060 1.00 0.00 N ATOM 0 H LYS A 104 -11.864 -12.438 9.204 1.00 0.00 H new ATOM 0 HA LYS A 104 -12.864 -9.763 8.801 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -14.488 -11.399 9.214 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -13.633 -12.062 10.592 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -14.101 -10.045 11.932 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -14.787 -9.227 10.542 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -16.659 -10.781 10.434 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -15.903 -11.878 11.572 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.601 -10.572 12.769 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -16.021 -10.081 13.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -17.569 -8.216 12.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -16.067 -8.146 11.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -17.445 -8.674 11.140 1.00 0.00 H new ATOM 1649 N PRO A 105 -11.498 -10.199 11.810 1.00 0.00 N ATOM 1650 CA PRO A 105 -10.779 -9.444 12.885 1.00 0.00 C ATOM 1651 C PRO A 105 -9.419 -8.932 12.385 1.00 0.00 C ATOM 1652 O PRO A 105 -8.432 -8.961 13.091 1.00 0.00 O ATOM 1653 CB PRO A 105 -10.602 -10.485 14.008 1.00 0.00 C ATOM 1654 CG PRO A 105 -10.677 -11.803 13.312 1.00 0.00 C ATOM 1655 CD PRO A 105 -11.699 -11.603 12.196 1.00 0.00 C ATOM 0 HA PRO A 105 -11.323 -8.559 13.214 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.647 -10.360 14.518 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -11.382 -10.390 14.763 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -9.706 -12.093 12.911 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -10.988 -12.593 13.995 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -11.522 -12.280 11.361 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -12.716 -11.784 12.543 1.00 0.00 H new ATOM 1663 N THR A 106 -9.365 -8.465 11.165 1.00 0.00 N ATOM 1664 CA THR A 106 -8.080 -7.953 10.612 1.00 0.00 C ATOM 1665 C THR A 106 -7.444 -6.998 11.621 1.00 0.00 C ATOM 1666 O THR A 106 -7.736 -5.821 11.652 1.00 0.00 O ATOM 1667 CB THR A 106 -8.349 -7.222 9.288 1.00 0.00 C ATOM 1668 OG1 THR A 106 -7.130 -6.696 8.786 1.00 0.00 O ATOM 1669 CG2 THR A 106 -9.349 -6.070 9.496 1.00 0.00 C ATOM 0 H THR A 106 -10.159 -8.417 10.527 1.00 0.00 H new ATOM 0 HA THR A 106 -7.399 -8.783 10.426 1.00 0.00 H new ATOM 0 HB THR A 106 -8.773 -7.932 8.578 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.998 -5.789 9.133 1.00 0.00 H new ATOM 0 HG21 THR A 106 -9.526 -5.565 8.546 1.00 0.00 H new ATOM 0 HG22 THR A 106 -10.290 -6.469 9.875 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.941 -5.359 10.214 1.00 0.00 H new ATOM 1677 N ASP A 107 -6.575 -7.508 12.450 1.00 0.00 N ATOM 1678 CA ASP A 107 -5.913 -6.641 13.472 1.00 0.00 C ATOM 1679 C ASP A 107 -5.096 -7.504 14.450 1.00 0.00 C ATOM 1680 O ASP A 107 -4.443 -6.990 15.337 1.00 0.00 O ATOM 1681 CB ASP A 107 -6.980 -5.848 14.250 1.00 0.00 C ATOM 1682 CG ASP A 107 -8.255 -6.686 14.368 1.00 0.00 C ATOM 1683 OD1 ASP A 107 -8.250 -7.632 15.138 1.00 0.00 O ATOM 1684 OD2 ASP A 107 -9.214 -6.366 13.685 1.00 0.00 O ATOM 0 H ASP A 107 -6.293 -8.488 12.466 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.242 -5.947 12.965 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -6.607 -5.593 15.242 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.195 -4.910 13.739 1.00 0.00 H new ATOM 1689 N VAL A 108 -5.120 -8.803 14.306 1.00 0.00 N ATOM 1690 CA VAL A 108 -4.338 -9.663 15.238 1.00 0.00 C ATOM 1691 C VAL A 108 -2.846 -9.504 14.951 1.00 0.00 C ATOM 1692 O VAL A 108 -2.033 -10.305 15.367 1.00 0.00 O ATOM 1693 CB VAL A 108 -4.746 -11.125 15.052 1.00 0.00 C ATOM 1694 CG1 VAL A 108 -6.242 -11.280 15.335 1.00 0.00 C ATOM 1695 CG2 VAL A 108 -4.453 -11.555 13.613 1.00 0.00 C ATOM 0 H VAL A 108 -5.644 -9.302 13.587 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.541 -9.361 16.265 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.180 -11.750 15.743 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -6.531 -12.322 15.202 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.452 -10.973 16.359 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.809 -10.655 14.645 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -4.743 -12.597 13.478 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.019 -10.929 12.924 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.388 -11.446 13.410 1.00 0.00 H new ATOM 1705 N GLY A 109 -2.482 -8.467 14.247 1.00 0.00 N ATOM 1706 CA GLY A 109 -1.039 -8.228 13.926 1.00 0.00 C ATOM 1707 C GLY A 109 -0.898 -7.751 12.478 1.00 0.00 C ATOM 1708 O GLY A 109 0.152 -7.867 11.877 1.00 0.00 O ATOM 0 H GLY A 109 -3.125 -7.768 13.876 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.625 -7.483 14.605 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.468 -9.145 14.073 1.00 0.00 H new ATOM 1712 N VAL A 110 -1.940 -7.207 11.911 1.00 0.00 N ATOM 1713 CA VAL A 110 -1.859 -6.718 10.517 1.00 0.00 C ATOM 1714 C VAL A 110 -0.950 -5.492 10.483 1.00 0.00 C ATOM 1715 O VAL A 110 -0.218 -5.268 9.539 1.00 0.00 O ATOM 1716 CB VAL A 110 -3.267 -6.358 10.035 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -4.214 -7.521 10.345 1.00 0.00 C ATOM 1718 CG2 VAL A 110 -3.758 -5.087 10.748 1.00 0.00 C ATOM 0 H VAL A 110 -2.847 -7.082 12.361 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.448 -7.485 9.861 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.247 -6.174 8.961 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.219 -7.272 10.005 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.869 -8.418 9.831 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.229 -7.701 11.420 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.760 -4.838 10.399 