USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1197 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 71 GLN : amide:sc= 1.06 K(o=4,f=3) USER MOD Set 1.2: A 75 THR OG1 : rot -71:sc= 1 USER MOD Set 1.3: B 75 THR OG1 : rot 80:sc= 1.9 USER MOD Set 2.1: B 17 HIS : no HE2:sc= 1.47 K(o=2.6,f=-9.7!) USER MOD Set 2.2: B 27 HIS : no HE2:sc= 1.11 K(o=2.6,f=-8!) USER MOD Set 3.1: A 19 TYR OH : rot -6:sc= 1.26 USER MOD Set 3.2: A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 35 LYS NZ :NH3+ -155:sc= 1.02 (180deg=0.567) USER MOD Set 4.2: A 39 GLN : amide:sc= 0.703 K(o=1.7,f=1) USER MOD Set 5.1: A 17 HIS : no HE2:sc= 1.61 K(o=3.9,f=-11!) USER MOD Set 5.2: A 27 HIS : no HE2:sc= 1.41 K(o=3.9,f=-12!) USER MOD Set 5.3: B 89 LYS NZ :NH3+ -176:sc= 0.903 (180deg=-0.236) USER MOD Single : A 3 SER OG : rot -22:sc= 0.767 USER MOD Single : A 7 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 18 LYS NZ :NH3+ -155:sc= 0.714 (180deg=-0.481) USER MOD Single : A 20 SER OG : rot -79:sc= 1 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 80:sc= 1.4 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0619) USER MOD Single : A 55 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.019) USER MOD Single : A 57 MET CE :methyl 165:sc= -0.0052 (180deg=-0.216) USER MOD Single : A 63 ASN : amide:sc= 1.64 K(o=1.6,f=-5.6!) USER MOD Single : A 64 LYS NZ :NH3+ -176:sc= -0.136 (180deg=-0.152) USER MOD Single : A 66 GLN : amide:sc= 1.17 K(o=1.2,f=-0.0044) USER MOD Single : A 69 ASN : amide:sc= 0.331 K(o=0.33,f=-2.5!) USER MOD Single : A 73 TYR OH : rot 154:sc= 1.18 USER MOD Single : A 82 MET CE :methyl 177:sc= 0 (180deg=-0.0265) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.671 K(o=0.67,f=-0.23) USER MOD Single : B 3 SER OG : rot 22:sc= 0.635 USER MOD Single : B 7 GLN : amide:sc= 0.896 K(o=0.9,f=0) USER MOD Single : B 18 LYS NZ :NH3+ 157:sc= 0.49 (180deg=0.293) USER MOD Single : B 19 TYR OH : rot -54:sc= 1 USER MOD Single : B 20 SER OG : rot -91:sc= 0.968 USER MOD Single : B 28 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0477) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 GLN : amide:sc= 0.8 K(o=0.8,f=-0.16) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 158:sc= 0.451 (180deg=0.247) USER MOD Single : B 57 MET CE :methyl 172:sc= 0 (180deg=-0.0973) USER MOD Single : B 69 ASN : amide:sc= 1.14 K(o=1.1,f=-0.8) USER MOD Single : B 71 GLN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : B 73 TYR OH : rot 156:sc= 1.1 USER MOD Single : B 82 MET CE :methyl 171:sc= 0 (180deg=-0.109) USER MOD Single : B 84 TYR OH : rot 167:sc= 1.24 USER MOD Single : B 85 ASN : amide:sc= 0.444 K(o=0.44,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.855 -3.488 -5.937 1.00 0.00 N ATOM 31 CA SER A 3 -8.618 -3.952 -6.537 1.00 0.00 C ATOM 32 C SER A 3 -7.448 -3.010 -6.217 1.00 0.00 C ATOM 33 O SER A 3 -6.513 -3.468 -5.567 1.00 0.00 O ATOM 34 CB SER A 3 -8.842 -4.233 -8.030 1.00 0.00 C ATOM 35 OG SER A 3 -10.038 -3.605 -8.475 1.00 0.00 O ATOM 0 HA SER A 3 -8.319 -4.902 -6.093 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.994 -3.866 -8.608 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.902 -5.308 -8.200 1.00 0.00 H new ATOM 0 HG SER A 3 -10.623 -3.435 -7.708 1.00 0.00 H new ATOM 41 N PRO A 4 -7.488 -1.719 -6.601 1.00 0.00 N ATOM 42 CA PRO A 4 -6.510 -0.713 -6.206 1.00 0.00 C ATOM 43 C PRO A 4 -6.033 -0.802 -4.753 1.00 0.00 C ATOM 44 O PRO A 4 -4.825 -0.859 -4.517 1.00 0.00 O ATOM 45 CB PRO A 4 -7.155 0.635 -6.522 1.00 0.00 C ATOM 46 CG PRO A 4 -7.973 0.311 -7.768 1.00 0.00 C ATOM 47 CD PRO A 4 -8.435 -1.130 -7.536 1.00 0.00 C ATOM 0 HA PRO A 4 -5.586 -0.872 -6.762 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.781 0.989 -5.703 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -6.411 1.409 -6.712 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -8.819 0.989 -7.879 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.373 0.398 -8.674 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.447 -1.153 -7.131 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -8.454 -1.687 -8.473 1.00 0.00 H new ATOM 55 N LEU A 5 -6.934 -0.807 -3.763 1.00 0.00 N ATOM 56 CA LEU A 5 -6.444 -0.919 -2.392 1.00 0.00 C ATOM 57 C LEU A 5 -5.842 -2.304 -2.150 1.00 0.00 C ATOM 58 O LEU A 5 -4.726 -2.413 -1.643 1.00 0.00 O ATOM 59 CB LEU A 5 -7.513 -0.578 -1.348 1.00 0.00 C ATOM 60 CG LEU A 5 -6.937 -0.695 0.080 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.680 0.155 0.316 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.963 -0.243 1.112 1.00 0.00 C ATOM 0 H LEU A 5 -7.946 -0.739 -3.875 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.658 -0.174 -2.270 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.882 0.434 -1.515 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.364 -1.250 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.678 -1.748 0.187 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.336 0.019 1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.896 -0.156 -0.374 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.915 1.206 0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.538 -0.333 2.112 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.234 0.796 0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.853 -0.868 1.039 1.00 0.00 H new ATOM 74 N ASP A 6 -6.580 -3.361 -2.503 1.00 0.00 N ATOM 75 CA ASP A 6 -6.181 -4.742 -2.260 1.00 0.00 C ATOM 76 C ASP A 6 -4.769 -5.001 -2.780 1.00 0.00 C ATOM 77 O ASP A 6 -3.946 -5.569 -2.066 1.00 0.00 O ATOM 78 CB ASP A 6 -7.181 -5.727 -2.885 1.00 0.00 C ATOM 79 CG ASP A 6 -8.564 -5.714 -2.231 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.631 -5.447 -1.010 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.534 -6.009 -2.961 1.00 0.00 O ATOM 0 H ASP A 6 -7.482 -3.276 -2.971 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.181 -4.903 -1.182 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.290 -5.494 -3.944 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.770 -6.735 -2.821 1.00 0.00 H new ATOM 86 N GLN A 7 -4.467 -4.576 -4.010 1.00 0.00 N ATOM 87 CA GLN A 7 -3.138 -4.747 -4.578 1.00 0.00 C ATOM 88 C GLN A 7 -2.099 -3.937 -3.800 1.00 0.00 C ATOM 89 O GLN A 7 -0.989 -4.415 -3.587 1.00 0.00 O ATOM 90 CB GLN A 7 -3.129 -4.451 -6.086 1.00 0.00 C ATOM 91 CG GLN A 7 -3.416 -2.990 -6.447 1.00 0.00 C ATOM 92 CD GLN A 7 -3.673 -2.838 -7.942 1.00 0.00 C ATOM 93 OE1 GLN A 7 -4.819 -2.794 -8.382 1.00 0.00 O ATOM 94 NE2 GLN A 7 -2.613 -2.768 -8.740 1.00 0.00 N ATOM 0 H GLN A 7 -5.131 -4.110 -4.629 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.853 -5.794 -4.475 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -2.156 -4.728 -6.492 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.870 -5.085 -6.573 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.282 -2.637 -5.888 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.571 -2.366 -6.154 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -1.674 -2.807 -8.345 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -2.739 -2.675 -9.748 1.00 0.00 H new ATOM 103 N ALA A 8 -2.440 -2.723 -3.354 1.00 0.00 N ATOM 104 CA ALA A 8 -1.513 -1.916 -2.574 1.00 0.00 C ATOM 105 C ALA A 8 -1.173 -2.592 -1.245 1.00 0.00 C ATOM 106 O ALA A 8 0.003 -2.811 -0.961 1.00 0.00 O ATOM 107 CB ALA A 8 -2.056 -0.509 -2.369 1.00 0.00 C ATOM 0 H ALA A 8 -3.346 -2.285 -3.522 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.584 -1.829 -3.138 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.345 0.074 -1.783 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.205 -0.032 -3.338 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -3.007 -0.560 -1.839 1.00 0.00 H new ATOM 113 N ILE A 9 -2.174 -2.954 -0.434 1.00 0.00 N ATOM 114 CA ILE A 9 -1.888 -3.690 0.800 1.00 0.00 C ATOM 115 C ILE A 9 -1.142 -4.989 0.451 1.00 0.00 C ATOM 116 O ILE A 9 -0.124 -5.313 1.063 1.00 0.00 O ATOM 117 CB ILE A 9 -3.140 -3.869 1.690 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.277 -4.646 1.014 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.604 -2.496 2.189 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.484 -4.863 1.931 1.00 0.00 C ATOM 0 H ILE A 9 -3.160 -2.756 -0.603 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.222 -3.103 1.433 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.852 -4.490 2.539 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.598 -4.107 0.123 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.901 -5.614 0.683 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.487 -2.616 2.817 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.807 -2.031 2.769 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.849 -1.863 1.336 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.253 -5.418 1.394 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.176 -5.428 2.811 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.883 -3.897 2.242 1.00 0.00 H new ATOM 132 N GLY A 10 -1.596 -5.676 -0.602 1.00 0.00 N ATOM 133 CA GLY A 10 -0.922 -6.806 -1.224 1.00 0.00 C ATOM 134 C GLY A 10 0.574 -6.562 -1.405 1.00 0.00 C ATOM 135 O GLY A 10 1.379 -7.422 -1.064 1.00 0.00 O ATOM 0 H GLY A 10 -2.479 -5.446 -1.058 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.071 -7.696 -0.613 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.375 -7.007 -2.195 1.00 0.00 H new ATOM 139 N LEU A 11 0.958 -5.396 -1.926 1.00 0.00 N ATOM 140 CA LEU A 11 2.345 -5.017 -2.156 1.00 0.00 C ATOM 141 C LEU A 11 3.132 -5.105 -0.845 1.00 0.00 C ATOM 142 O LEU A 11 4.104 -5.855 -0.753 1.00 0.00 O ATOM 143 CB LEU A 11 