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.781 -5.259 11.824 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.082 -4.261 10.527 1.00 0.00 H new ATOM 1728 N LEU A 111 -0.992 -4.699 11.523 1.00 0.00 N ATOM 1729 CA LEU A 111 -0.136 -3.479 11.588 1.00 0.00 C ATOM 1730 C LEU A 111 0.421 -3.338 13.007 1.00 0.00 C ATOM 1731 O LEU A 111 -0.014 -2.501 13.772 1.00 0.00 O ATOM 1732 CB LEU A 111 -0.976 -2.239 11.247 1.00 0.00 C ATOM 1733 CG LEU A 111 -1.272 -2.194 9.733 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -2.534 -1.361 9.479 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -0.097 -1.552 8.978 1.00 0.00 C ATOM 0 H LEU A 111 -1.589 -4.847 12.337 1.00 0.00 H new ATOM 0 HA LEU A 111 0.682 -3.567 10.873 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.911 -2.259 11.807 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -0.444 -1.337 11.548 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.418 -3.214 9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -2.741 -1.331 8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.379 -1.812 9.999 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.381 -0.347 9.848 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.320 -1.527 7.911 1.00 0.00 H new ATOM 0 HD22 LEU A 111 0.057 -0.536 9.340 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.807 -2.138 9.146 1.00 0.00 H new ATOM 1747 N ASP A 112 1.381 -4.156 13.362 1.00 0.00 N ATOM 1748 CA ASP A 112 1.979 -4.085 14.733 1.00 0.00 C ATOM 1749 C ASP A 112 3.503 -4.162 14.618 1.00 0.00 C ATOM 1750 O ASP A 112 4.144 -3.240 14.154 1.00 0.00 O ATOM 1751 CB ASP A 112 1.473 -5.263 15.567 1.00 0.00 C ATOM 1752 CG ASP A 112 2.047 -5.175 16.982 1.00 0.00 C ATOM 1753 OD1 ASP A 112 1.815 -4.170 17.632 1.00 0.00 O ATOM 1754 OD2 ASP A 112 2.709 -6.116 17.391 1.00 0.00 O ATOM 0 H ASP A 112 1.779 -4.875 12.757 1.00 0.00 H new ATOM 0 HA ASP A 112 1.693 -3.149 15.213 1.00 0.00 H new ATOM 0 HB2 ASP A 112 0.384 -5.254 15.605 1.00 0.00 H new ATOM 0 HB3 ASP A 112 1.768 -6.204 15.102 1.00 0.00 H new ATOM 1759 N GLU A 113 4.089 -5.253 15.029 1.00 0.00 N ATOM 1760 CA GLU A 113 5.566 -5.382 14.931 1.00 0.00 C ATOM 1761 C GLU A 113 5.930 -5.796 13.506 1.00 0.00 C ATOM 1762 O GLU A 113 5.082 -5.887 12.641 1.00 0.00 O ATOM 1763 CB GLU A 113 6.053 -6.446 15.918 1.00 0.00 C ATOM 1764 CG GLU A 113 5.435 -7.799 15.555 1.00 0.00 C ATOM 1765 CD GLU A 113 5.601 -8.769 16.725 1.00 0.00 C ATOM 1766 OE1 GLU A 113 5.489 -8.327 17.857 1.00 0.00 O ATOM 1767 OE2 GLU A 113 5.835 -9.939 16.470 1.00 0.00 O ATOM 0 H GLU A 113 3.607 -6.059 15.428 1.00 0.00 H new ATOM 0 HA GLU A 113 6.040 -4.430 15.171 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.141 -6.512 15.891 1.00 0.00 H new ATOM 0 HB3 GLU A 113 5.776 -6.168 16.935 1.00 0.00 H new ATOM 0 HG2 GLU A 113 4.378 -7.676 15.319 1.00 0.00 H new ATOM 0 HG3 GLU A 113 5.916 -8.202 14.664 1.00 0.00 H new ATOM 1774 N GLN A 114 7.184 -6.047 13.252 1.00 0.00 N ATOM 1775 CA GLN A 114 7.603 -6.454 11.883 1.00 0.00 C ATOM 1776 C GLN A 114 7.559 -7.982 11.786 1.00 0.00 C ATOM 1777 O GLN A 114 8.568 -8.631 11.588 1.00 0.00 O ATOM 1778 CB GLN A 114 9.031 -5.944 11.621 1.00 0.00 C ATOM 1779 CG GLN A 114 9.236 -4.602 12.332 1.00 0.00 C ATOM 1780 CD GLN A 114 8.124 -3.628 11.935 1.00 0.00 C ATOM 1781 OE1 GLN A 114 8.222 -2.957 10.929 1.00 0.00 O ATOM 1782 NE2 GLN A 114 7.069 -3.513 12.695 1.00 0.00 N ATOM 0 H GLN A 114 7.938 -5.987 13.936 1.00 0.00 H new ATOM 0 HA GLN A 114 6.932 -6.027 11.138 1.00 0.00 H new ATOM 0 HB2 GLN A 114 9.759 -6.672 11.979 1.00 0.00 H new ATOM 0 HB3 GLN A 114 9.196 -5.828 10.550 1.00 0.00 H new ATOM 0 HG2 GLN A 114 9.235 -4.749 13.412 1.00 0.00 H new ATOM 0 HG3 GLN A 114 10.208 -4.185 12.068 1.00 0.00 H new ATOM 0 HE21 GLN A 114 6.986 -4.077 13.541 1.00 0.00 H new ATOM 0 HE22 GLN A 114 6.328 -2.859 12.443 1.00 0.00 H new ATOM 1791 N LYS A 115 6.391 -8.562 11.926 1.00 0.00 N ATOM 1792 CA LYS A 115 6.274 -10.051 11.844 1.00 0.00 C ATOM 1793 C LYS A 115 7.089 -10.554 10.660 1.00 0.00 C ATOM 1794 O LYS A 115 7.939 -11.410 10.797 1.00 0.00 O ATOM 1795 CB LYS A 115 4.804 -10.444 11.654 1.00 0.00 C ATOM 1796 CG LYS A 115 3.975 -10.012 12.875 1.00 0.00 C ATOM 1797 CD LYS A 115 4.112 -11.042 14.007 1.00 0.00 C ATOM 1798 CE LYS A 115 3.112 -10.714 15.117 1.00 0.00 C ATOM 1799 NZ LYS A 115 1.735 -10.667 14.550 1.00 0.00 N ATOM 0 H LYS A 115 5.514 -8.068 12.093 1.00 0.00 H new ATOM 0 HA LYS A 115 6.650 -10.496 12.765 1.00 0.00 H new ATOM 0 HB2 LYS A 115 4.409 -9.975 10.753 1.00 0.00 H new ATOM 0 HB3 LYS A 115 4.724 -11.522 11.514 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.309 -9.034 13.222 1.00 0.00 H new ATOM 0 HG3 LYS A 115 2.927 -9.909 12.593 1.00 0.00 H new ATOM 0 HD2 LYS A 115 3.930 -12.046 13.624 1.00 0.00 H new ATOM 0 HD3 LYS A 115 5.128 -11.031 14.403 1.00 0.00 H new ATOM 0 HE2 LYS A 115 3.167 -11.466 15.904 1.00 0.00 H new ATOM 0 HE3 LYS A 115 3.361 -9.756 15.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.043 -10.851 15.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 1.560 -9.727 14.