2.385 -3.606 -2.774 1.00 0.00 C ATOM 144 CG LEU A 11 3.645 -3.234 -3.571 1.00 0.00 C ATOM 145 CD1 LEU A 11 4.931 -3.438 -2.781 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.698 -3.944 -4.925 1.00 0.00 C ATOM 0 H LEU A 11 0.294 -4.674 -2.205 1.00 0.00 H new ATOM 0 HA LEU A 11 2.818 -5.703 -2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.523 -3.499 -3.432 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.265 -2.880 -1.970 1.00 0.00 H new ATOM 0 HG LEU A 11 3.570 -2.164 -3.765 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.785 -3.158 -3.398 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.911 -2.817 -1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.019 -4.486 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.605 -3.652 -5.454 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.700 -5.023 -4.770 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.827 -3.664 -5.517 1.00 0.00 H new ATOM 158 N LEU A 12 2.706 -4.360 0.180 1.00 0.00 N ATOM 159 CA LEU A 12 3.349 -4.356 1.492 1.00 0.00 C ATOM 160 C LEU A 12 3.460 -5.784 2.030 1.00 0.00 C ATOM 161 O LEU A 12 4.511 -6.183 2.539 1.00 0.00 O ATOM 162 CB LEU A 12 2.539 -3.502 2.486 1.00 0.00 C ATOM 163 CG LEU A 12 2.746 -1.984 2.364 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.231 -1.401 1.044 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.025 -1.277 3.516 1.00 0.00 C ATOM 0 H LEU A 12 1.899 -3.739 0.119 1.00 0.00 H new ATOM 0 HA LEU A 12 4.346 -3.930 1.382 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.480 -3.720 2.349 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.799 -3.808 3.499 1.00 0.00 H new ATOM 0 HG LEU A 12 3.823 -1.817 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.410 -0.326 1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.755 -1.869 0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.162 -1.592 0.954 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.171 -0.200 3.430 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.960 -1.503 3.472 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.430 -1.624 4.466 1.00 0.00 H new ATOM 177 N ILE A 13 2.363 -6.539 1.943 1.00 0.00 N ATOM 178 CA ILE A 13 2.288 -7.888 2.484 1.00 0.00 C ATOM 179 C ILE A 13 3.287 -8.790 1.763 1.00 0.00 C ATOM 180 O ILE A 13 4.053 -9.501 2.412 1.00 0.00 O ATOM 181 CB ILE A 13 0.845 -8.411 2.385 1.00 0.00 C ATOM 182 CG1 ILE A 13 -0.107 -7.549 3.229 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.747 -9.856 2.886 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.551 -7.627 2.728 1.00 0.00 C ATOM 0 H ILE A 13 1.502 -6.227 1.493 1.00 0.00 H new ATOM 0 HA ILE A 13 2.558 -7.884 3.540 1.00 0.00 H new ATOM 0 HB ILE A 13 0.560 -8.364 1.334 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.066 -7.876 4.268 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.228 -6.512 3.207 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.284 -10.200 2.805 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.392 -10.495 2.282 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.064 -9.902 3.928 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.188 -7.002 3.354 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.598 -7.275 1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.897 -8.660 2.775 1.00 0.00 H new ATOM 196 N GLY A 14 3.285 -8.751 0.432 1.00 0.00 N ATOM 197 CA GLY A 14 4.179 -9.517 -0.414 1.00 0.00 C ATOM 198 C GLY A 14 5.628 -9.174 -0.094 1.00 0.00 C ATOM 199 O GLY A 14 6.428 -10.068 0.170 1.00 0.00 O ATOM 0 H GLY A 14 2.639 -8.166 -0.097 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.008 -10.583 -0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.970 -9.305 -1.463 1.00 0.00 H new ATOM 203 N ILE A 15 5.962 -7.878 -0.089 1.00 0.00 N ATOM 204 CA ILE A 15 7.293 -7.410 0.268 1.00 0.00 C ATOM 205 C ILE A 15 7.712 -8.015 1.607 1.00 0.00 C ATOM 206 O ILE A 15 8.800 -8.575 1.719 1.00 0.00 O ATOM 207 CB ILE A 15 7.347 -5.867 0.236 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.656 -5.428 -1.205 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.382 -5.305 1.216 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.748 -3.909 -1.375 1.00 0.00 C ATOM 0 H ILE A 15 5.313 -7.130 -0.333 1.00 0.00 H new ATOM 0 HA ILE A 15 8.022 -7.749 -0.467 1.00 0.00 H new ATOM 0 HB ILE A 15 6.383 -5.470 0.553 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.597 -5.878 -1.519 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.881 -5.813 -1.868 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.384 -4.217 1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.128 -5.614 2.230 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.371 -5.684 0.958 1.00 0.00 H new ATOM 0 HD11 ILE A 15 7.968 -3.672 -2.416 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.799 -3.453 -1.092 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.542 -3.519 -0.738 1.00 0.00 H new ATOM 222 N PHE A 16 6.844 -7.915 2.617 1.00 0.00 N ATOM 223 CA PHE A 16 7.144 -8.465 3.928 1.00 0.00 C ATOM 224 C PHE A 16 7.423 -9.963 3.829 1.00 0.00 C ATOM 225 O PHE A 16 8.514 -10.429 4.151 1.00 0.00 O ATOM 226 CB PHE A 16 5.991 -8.166 4.890 1.00 0.00 C ATOM 227 CG PHE A 16 6.290 -8.497 6.336 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.894 -7.535 7.164 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.009 -9.776 6.847 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.127 -7.817 8.519 1.00 0.00 C ATOM 231 CE2 PHE A 16 6.263 -10.066 8.195 1.00 0.00 C ATOM 232 CZ PHE A 16 6.798 -9.079 9.039 1.00 0.00 C ATOM 0 H PHE A 16 5.934 -7.460 2.546 1.00 0.00 H new ATOM 0 HA PHE A 16 8.045 -7.993 4.321 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.735 -7.109 4.816 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.113 -8.729 4.574 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.179 -6.576 6.756 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.597 -10.536 6.200 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.559 -7.064 9.161 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.047 -11.050 8.585 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.956 -9.290 10.086 1.00 0.00 H new ATOM 242 N HIS A 17 6.429 -10.724 3.371 1.00 0.00 N ATOM 243 CA HIS A 17 6.476 -12.174 3.431 1.00 0.00 C ATOM 244 C HIS A 17 7.569 -12.760 2.545 1.00 0.00 C ATOM 245 O HIS A 17 8.146 -13.787 2.895 1.00 0.00 O ATOM 246 CB HIS A 17 5.093 -12.765 3.159 1.00 0.00 C ATOM 247 CG HIS A 17 4.160 -12.454 4.299 1.00 0.00 C ATOM 248 ND1 HIS A 17 3.410 -11.311 4.425 1.00 0.00 N ATOM 249 CD2 HIS A 17 4.163 -13.080 5.515 1.00 0.00 C ATOM 250 CE1 HIS A 17 2.944 -11.264 5.684 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.381 -12.318 6.393 1.00 0.00 N ATOM 0 H HIS A 17 5.577 -10.351 2.952 1.00 0.00 H new ATOM 0 HA HIS A 17 6.755 -12.462 4.445 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.692 -12.358 2.230 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.170 -13.844 3.027 1.00 0.00 H new ATOM 0 HD1 HIS A 17 3.238 -10.621 3.694 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.677 -13.999 5.756 1.00 0.00 H new ATOM 0 HE1 HIS A 17 2.305 -10.485 6.073 1.00 0.00 H new ATOM 259 N LYS A 18 7.908 -12.089 1.441 1.00 0.00 N ATOM 260 CA LYS A 18 9.060 -12.462 0.633 1.00 0.00 C ATOM 261 C LYS A 18 10.307 -12.533 1.518 1.00 0.00 C ATOM 262 O LYS A 18 11.091 -13.475 1.420 1.00 0.00 O ATOM 263 CB LYS A 18 9.229 -11.458 -0.516 1.00 0.00 C ATOM 264 CG LYS A 18 10.399 -11.840 -1.439 1.00 0.00 C ATOM 265 CD LYS A 18 10.427 -11.043 -2.753 1.00 0.00 C ATOM 266 CE LYS A 18 11.104 -9.669 -2.653 1.00 0.00 C ATOM 267 NZ LYS A 18 10.336 -8.706 -1.846 1.00 0.00 N ATOM 0 H LYS A 18 7.394 -11.281 1.089 1.00 0.00 H new ATOM 0 HA LYS A 18 8.908 -13.448 0.194 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.308 -11.411 -1.097 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.399 -10.462 -0.107 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.337 -11.683 -0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.338 -12.904 -1.669 1.00 0.00 H new ATOM 0 HD2 LYS A 18 10.943 -11.634 -3.510 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.403 -10.904 -3.100 1.00 0.00 H new ATOM 0 HE2 LYS A 18 12.096 -9.790 -2.218 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.243 -9.265 -3.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 10.576 -7.738 -2.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 9.318 -8.869 -1.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 10.570 -8.831 -0.840 1.00 0.00 H new ATOM 281 N TYR A 19 10.480 -11.541 2.393 1.00 0.00 N ATOM 282 CA TYR A 19 11.607 -11.489 3.307 1.00 0.00 C ATOM 283 C TYR A 19 11.402 -12.419 4.503 1.00 0.00 C ATOM 284 O TYR A 19 12.343 -13.118 4.872 1.00 0.00 O ATOM 285 CB TYR A 19 11.922 -10.031 3.652 1.00 0.00 C ATOM 286 CG TYR A 19 12.840 -9.421 2.619 1.00 0.00 C ATOM 287 CD1 TYR A 19 14.223 -9.651 2.725 1.00 0.00 C ATOM 288 CD2 TYR A 19 12.313 -8.866 1.439 1.00 0.00 C ATOM 289 CE1 TYR A 19 15.066 -9.388 1.637 1.00 0.00 C ATOM 290 CE2 TYR A 19 13.166 -8.545 0.371 1.00 0.00 C ATOM 291 CZ TYR A 19 14.538 -8.833 0.461 1.00 0.00 C ATOM 292 OH TYR A 19 15.355 -8.554 -0.588 1.00 0.00 O ATOM 0 H TYR A 19 9.838 -10.753 2.483 1.00 0.00 H new ATOM 0 HA TYR A 19 12.503 -11.881 2.826 1.00 0.00 H new ATOM 0 HB2 TYR A 19 10.997 -9.458 3.706 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.388 -9.978 4.636 1.00 0.00 H new ATOM 0 HD1 TYR A 19 14.637 -10.031 3.647 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.251 -8.687 1.354 1.00 0.00 H new ATOM 0 HE1 TYR A 19 16.120 -9.612 1.703 