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 1.640 -11.390 13.808 1.00 0.00 H new ATOM 1813 N GLY A 116 6.856 -10.015 9.501 1.00 0.00 N ATOM 1814 CA GLY A 116 7.640 -10.455 8.327 1.00 0.00 C ATOM 1815 C GLY A 116 9.115 -10.158 8.595 1.00 0.00 C ATOM 1816 O GLY A 116 9.526 -9.022 8.691 1.00 0.00 O ATOM 0 H GLY A 116 6.160 -9.292 9.319 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.493 -11.521 8.150 1.00 0.00 H new ATOM 0 HA3 GLY A 116 7.305 -9.934 7.430 1.00 0.00 H new ATOM 1820 N LYS A 117 9.917 -11.168 8.725 1.00 0.00 N ATOM 1821 CA LYS A 117 11.362 -10.925 8.993 1.00 0.00 C ATOM 1822 C LYS A 117 12.046 -10.581 7.672 1.00 0.00 C ATOM 1823 O LYS A 117 13.203 -10.207 7.635 1.00 0.00 O ATOM 1824 CB LYS A 117 11.990 -12.192 9.578 1.00 0.00 C ATOM 1825 CG LYS A 117 11.429 -13.422 8.860 1.00 0.00 C ATOM 1826 CD LYS A 117 12.310 -14.639 9.155 1.00 0.00 C ATOM 1827 CE LYS A 117 11.826 -15.831 8.330 1.00 0.00 C ATOM 1828 NZ LYS A 117 10.508 -16.294 8.848 1.00 0.00 N ATOM 0 H LYS A 117 9.642 -12.148 8.659 1.00 0.00 H new ATOM 0 HA LYS A 117 11.481 -10.106 9.702 1.00 0.00 H new ATOM 0 HB2 LYS A 117 13.074 -12.157 9.468 1.00 0.00 H new ATOM 0 HB3 LYS A 117 11.780 -12.254 10.646 1.00 0.00 H new ATOM 0 HG2 LYS A 117 10.407 -13.612 9.189 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.390 -13.241 7.786 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.350 -14.415 8.915 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.273 -14.879 10.218 1.00 0.00 H new ATOM 0 HE2 LYS A 117 11.737 -15.548 7.281 1.00 0.00 H new ATOM 0 HE3 LYS A 117 12.553 -16.641 8.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 10.275 -17.217 8.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 10.554 -16.386 9.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 9.773 -15.603 8.594 1.00 0.00 H new ATOM 1842 N ASP A 118 11.322 -10.691 6.590 1.00 0.00 N ATOM 1843 CA ASP A 118 11.884 -10.361 5.243 1.00 0.00 C ATOM 1844 C ASP A 118 11.071 -9.217 4.631 1.00 0.00 C ATOM 1845 O ASP A 118 9.860 -9.214 4.714 1.00 0.00 O ATOM 1846 CB ASP A 118 11.788 -11.591 4.336 1.00 0.00 C ATOM 1847 CG ASP A 118 12.561 -12.752 4.965 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.779 -12.714 4.931 1.00 0.00 O ATOM 1849 OD2 ASP A 118 11.921 -13.661 5.469 1.00 0.00 O ATOM 0 H ASP A 118 10.350 -11.000 6.580 1.00 0.00 H new ATOM 0 HA ASP A 118 12.928 -10.063 5.342 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.744 -11.870 4.194 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.194 -11.362 3.351 1.00 0.00 H new ATOM 1854 N LYS A 119 11.738 -8.255 4.028 1.00 0.00 N ATOM 1855 CA LYS A 119 11.051 -7.077 3.387 1.00 0.00 C ATOM 1856 C LYS A 119 9.622 -7.444 2.963 1.00 0.00 C ATOM 1857 O LYS A 119 9.363 -7.872 1.857 1.00 0.00 O ATOM 1858 CB LYS A 119 11.860 -6.626 2.159 1.00 0.00 C ATOM 1859 CG LYS A 119 13.042 -5.750 2.598 1.00 0.00 C ATOM 1860 CD LYS A 119 14.035 -6.586 3.410 1.00 0.00 C ATOM 1861 CE LYS A 119 15.371 -5.846 3.500 1.00 0.00 C ATOM 1862 NZ LYS A 119 15.146 -4.480 4.053 1.00 0.00 N ATOM 0 H LYS A 119 12.755 -8.236 3.951 1.00 0.00 H new ATOM 0 HA LYS A 119 10.994 -6.265 4.112 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.225 -7.497 1.615 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.219 -6.069 1.476 1.00 0.00 H new ATOM 0 HG2 LYS A 119 13.538 -5.328 1.724 1.00 0.00 H new ATOM 0 HG3 LYS A 119 12.683 -4.913 3.196 1.00 0.00 H new ATOM 0 HD2 LYS A 119 13.641 -6.769 4.409 1.00 0.00 H new ATOM 0 HD3 LYS A 119 14.177 -7.559 2.940 1.00 0.00 H new ATOM 0 HE2 LYS A 119 16.063 -6.398 4.136 1.00 0.00 H new ATOM 0 HE3 LYS A 119 15.829 -5.780 2.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 16.050 -4.086 4.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.750 -3.866 3.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 14.480 -4.534 4.850 1.00 0.00 H new ATOM 1876 N GLN A 120 8.711 -7.281 3.874 1.00 0.00 N ATOM 1877 CA GLN A 120 7.280 -7.607 3.626 1.00 0.00 C ATOM 1878 C GLN A 120 6.557 -6.389 3.052 1.00 0.00 C ATOM 1879 O GLN A 120 7.015 -5.267 3.164 1.00 0.00 O ATOM 1880 CB GLN A 120 6.631 -7.998 4.960 1.00 0.00 C ATOM 1881 CG GLN A 120 6.779 -6.839 5.964 1.00 0.00 C ATOM 1882 CD GLN A 120 6.796 -7.364 7.396 1.00 0.00 C ATOM 1883 OE1 GLN A 120 5.773 -7.736 7.937 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.932 -7.407 8.032 1.00 0.00 N ATOM 0 H GLN A 120 8.903 -6.924 4.810 1.00 0.00 H new ATOM 0 HA GLN A 120 7.210 -8.428 2.913 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.577 -8.230 4.809 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.102 -8.898 5.356 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.699 -6.291 5.761 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.956 -6.136 5.839 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.786 -7.093 7.572 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.967 -7.755 8.990 1.00 0.00 H new ATOM 1893 N LEU A 121 5.425 -6.609 2.437 1.00 0.00 N ATOM 1894 CA LEU A 121 4.638 -5.487 1.840 1.00 0.00 C ATOM 1895 C LEU A 121 3.170 -5.646 2.248 1.00 0.00 C ATOM 1896 O LEU A 121 2.489 -6.542 1.795 1.00 0.00 O ATOM 1897 CB LEU A 121 4.761 -5.563 0.315 1.00 0.00 C ATOM 1898 CG LEU A 121 3.994 -4.412 -0.351 1.00 0.00 C ATOM 1899 CD1 LEU A 121 4.574 -3.056 0.086 1.00 0.00 C ATOM 1900 CD2 LEU A 121 4.108 -4.555 -1.875 1.00 0.00 C ATOM 0 H LEU A 121 5.006 -7.531 2.321 1.00 0.00 H new ATOM 0 HA LEU A 121 5.012 -4.525 2.191 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.812 -5.520 0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.372 -6.518 -0.039 1.00 0.00 H new ATOM 0 HG LEU A 121 2.948 -4.454 -0.048 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.019 -2.251 -0.395 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.492 -2.957 1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.623 -2.998 -0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.566 -3.742 -2.358 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.158 -4.516 -2.167 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.681 -5.509 -2.184 1.00 0.00 H new ATOM 1912 N THR A 122 2.681 -4.794 3.111 1.00 0.00 N ATOM 1913 CA THR A 122 1.259 -4.909 3.561 1.00 0.00 C ATOM 1914 C THR A 122 0.367 -4.009 2.704 1.00 0.00 C ATOM 1915 O THR A 122 0.171 -2.847 2.997 1.00 0.00 O ATOM 1916 CB THR A 122 1.159 -4.481 5.029 1.00 0.00 C ATOM 1917 OG1 THR A 122 2.155 -5.157 5.783 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.225 -4.834 5.574 1.00 0.00 C ATOM 0 H THR A 122 3.204 -4.022 3.525 1.00 0.00 H new ATOM 0 HA THR A 122 0.928 -5.942 3.455 1.00 0.00 H new ATOM 0 HB THR A 122 1.311 -3.404 5.106 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.095 -4.884 6.722 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.294 -4.529 6.618 1.00 0.00 H new ATOM 0 HG22 THR A 122 -0.988 -4.315 4.993 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.382 -5.910 5.500 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.182 -4.542 1.648 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.066 -3.724 0.770 1.00 0.00 C ATOM 1928 C LEU A 123 -2.419 -3.527 1.463 1.00 0.00 C ATOM 1929 O LEU A 123 -2.875 -4.376 2.204 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.273 -4.455 -0.561 1.00 0.00 C ATOM 1931 CG LEU A 123 0.084 -4.750 -1.217 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.105 -5.782 -2.330 1.00 0.00 C ATOM 1933 CD2 LEU A 123 0.675 -3.466 -1.813 1.00 0.00 C ATOM 0 H LEU A 123 -0.057 -5.511 1.354 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.607 -2.753 0.583 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -1.815 -5.386 -0.393 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -1.884 -3.847 -1.228 1.00 0.00 H new ATOM 0 HG LEU A 123 0.766 -5.139 -0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.857 -5.993 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -0.513 -6.701 -1.909 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -0.793 -5.388 -3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.637 -3.688 -2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -0.005 -3.067 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 123 0.814 -2.728 -1.023 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.063 -2.406 1.235 1.00 0.00 N ATOM 1946 CA ILE A 124 -4.389 -2.141 1.887 1.00 0.00 C ATOM 1947 C ILE A 124 -5.337 -1.494 0.878 1.00 0.00 C ATOM 1948 O ILE A 124 -4.933 -0.682 0.072 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.206 -1.168 3.055 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.089 -1.657 3.980 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -5.513 -1.060 3.841 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -2.821 -0.595 5.046 1.00 0.00 C ATOM 0 H ILE A 124 -2.728 -1.661 0.624 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.799 -3.086 2.242 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.935 -0.188 2.661 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.375 -2.598 4.450 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.183 -1.850 3.406 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.382 -0.367 4.672 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.303 -0.694 3.185 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.788 -2.042 4.227 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.026 -0.937 5.709 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.517 0.335 4.565 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.728 -0.424 5.626 1.00 0.00 H new ATOM 1964 N THR A 125 -6.601 -1.831 0.930 1.00 0.00 N ATOM 1965 CA THR A 125 -7.590 -1.213 -0.011 1.00 0.00 C ATOM 1966 C THR A 125 -8.433 -0.195 0.761 1.00 0.00 C ATOM 1967 O THR A 125 -8.579 -0.285 1.964 1.00 0.00 O ATOM 1968 CB THR A 125 -8.504 -2.299 -0.593 1.00 0.00 C ATOM 1969 OG1 THR A 125 -9.646 -2.452 0.240 1.00 0.00 O ATOM 1970 CG2 THR A 125 -7.750 -3.630 -0.674 1.00 0.00 C ATOM 0 H THR A 125 -6.993 -2.508 1.584 1.00 0.00 H new ATOM 0 HA THR A 125 -7.063 -0.719 -0.827 1.00 0.00 H new ATOM 0 HB THR A 125 -8.817 -2.004 -1.595 1.00 0.00 H new ATOM 0 HG1 THR A 125 -10.404 -1.970 -0.152 1.00 0.00 H new ATOM 0 HG21 THR A 125 -8.406 -4.395 -1.088 1.00 0.00 H new ATOM 0 HG22 THR A 125 -6.877 -3.515 -1.316 1.00 0.00 H new ATOM 0 HG23 THR A 125 -7.430 -3.928 0.324 1.00 0.00 H new ATOM 1978 N CYS A 126 -8.994 0.776 0.086 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.828 1.797 0.791 1.00 0.00 C ATOM 1980 C CYS A 126 -10.975 2.235 -0.123 1.00 0.00 C ATOM 1981 O CYS A 126 -10.888 2.130 -1.328 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.961 3.011 1.138 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.836 2.583 2.490 1.00 0.00 S ATOM 0 H CYS A 126 -8.911 0.906 -0.922 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.235 1.367 1.706 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.392 3.327 0.264 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.592 3.851 1.428 1.00 0.00 H new ATOM 0 HG CYS A 126 -7.952 1.318 2.767 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.049 2.724 0.440 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.200 3.173 -0.400 1.00 0.00 C ATOM 1991 C ASP A 127 -14.403 3.475 0.498 1.00 0.00 C ATOM 1992 O ASP A 127 -14.671 2.773 1.453 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.576 2.078 -1.415 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.297 0.698 -0.815 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -13.214 0.608 0.398 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -13.175 -0.245 -1.579 1.00 0.00 O ATOM 0 H ASP A 127 -12.179 2.832 1.446 1.00 0.00 H new ATOM 0 HA ASP A 127 -12.913 4.074 -0.942 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.629 2.163 -1.682 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.003 2.208 -2.333 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.125 4.516 0.189 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.316 4.879 1.004 1.00 0.00 C ATOM 2003 C ASP A 128 -15.894 5.076 2.453 1.00 0.00 C ATOM 2004 O ASP A 128 -16.325 4.363 3.332 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.360 3.760 0.934 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.602 3.367 -0.525 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -16.645 3.346 -1.281 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -18.742 3.092 -0.861 