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.768 -8.078 -0.518 1.00 0.00 H new ATOM 0 HH TYR A 19 16.287 -8.709 -0.327 1.00 0.00 H new ATOM 302 N SER A 20 10.191 -12.518 5.063 1.00 0.00 N ATOM 303 CA SER A 20 9.895 -13.550 6.057 1.00 0.00 C ATOM 304 C SER A 20 10.268 -14.946 5.548 1.00 0.00 C ATOM 305 O SER A 20 10.717 -15.780 6.326 1.00 0.00 O ATOM 306 CB SER A 20 8.427 -13.524 6.471 1.00 0.00 C ATOM 307 OG SER A 20 8.065 -12.219 6.870 1.00 0.00 O ATOM 0 H SER A 20 9.408 -11.901 4.846 1.00 0.00 H new ATOM 0 HA SER A 20 10.506 -13.327 6.932 1.00 0.00 H new ATOM 0 HB2 SER A 20 7.800 -13.847 5.640 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.258 -14.224 7.289 1.00 0.00 H new ATOM 0 HG SER A 20 8.379 -12.058 7.784 1.00 0.00 H new ATOM 313 N GLY A 21 10.123 -15.195 4.244 1.00 0.00 N ATOM 314 CA GLY A 21 10.601 -16.403 3.584 1.00 0.00 C ATOM 315 C GLY A 21 12.033 -16.766 3.994 1.00 0.00 C ATOM 316 O GLY A 21 12.349 -17.937 4.203 1.00 0.00 O ATOM 0 H GLY A 21 9.660 -14.546 3.608 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.936 -17.232 3.824 1.00 0.00 H new ATOM 0 HA3 GLY A 21 10.560 -16.264 2.504 1.00 0.00 H new ATOM 398 N HIS A 27 5.239 -14.862 10.363 1.00 0.00 N ATOM 399 CA HIS A 27 4.838 -13.473 10.141 1.00 0.00 C ATOM 400 C HIS A 27 5.629 -12.480 11.005 1.00 0.00 C ATOM 401 O HIS A 27 5.072 -11.679 11.760 1.00 0.00 O ATOM 402 CB HIS A 27 3.318 -13.359 10.333 1.00 0.00 C ATOM 403 CG HIS A 27 2.569 -14.360 9.485 1.00 0.00 C ATOM 404 ND1 HIS A 27 2.645 -14.447 8.116 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.948 -15.497 9.931 1.00 0.00 C ATOM 406 CE1 HIS A 27 2.093 -15.613 7.745 1.00 0.00 C ATOM 407 NE2 HIS A 27 1.639 -16.285 8.817 1.00 0.00 N ATOM 0 HA HIS A 27 5.082 -13.194 9.116 1.00 0.00 H new ATOM 0 HB2 HIS A 27 3.071 -13.516 11.383 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.994 -12.350 10.076 1.00 0.00 H new ATOM 0 HD1 HIS A 27 3.049 -13.749 7.492 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.735 -15.742 10.961 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.023 -15.963 6.726 1.00 0.00 H new ATOM 415 N THR A 28 6.948 -12.515 10.847 1.00 0.00 N ATOM 416 CA THR A 28 7.934 -11.693 11.504 1.00 0.00 C ATOM 417 C THR A 28 9.047 -11.448 10.487 1.00 0.00 C ATOM 418 O THR A 28 9.113 -12.137 9.467 1.00 0.00 O ATOM 419 CB THR A 28 8.452 -12.409 12.759 1.00 0.00 C ATOM 420 OG1 THR A 28 8.765 -13.757 12.477 1.00 0.00 O ATOM 421 CG2 THR A 28 7.430 -12.391 13.897 1.00 0.00 C ATOM 0 H THR A 28 7.381 -13.176 10.202 1.00 0.00 H new ATOM 0 HA THR A 28 7.518 -10.741 11.834 1.00 0.00 H new ATOM 0 HB THR A 28 9.345 -11.867 13.070 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.095 -14.193 13.290 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.841 -12.909 14.763 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.203 -11.359 14.165 1.00 0.00 H new ATOM 0 HG23 THR A 28 6.517 -12.892 13.574 1.00 0.00 H new ATOM 429 N LEU A 29 9.895 -10.453 10.741 1.00 0.00 N ATOM 430 CA LEU A 29 10.972 -10.097 9.826 1.00 0.00 C ATOM 431 C LEU A 29 12.165 -9.594 10.644 1.00 0.00 C ATOM 432 O LEU A 29 11.997 -8.721 11.494 1.00 0.00 O ATOM 433 CB LEU A 29 10.412 -9.069 8.834 1.00 0.00 C ATOM 434 CG LEU A 29 11.056 -9.065 7.445 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.123 -8.316 6.493 1.00 0.00 C ATOM 436 CD2 LEU A 29 12.416 -8.372 7.451 1.00 0.00 C ATOM 0 H LEU A 29 9.854 -9.876 11.581 1.00 0.00 H new ATOM 0 HA LEU A 29 11.337 -10.945 9.246 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.343 -9.249 8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.523 -8.075 9.268 1.00 0.00 H new ATOM 0 HG LEU A 29 11.209 -10.097 7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.560 -8.299 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.157 -8.820 6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.986 -7.294 6.847 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.839 -8.391 6.446 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.296 -7.338 7.775 1.00 0.00 H new ATOM 0 HD23 LEU A 29 13.086 -8.891 8.136 1.00 0.00 H new ATOM 448 N SER A 30 13.348 -10.196 10.469 1.00 0.00 N ATOM 449 CA SER A 30 14.504 -9.910 11.317 1.00 0.00 C ATOM 450 C SER A 30 15.228 -8.617 10.931 1.00 0.00 C ATOM 451 O SER A 30 14.859 -7.932 9.981 1.00 0.00 O ATOM 452 CB SER A 30 15.456 -11.113 11.359 1.00 0.00 C ATOM 453 OG SER A 30 16.374 -10.960 12.427 1.00 0.00 O ATOM 0 H SER A 30 13.527 -10.888 9.742 1.00 0.00 H new ATOM 0 HA SER A 30 14.125 -9.741 12.325 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.887 -12.034 11.485 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.993 -11.197 10.414 1.00 0.00 H new ATOM 0 HG SER A 30 15.942 -11.216 13.269 1.00 0.00 H new ATOM 459 N LYS A 31 16.282 -8.297 11.682 1.00 0.00 N ATOM 460 CA LYS A 31 16.968 -7.013 11.630 1.00 0.00 C ATOM 461 C LYS A 31 17.694 -6.834 10.294 1.00 0.00 C ATOM 462 O LYS A 31 17.305 -6.029 9.450 1.00 0.00 O ATOM 463 CB LYS A 31 17.929 -6.882 12.823 1.00 0.00 C ATOM 464 CG LYS A 31 17.246 -7.206 14.156 1.00 0.00 C ATOM 465 CD LYS A 31 18.038 -6.598 15.319 1.00 0.00 C ATOM 466 CE LYS A 31 17.357 -6.952 16.644 1.00 0.00 C ATOM 467 NZ LYS A 31 17.879 -6.146 17.759 1.00 0.00 N ATOM 0 H LYS A 31 16.690 -8.942 12.359 1.00 0.00 H new ATOM 0 HA LYS A 31 16.229 -6.215 11.702 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.777 -7.552 12.679 1.00 0.00 H new ATOM 0 HB3 LYS A 31 18.326 -5.868 12.858 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.228 -6.815 14.156 1.00 0.00 H new ATOM 0 HG3 LYS A 31 17.172 -8.286 14.282 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.061 -6.975 15.312 1.00 0.00 H new ATOM 0 HD3 LYS A 31 18.096 -5.515 15.206 1.00 0.00 H new ATOM 0 HE2 LYS A 31 16.282 -6.795 16.554 1.00 0.00 H new ATOM 0 HE3 LYS A 31 17.507 -8.010 16.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 17.394 -6.415 18.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 18.900 -6.315 17.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 17.713 -5.138 17.566 1.00 0.00 H new ATOM 481 N LYS A 32 18.764 -7.602 10.083 1.00 0.00 N ATOM 482 CA LYS A 32 19.533 -7.481 8.854 1.00 0.00 C ATOM 483 C LYS A 32 18.655 -7.854 7.653 1.00 0.00 C ATOM 484 O LYS A 32 18.768 -7.267 6.579 1.00 0.00 O ATOM 485 CB LYS A 32 20.816 -8.314 8.928 1.00 0.00 C ATOM 486 CG LYS A 32 21.702 -7.881 10.104 1.00 0.00 C ATOM 487 CD LYS A 32 23.033 -8.643 10.067 1.00 0.00 C ATOM 488 CE LYS A 32 23.923 -8.301 11.268 1.00 0.00 C ATOM 489 NZ LYS A 32 24.314 -6.880 11.281 1.00 0.00 N ATOM 0 H LYS A 32 19.110 -8.303 10.739 1.00 0.00 H new ATOM 0 HA LYS A 32 19.846 -6.445 8.723 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.561 -9.368 9.033 1.00 0.00 H new ATOM 0 HB3 LYS A 32 21.372 -8.212 7.996 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.886 -6.808 10.055 1.00 0.00 H new ATOM 0 HG3 LYS A 32 21.189 -8.074 11.046 1.00 0.00 H new ATOM 0 HD2 LYS A 32 22.837 -9.715 10.054 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.562 -8.405 9.144 1.00 0.00 H new ATOM 0 HE2 LYS A 32 23.394 -8.539 12.191 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.818 -8.923 11.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 24.982 -6.711 12.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.767 -6.636 10.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.469 -6.289 11.415 1.00 0.00 H new ATOM 503 N GLU A 33 17.736 -8.801 7.859 1.00 0.00 N ATOM 504 CA GLU A 33 16.728 -9.175 6.882 1.00 0.00 C ATOM 505 C GLU A 33 15.931 -7.937 6.442 1.00 0.00 C ATOM 506 O GLU A 33 15.766 -7.698 5.246 1.00 0.00 O ATOM 507 CB GLU A 33 15.862 -10.264 7.523 1.00 0.00 C ATOM 508 CG GLU A 33 14.878 -10.935 6.566 1.00 0.00 C ATOM 509 CD GLU A 33 14.107 -12.016 7.313 1.00 0.00 C ATOM 510 OE1 GLU A 33 14.756 -13.015 7.692 1.00 0.00 O ATOM 511 OE2 GLU A 33 12.904 -11.792 7.551 1.00 0.00 O ATOM 0 H GLU A 33 17.676 -9.334 8.726 1.00 0.00 H new ATOM 0 HA GLU A 33 17.170 -9.574 5.969 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.515 -11.027 7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.304 -9.826 8.351 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.188 -10.196 6.158 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.413 -11.371 5.722 1.00 0.00 H new ATOM 518 N LEU A 34 15.473 -7.125 7.400 1.00 0.00 N ATOM 519 CA LEU A 34 14.797 -5.868 7.121 1.00 0.00 C ATOM 520 C LEU A 34 15.701 -4.949 6.304 1.00 0.00 C ATOM 521 O LEU A 34 15.283 -4.450 5.262 1.00 0.00 O ATOM 522 CB LEU A 34 14.310 -5.215 8.429 1.00 0.00 C ATOM 523 CG LEU A 34 13.616 -3.850 8.290 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.610 -2.699 8.076 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.531 -3.860 7.203 1.00 0.00 C ATOM 0 H LEU A 34 15.565 -7.329 8.395 1.00 0.00 H new ATOM 0 HA LEU A 34 13.911 -6.061 6.517 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.619 -5.902 8.918 1.00 0.00 H new ATOM 0 HB3 LEU A 34 15.167 -5.098 9.093 1.00 0.00 H new ATOM 0 HG LEU A 34 13.122 -3.667 9.244 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.065 -1.760 7.984 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.290 -2.643 8.926 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.182 -2.877 7.165 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.069 -2.875 7.141 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.981 -4.111 6.242 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.772 -4.602 7.453 1.00 0.00 H new ATOM 537 N LYS A 35 16.935 -4.684 6.741 1.00 0.00 N ATOM 538 CA LYS A 35 17.739 -3.754 5.950 1.00 0.00 C ATOM 539 C LYS A 35 17.986 -4.297 4.532 1.00 0.00 C ATOM 540 O LYS A 