1.00 0.00 O ATOM 0 H ASP A 128 -14.939 5.135 -0.600 1.00 0.00 H new ATOM 0 HA ASP A 128 -16.748 5.800 0.613 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -17.017 2.895 1.501 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.293 4.091 1.390 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.059 6.037 2.722 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.633 6.253 4.127 1.00 0.00 C ATOM 2015 C TYR A 129 -15.867 6.600 4.961 1.00 0.00 C ATOM 2016 O TYR A 129 -16.559 7.560 4.685 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.610 7.393 4.188 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.108 7.562 5.604 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -13.890 8.229 6.553 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -11.853 7.059 5.962 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.414 8.393 7.860 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.377 7.220 7.266 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.158 7.889 8.216 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.687 8.053 9.504 1.00 0.00 O ATOM 0 H TYR A 129 -14.657 6.676 2.036 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.166 5.351 4.522 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -12.775 7.180 3.520 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.066 8.321 3.842 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.860 8.617 6.278 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.250 6.545 5.228 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.016 8.909 8.593 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.408 6.829 7.540 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.191 7.253 9.775 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.171 5.819 5.970 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.382 6.110 6.792 1.00 0.00 C ATOM 2036 C ASN A 130 -17.039 7.130 7.883 1.00 0.00 C ATOM 2037 O ASN A 130 -16.308 6.844 8.810 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.873 4.807 7.438 1.00 0.00 C ATOM 2039 CG ASN A 130 -19.348 4.938 7.824 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -20.105 5.614 7.156 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -19.790 4.314 8.879 1.00 0.00 N ATOM 0 H ASN A 130 -15.636 4.999 6.256 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.164 6.524 6.156 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.742 3.976 6.745 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -17.276 4.582 8.322 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -20.772 4.393 9.144 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -19.154 3.747 9.440 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.568 8.321 7.776 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.280 9.365 8.800 1.00 0.00 C ATOM 2050 C GLU A 131 -18.108 9.098 10.057 1.00 0.00 C ATOM 2051 O GLU A 131 -18.093 9.869 10.994 1.00 0.00 O ATOM 2052 CB GLU A 131 -17.633 10.746 8.242 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.096 10.761 7.799 1.00 0.00 C ATOM 2054 CD GLU A 131 -19.390 12.063 7.052 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.400 13.102 7.692 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -19.601 12.000 5.852 1.00 0.00 O ATOM 0 H GLU A 131 -18.188 8.615 7.021 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.220 9.335 9.052 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.464 11.510 9.001 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.985 10.985 7.399 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.301 9.906 7.155 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.750 10.671 8.666 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.825 8.008 10.091 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.642 7.700 11.299 1.00 0.00 C ATOM 2065 C LYS A 132 -18.728 7.118 12.379 1.00 0.00 C ATOM 2066 O LYS A 132 -18.681 7.600 13.492 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.733 6.684 10.948 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.506 7.160 9.714 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.719 6.254 9.488 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.616 6.860 8.407 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.600 5.840 7.940 1.00 0.00 N ATOM 0 H LYS A 132 -18.881 7.321 9.339 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.114 8.613 11.663 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -20.286 5.709 10.755 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.414 6.562 11.790 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.830 8.192 9.851 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -20.858 7.143 8.838 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.392 5.259 9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -23.278 6.139 10.417 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -24.140 7.731 8.801 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.010 7.205 7.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.208 6.255 7.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.092 5.022 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -25.187 5.531 8.741 1.00 0.00 H new ATOM 2085 N THR A 133 -17.992 6.086 12.053 1.00 0.00 N ATOM 2086 CA THR A 133 -17.068 5.469 13.053 1.00 0.00 C ATOM 2087 C THR A 133 -15.659 6.035 12.853 1.00 0.00 C ATOM 2088 O THR A 133 -14.766 5.795 13.640 1.00 0.00 O ATOM 2089 CB THR A 133 -17.036 3.951 12.850 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.814 3.661 11.478 1.00 0.00 O ATOM 2091 CG2 THR A 133 -18.370 3.347 13.293 1.00 0.00 C ATOM 0 H THR A 133 -17.991 5.643 11.134 1.00 0.00 H new ATOM 0 HA THR A 133 -17.417 5.695 14.061 1.00 0.00 H new ATOM 0 HB THR A 133 -16.230 3.522 13.446 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.792 2.690 11.348 1.00 0.00 H new ATOM 0 HG21 THR A 133 -18.346 2.267 13.148 1.00 0.00 H new ATOM 0 HG22 THR A 133 -18.537 3.568 14.347 1.00 0.00 H new ATOM 0 HG23 THR A 133 -19.178 3.775 12.700 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.455 6.785 11.803 1.00 0.00 N ATOM 2100 CA GLY A 134 -14.105 7.365 11.551 1.00 0.00 C ATOM 2101 C GLY A 134 -13.160 6.263 11.069 1.00 0.00 C ATOM 2102 O GLY A 134 -12.016 6.195 11.470 1.00 0.00 O ATOM 0 H GLY A 134 -16.165 7.021 11.110 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.171 8.156 10.803 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.716 7.819 12.462 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.631 5.394 10.212 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.763 4.286 9.709 1.00 0.00 C ATOM 2108 C VAL A 135 -13.127 3.951 8.261 1.00 0.00 C ATOM 2109 O VAL A 135 -14.239 4.174 7.824 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.994 3.040 10.570 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.841 2.055 10.371 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -13.072 3.442 12.044 1.00 0.00 C ATOM 0 H VAL A 135 -14.580 5.403 9.838 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.720 4.599 9.760 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.930 2.566 10.273 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -12.008 1.170 10.985 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.788 1.764 9.322 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.904 2.528 10.664 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -13.236 2.554 12.655 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -12.138 3.919 12.341 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.897 4.139 12.188 1.00 0.00 H new ATOM 2122 N TRP A 136 -12.208 3.393 7.522 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.519 3.020 6.121 1.00 0.00 C ATOM 2124 C TRP A 136 -13.642 1.983 6.139 1.00 0.00 C ATOM 2125 O TRP A 136 -13.458 0.875 6.603 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.268 2.427 5.454 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.394 3.536 4.960 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.213 3.904 5.505 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.620 4.428 3.833 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.706 4.970 4.785 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.534 5.327 3.744 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.653 4.540 2.891 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.476 6.308 2.755 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.600 5.525 1.891 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.511 6.408 1.824 1.00 0.00 C ATOM 0 H TRP A 136 -11.259 3.181 7.830 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.832 3.898 5.556 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.722 1.808 6.166 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.556 1.780 4.625 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.743 3.442 6.361 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -7.824 5.436 4.999 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.495 3.865 2.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -8.636 6.986 2.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.401 5.603 1.170 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.474 7.164 1.053 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.807 2.342 5.651 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.964 1.390 5.643 1.00 0.00 C ATOM 2148 C GLU A 137 -15.474 -0.030 5.325 1.00 0.00 C ATOM 2149 O GLU A 137 -15.308 -0.849 6.207 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.981 1.824 4.587 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.206 0.909 4.643 1.00 0.00 C ATOM 2152 CD GLU A 137 -19.254 1.402 3.643 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -19.455 2.604 3.570 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -19.837 0.570 2.969 1.00 0.00 O ATOM 0 H GLU A 137 -15.007 3.261 5.255 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.434 1.396 6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.279 2.858 4.759 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.530 1.783 3.596 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -17.919 -0.116 4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -18.623 0.902 5.650 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.221 -0.320 4.075 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.714 -1.678 3.707 1.00 0.00 C ATOM 2163 C LYS A 138 -13.185 -1.649 3.760 1.00 0.00 C ATOM 2164 O LYS A 138 -12.565 -0.696 3.329 1.00 0.00 O ATOM 2165 CB LYS A 138 -15.170 -2.042 2.289 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.671 -1.774 2.141 1.00 0.00 C ATOM 2167 CD LYS A 138 -17.108 -2.026 0.692 1.00 0.00 C ATOM 2168 CE LYS A 138 -16.795 -3.473 0.285 1.00 0.00 C ATOM 2169 NZ LYS A 138 -17.012 -4.383 1.446 1.00 0.00 N ATOM 0 H LYS A 138 -15.343 0.323 3.293 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.105 -2.422 4.401 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -14.613 -1.457 1.557 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.957 -3.092 2.087 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -17.232 -2.419 2.816 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.895 -0.745 2.424 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -18.176 -1.835 0.589 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -16.594 -1.334 0.025 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -17.432 -3.772 -0.547 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -15.764 -3.548 -0.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -17.151 -5.355 1.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -16.182 -4.351 2.