35 18.079 -3.521 3.580 1.00 0.00 O ATOM 541 CB LYS A 35 18.987 -3.252 6.683 1.00 0.00 C ATOM 542 CG LYS A 35 20.194 -4.190 6.643 1.00 0.00 C ATOM 543 CD LYS A 35 21.326 -3.681 7.546 1.00 0.00 C ATOM 544 CE LYS A 35 21.748 -2.234 7.250 1.00 0.00 C ATOM 545 NZ LYS A 35 22.133 -2.041 5.842 1.00 0.00 N ATOM 0 H LYS A 35 17.374 -5.069 7.577 1.00 0.00 H new ATOM 0 HA LYS A 35 17.154 -2.844 5.815 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.279 -2.294 6.253 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.726 -3.068 7.725 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.893 -5.188 6.962 1.00 0.00 H new ATOM 0 HG3 LYS A 35 20.555 -4.278 5.618 1.00 0.00 H new ATOM 0 HD2 LYS A 35 21.009 -3.752 8.586 1.00 0.00 H new ATOM 0 HD3 LYS A 35 22.192 -4.333 7.431 1.00 0.00 H new ATOM 0 HE2 LYS A 35 20.926 -1.561 7.495 1.00 0.00 H new ATOM 0 HE3 LYS A 35 22.585 -1.963 7.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 22.784 -1.234 5.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 22.603 -2.899 5.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 21.283 -1.854 5.272 1.00 0.00 H new ATOM 559 N GLU A 36 18.060 -5.625 4.376 1.00 0.00 N ATOM 560 CA GLU A 36 18.094 -6.267 3.068 1.00 0.00 C ATOM 561 C GLU A 36 16.819 -5.924 2.276 1.00 0.00 C ATOM 562 O GLU A 36 16.911 -5.457 1.140 1.00 0.00 O ATOM 563 CB GLU A 36 18.287 -7.788 3.224 1.00 0.00 C ATOM 564 CG GLU A 36 19.224 -8.397 2.170 1.00 0.00 C ATOM 565 CD GLU A 36 18.839 -8.047 0.734 1.00 0.00 C ATOM 566 OE1 GLU A 36 17.933 -8.727 0.205 1.00 0.00 O ATOM 567 OE2 GLU A 36 19.458 -7.107 0.191 1.00 0.00 O ATOM 0 H GLU A 36 18.098 -6.280 5.157 1.00 0.00 H new ATOM 0 HA GLU A 36 18.944 -5.888 2.501 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.686 -7.996 4.217 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.315 -8.278 3.162 1.00 0.00 H new ATOM 0 HG2 GLU A 36 20.241 -8.054 2.359 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.228 -9.481 2.282 1.00 0.00 H new ATOM 574 N LEU A 37 15.639 -6.129 2.882 1.00 0.00 N ATOM 575 CA LEU A 37 14.352 -5.725 2.311 1.00 0.00 C ATOM 576 C LEU A 37 14.463 -4.300 1.784 1.00 0.00 C ATOM 577 O LEU A 37 14.193 -4.039 0.616 1.00 0.00 O ATOM 578 CB LEU A 37 13.204 -5.885 3.331 1.00 0.00 C ATOM 579 CG LEU A 37 11.803 -5.423 2.872 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.755 -6.075 3.781 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.583 -3.905 2.981 1.00 0.00 C ATOM 0 H LEU A 37 15.555 -6.585 3.791 1.00 0.00 H new ATOM 0 HA LEU A 37 14.106 -6.383 1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.141 -6.936 3.612 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.468 -5.330 4.231 1.00 0.00 H new ATOM 0 HG LEU A 37 11.716 -5.710 1.824 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.758 -5.760 3.472 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.832 -7.160 3.706 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.928 -5.770 4.813 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.577 -3.658 2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.702 -3.594 4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.314 -3.386 2.361 1.00 0.00 H new ATOM 593 N ILE A 38 14.874 -3.375 2.645 1.00 0.00 N ATOM 594 CA ILE A 38 14.965 -1.968 2.297 1.00 0.00 C ATOM 595 C ILE A 38 15.915 -1.745 1.124 1.00 0.00 C ATOM 596 O ILE A 38 15.577 -1.021 0.189 1.00 0.00 O ATOM 597 CB ILE A 38 15.331 -1.167 3.553 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.068 -1.148 4.425 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.827 0.248 3.237 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.241 -0.322 5.686 1.00 0.00 C ATOM 0 H ILE A 38 15.153 -3.583 3.604 1.00 0.00 H new ATOM 0 HA ILE A 38 13.999 -1.604 1.947 1.00 0.00 H new ATOM 0 HB ILE A 38 16.168 -1.636 4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.236 -0.748 3.845 1.00 0.00 H new ATOM 0 HG13 ILE A 38 13.804 -2.170 4.698 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.070 0.764 4.166 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.717 0.190 2.610 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.047 0.798 2.710 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.317 -0.344 6.265 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.053 -0.736 6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.477 0.708 5.417 1.00 0.00 H new ATOM 612 N GLN A 39 17.102 -2.346 1.147 1.00 0.00 N ATOM 613 CA GLN A 39 18.037 -2.177 0.045 1.00 0.00 C ATOM 614 C GLN A 39 17.451 -2.691 -1.273 1.00 0.00 C ATOM 615 O GLN A 39 17.616 -2.032 -2.298 1.00 0.00 O ATOM 616 CB GLN A 39 19.388 -2.792 0.407 1.00 0.00 C ATOM 617 CG GLN A 39 20.109 -1.824 1.357 1.00 0.00 C ATOM 618 CD GLN A 39 21.228 -2.508 2.120 1.00 0.00 C ATOM 619 OE1 GLN A 39 22.406 -2.304 1.844 