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.855 -4.078 1.973 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.564 -2.669 4.293 1.00 0.00 N ATOM 2184 CA ARG A 139 -11.072 -2.660 4.375 1.00 0.00 C ATOM 2185 C ARG A 139 -10.525 -4.091 4.367 1.00 0.00 C ATOM 2186 O ARG A 139 -10.636 -4.813 5.338 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.650 -1.968 5.674 1.00 0.00 C ATOM 2188 CG ARG A 139 -9.131 -1.775 5.691 1.00 0.00 C ATOM 2189 CD ARG A 139 -8.699 -1.229 7.053 1.00 0.00 C ATOM 2190 NE ARG A 139 -9.085 0.205 7.162 1.00 0.00 N ATOM 2191 CZ ARG A 139 -9.097 0.790 8.329 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.758 0.120 9.396 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.447 2.043 8.430 1.00 0.00 N ATOM 0 H ARG A 139 -13.019 -3.500 4.672 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.672 -2.126 3.513 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -11.149 -1.003 5.761 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.959 -2.565 6.532 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -8.631 -2.723 5.493 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -8.833 -1.086 4.900 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.168 -1.804 7.852 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.621 -1.336 7.174 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.340 0.730 6.325 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.484 -0.859 9.318 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.767 0.576 10.309 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -9.712 2.567 7.596 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -9.456 2.498 9.343 1.00 0.00 H new ATOM 2207 N LYS A 140 -9.910 -4.492 3.281 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.314 -5.865 3.193 1.00 0.00 C ATOM 2209 C LYS A 140 -7.790 -5.724 3.197 1.00 0.00 C ATOM 2210 O LYS A 140 -7.240 -4.885 2.506 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.762 -6.538 1.894 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.294 -6.638 1.870 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.788 -7.011 0.454 1.00 0.00 C ATOM 2214 CE LYS A 140 -12.105 -5.747 -0.359 1.00 0.00 C ATOM 2215 NZ LYS A 140 -11.098 -4.688 -0.067 1.00 0.00 N ATOM 0 H LYS A 140 -9.794 -3.922 2.443 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.641 -6.473 4.036 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.411 -5.965 1.036 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.321 -7.532 1.816 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.627 -7.388 2.587 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.732 -5.688 2.176 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -11.027 -7.599 -0.059 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -12.678 -7.636 0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -12.102 -5.979 -1.424 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -13.104 -5.388 -0.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -11.204 -3.910 -0.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -11.245 -4.325 0.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -10.141 -5.088 -0.144 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.102 -6.518 3.984 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.607 -6.413 4.051 1.00 0.00 C ATOM 2231 C ILE A 141 -4.943 -7.569 3.293 1.00 0.00 C ATOM 2232 O ILE A 141 -5.243 -8.729 3.505 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.160 -6.457 5.514 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.053 -5.541 6.363 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -3.701 -6.004 5.618 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.064 -4.121 5.786 1.00 0.00 C ATOM 0 H ILE A 141 -7.511 -7.235 4.583 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.307 -5.472 3.591 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.248 -7.478 5.885 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.068 -5.937 6.391 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -5.690 -5.520 7.391 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.384 -6.036 6.660 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.071 -6.668 5.026 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.609 -4.985 5.241 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.702 -3.484 6.399 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.050 -3.722 5.781 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.449 -4.146 4.766 1.00 0.00 H new ATOM 2248 N PHE A 142 -4.021 -7.241 2.427 1.00 0.00 N ATOM 2249 CA PHE A 142 -3.275 -8.274 1.638 1.00 0.00 C ATOM 2250 C PHE A 142 -1.793 -8.166 2.027 1.00 0.00 C ATOM 2251 O PHE A 142 -1.367 -7.155 2.548 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.442 -7.980 0.135 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.727 -8.593 -0.384 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.959 -8.191 0.148 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -4.688 -9.561 -1.399 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -7.148 -8.753 -0.333 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -5.877 -10.122 -1.878 1.00 0.00 C ATOM 2258 CZ PHE A 142 -7.107 -9.719 -1.344 1.00 0.00 C ATOM 0 H PHE A 142 -3.745 -6.280 2.227 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.653 -9.275 1.844 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -3.452 -6.903 -0.032 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.592 -8.381 -0.417 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -5.992 -7.447 0.930 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -3.740 -9.873 -1.811 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -8.097 -8.441 0.077 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -5.846 -10.866 -2.660 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.024 -10.154 -1.713 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.999 -9.186 1.793 1.00 0.00 N ATOM 2269 CA VAL A 143 0.450 -9.100 2.177 1.00 0.00 C ATOM 2270 C VAL A 143 1.328 -9.862 1.174 1.00 0.00 C ATOM 2271 O VAL A 143 0.920 -10.843 0.579 1.00 0.00 O ATOM 2272 CB VAL A 143 0.648 -9.697 3.573 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.029 -9.311 4.103 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.427 -9.156 4.522 1.00 0.00 C ATOM 0 H VAL A 143 -1.285 -10.063 1.359 1.00 0.00 H new ATOM 0 HA VAL A 143 0.744 -8.050 2.174 1.00 0.00 H new ATOM 0 HB VAL A 143 0.569 -10.783 3.514 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.169 -9.736 5.097 1.00 0.00 H new ATOM 0 HG12 VAL A 143 2.797 -9.696 3.432 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.107 -8.225 4.159 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.284 -9.582 5.515 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.349 -8.070 4.579 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.414 -9.430 4.148 1.00 0.00 H new ATOM 2284 N ALA A 144 2.544 -9.409 0.997 1.00 0.00 N ATOM 2285 CA ALA A 144 3.487 -10.080 0.051 1.00 0.00 C ATOM 2286 C ALA A 144 4.904 -9.965 0.623 1.00 0.00 C ATOM 2287 O ALA A 144 5.102 -9.387 1.673 1.00 0.00 O ATOM 2288 CB ALA A 144 3.420 -9.378 -1.309 1.00 0.00 C ATOM 0 H ALA A 144 2.928 -8.593 1.474 1.00 0.00 H new ATOM 0 HA ALA A 144 3.220 -11.129 -0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.106 -9.863 -2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.404 -9.439 -1.700 1.00 0.00 H new ATOM 0 HB3 ALA A 144 3.702 -8.332 -1.193 1.00 0.00 H new ATOM 2294 N THR A 145 5.899 -10.501 -0.041 1.00 0.00 N ATOM 2295 CA THR A 145 7.281 -10.389 0.518 1.00 0.00 C ATOM 2296 C THR A 145 8.337 -10.642 -0.557 1.00 0.00 C ATOM 2297 O THR A 145 8.092 -11.288 -1.556 1.00 0.00 O ATOM 2298 CB THR A 145 7.459 -11.393 1.662 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.690 -11.136 2.326 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.466 -12.819 1.110 1.00 0.00 C ATOM 0 H THR A 145 5.818 -11.001 -0.927 1.00 0.00 H new ATOM 0 HA THR A 145 7.414 -9.374 0.893 1.00 0.00 H new ATOM 0 HB THR A 145 6.632 -11.287 2.364 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.906 -10.183 2.256 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.593 -13.526 1.930 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.522 -13.017 0.603 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.288 -12.932 0.403 1.00 0.00 H new ATOM 2308 N GLU A 146 9.520 -10.124 -0.343 1.00 0.00 N ATOM 2309 CA GLU A 146 10.624 -10.307 -1.327 1.00 0.00 C ATOM 2310 C GLU A 146 10.928 -11.794 -1.503 1.00 0.00 C ATOM 2311 O GLU A 146 11.026 -12.536 -0.546 1.00 0.00 O ATOM 2312 CB GLU A 146 11.879 -9.594 -0.824 1.00 0.00 C ATOM 2313 CG GLU A 146 12.985 -9.711 -1.876 1.00 0.00 C ATOM 2314 CD GLU A 146 14.176 -8.843 -1.469 1.00 0.00 C ATOM 2315 OE1 GLU A 146 14.950 -9.287 -0.636 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.294 -7.750 -1.996 1.00 0.00 O ATOM 0 H GLU A 146 9.768 -9.577 0.481 1.00 0.00 H new ATOM 0 HA GLU A 146 10.318 -9.886 -2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.660 -8.545 -0.626 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.209 -10.034 0.117 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.297 -10.751 -1.975 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.609 -9.397 -2.850 1.00 0.00 H new ATOM 2323 N VAL A 147 11.087 -12.234 -2.722 1.00 0.00 N ATOM 2324 CA VAL A 147 11.397 -13.675 -2.967 1.00 0.00 C ATOM 2325 C VAL A 147 12.904 -13.870 -2.996 1.00 0.00 C ATOM 2326 O VAL A 147 13.415 -14.963 -2.851 1.00 0.00 O ATOM 2327 CB VAL A 147 10.819 -14.096 -4.313 1.00 0.00 C ATOM 2328 CG1 VAL A 147 11.139 -15.569 -4.567 1.00 0.00 C ATOM 2329 CG2 VAL A 147 9.303 -13.896 -4.301 1.00 0.00 C ATOM 0 H VAL A 147 11.016 -11.658 -3.561 1.00 0.00 H new ATOM 0 HA VAL A 147 10.961 -14.279 -2.171 1.00 0.00 H new ATOM 0 HB VAL A 147 11.259 -13.489 -5.104 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.726 -15.870 -5.530 1.00 0.00 H new ATOM 0 HG12 VAL A 147 12.220 -15.710 -4.576 1.00 0.00 H new ATOM 0 HG13 VAL A 147 10.700 -16.178 -3.777 1.00 0.00 H new ATOM 0 HG21 VAL A 147 8.889 -14.197 -5.263 1.00 0.00 H new ATOM 0 HG22 VAL A 147 8.862 -14.503 -3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 147 9.076 -12.845 -4.121 1.00 0.00 H new ATOM 2339 N LYS A 148 13.609 -12.808 -3.182 1.00 0.00 N ATOM 2340 CA LYS A 148 15.097 -12.882 -3.229 1.00 0.00 C ATOM 2341 C LYS A 148 15.649 -12.998 -1.806 1.00 0.00 C ATOM 2342 O LYS A 148 14.900 -13.402 -0.933 1.00 0.00 O ATOM 2343 CB LYS A 148 15.648 -11.612 -3.889 1.00 0.00 C ATOM 2344 CG LYS A 148 15.365 -11.633 -5.403 1.00 0.00 C ATOM 2345 CD LYS A 148 16.477 -12.389 -6.143 1.00 0.00 C ATOM 2346 CE LYS A 148 16.231 -12.308 -7.651 1.00 0.00 C ATOM 2347 NZ LYS A 148 17.437 -12.794 -8.379 1.00 0.00 N ATOM 2348 OXT LYS A 148 16.811 -12.679 -1.615 1.00 0.00 O ATOM 0 H LYS A 148 13.222 -11.873 -3.306 1.00 0.00 H new ATOM 0 HA LYS A 148 15.400 -13.755 -3.807 1.00 0.00 H new ATOM 0 HB2 LYS A 148 15.190 -10.731 -3.438 1.00 0.00 H new ATOM 0 HB3 LYS A 148 16.721 -11.539 -3.713 1.00 0.00 H new ATOM 0 HG2 LYS A 148 14.403 -12.109 -5.593 1.00 0.00 H new ATOM 0 HG3 LYS A 148 15.296 -10.613 -5.781 1.00 0.00 H new ATOM 0 HD2 LYS A 148 17.449 -11.960 -5.898 1.00 0.00 H new ATOM 0 HD3 LYS A 148 16.499 -13.431 -5.823 1.00 0.00 H new ATOM 0 HE2 LYS A 148 15.363 -12.910 -7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 148 16.009 -11.281 -7.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 17.269 -12.739 -9.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 18.255 -12.202 -8.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 17.629 -13.781 -8.112 1.00 0.00 H new TER 2362 LYS A 148