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.859 -3.292 3.122 1.00 0.00 N ATOM 0 H GLN A 39 17.433 -2.944 1.904 1.00 0.00 H new ATOM 0 HA GLN A 39 18.212 -1.114 -0.121 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.250 -3.762 0.884 1.00 0.00 H new ATOM 0 HB3 GLN A 39 19.983 -2.960 -0.490 1.00 0.00 H new ATOM 0 HG2 GLN A 39 20.516 -0.990 0.785 1.00 0.00 H new ATOM 0 HG3 GLN A 39 19.391 -1.406 2.063 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.869 -3.436 3.319 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.565 -3.752 3.697 1.00 0.00 H new ATOM 629 N LYS A 40 16.737 -3.820 -1.271 1.00 0.00 N ATOM 630 CA LYS A 40 16.111 -4.290 -2.502 1.00 0.00 C ATOM 631 C LYS A 40 14.953 -3.382 -2.931 1.00 0.00 C ATOM 632 O LYS A 40 14.882 -2.963 -4.083 1.00 0.00 O ATOM 633 CB LYS A 40 15.660 -5.750 -2.358 1.00 0.00 C ATOM 634 CG LYS A 40 15.096 -6.281 -3.690 1.00 0.00 C ATOM 635 CD LYS A 40 14.678 -7.753 -3.611 1.00 0.00 C ATOM 636 CE LYS A 40 15.886 -8.698 -3.645 1.00 0.00 C ATOM 637 NZ LYS A 40 15.481 -10.085 -3.361 1.00 0.00 N ATOM 0 H LYS A 40 16.582 -4.409 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 40 16.858 -4.246 -3.294 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.502 -6.366 -2.043 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.900 -5.826 -1.580 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.236 -5.679 -3.981 1.00 0.00 H new ATOM 0 HG3 LYS A 40 15.847 -6.162 -4.471 1.00 0.00 H new ATOM 0 HD2 LYS A 40 14.113 -7.920 -2.694 1.00 0.00 H new ATOM 0 HD3 LYS A 40 14.013 -7.986 -4.442 1.00 0.00 H new ATOM 0 HE2 LYS A 40 16.363 -8.648 -4.624 1.00 0.00 H new ATOM 0 HE3 LYS A 40 16.626 -8.374 -2.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 16.317 -10.704 -3.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 15.047 -10.134 -2.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 14.793 -10.399 -4.075 1.00 0.00 H new ATOM 651 N GLU A 41 14.008 -3.135 -2.024 1.00 0.00 N ATOM 652 CA GLU A 41 12.743 -2.496 -2.346 1.00 0.00 C ATOM 653 C GLU A 41 12.854 -0.974 -2.448 1.00 0.00 C ATOM 654 O GLU A 41 12.285 -0.381 -3.364 1.00 0.00 O ATOM 655 CB GLU A 41 11.681 -2.910 -1.319 1.00 0.00 C ATOM 656 CG GLU A 41 11.509 -4.437 -1.221 1.00 0.00 C ATOM 657 CD GLU A 41 11.124 -5.101 -2.540 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.351 -4.477 -3.298 1.00 0.00 O ATOM 659 OE2 GLU A 41 11.599 -6.238 -2.756 1.00 0.00 O ATOM 0 H GLU A 41 14.105 -3.377 -1.038 1.00 0.00 H new ATOM 0 HA GLU A 41 12.442 -2.839 -3.336 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.956 -2.516 -0.340 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.726 -2.458 -1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.440 -4.876 -0.863 1.00 0.00 H new ATOM 0 HG3 GLU A 41 10.745 -4.660 -0.476 1.00 0.00 H new ATOM 666 N LEU A 42 13.534 -0.330 -1.497 1.00 0.00 N ATOM 667 CA LEU A 42 13.673 1.123 -1.456 1.00 0.00 C ATOM 668 C LEU A 42 14.963 1.564 -2.147 1.00 0.00 C ATOM 669 O LEU A 42 14.935 2.493 -2.949 1.00 0.00 O ATOM 670 CB LEU A 42 13.574 1.666 -0.021 1.00 0.00 C ATOM 671 CG LEU A 42 12.191 1.479 0.637 1.00 0.00 C ATOM 672 CD1 LEU A 42 12.196 2.103 2.038 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.070 2.132 -0.183 1.00 0.00 C ATOM 0 H LEU A 42 14.006 -0.808 -0.729 1.00 0.00 H new ATOM 0 HA LEU A 42 12.838 1.554 -2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.326 1.171 0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.818 2.728 -0.030 1.00 0.00 H new ATOM 0 HG LEU A 42 12.001 0.407 0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.218 1.969 2.499 1.00 0.00 H new ATOM 0 HD12 LEU A 42 12.956 1.617 2.650 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.418 3.167 1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.114 1.975 0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.261 3.201 -0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.037 1.684 -1.176 1.00 0.00 H new ATOM 794 N ASP A 50 23.629 4.582 5.739 1.00 0.00 N ATOM 795 CA ASP A 50 23.506 3.267 6.367 1.00 0.00 C ATOM 796 C ASP A 50 23.221 3.372 7.867 1.00 0.00 C ATOM 797 O ASP A 50 22.380 2.643 8.382 1.00 0.00 O ATOM 798 CB ASP A 50 24.762 2.422 6.132 1.00 0.00 C ATOM 799 CG ASP A 50 24.561 1.013 6.684 1.00 0.00 C ATOM 800 OD1 ASP A 50 23.898 0.222 5.979 1.00 0.00 O ATOM 801 OD2 ASP A 50 25.059 0.760 7.802 1.00 0.00 O ATOM 0 HA ASP A 50 22.656 2.774 5.896 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.983 2.374 5.066 1.00 0.00 H new ATOM 0 HB3 ASP A 50 25.620 2.890 6.615 1.00 0.00 H new ATOM 806 N ALA A 51 23.892 4.298 8.558 1.00 0.00 N ATOM 807 CA ALA A 51 23.626 4.601 9.962 1.00 0.00 C ATOM 808 C ALA A 51 22.129 4.840 10.205 1.00 0.00 C ATOM 809 O ALA A 51 21.534 4.282 11.127 1.00 0.00 O ATOM 810 CB ALA A 51 24.443 5.828 10.376 1.00 0.00 C ATOM 0 H ALA A 51 24.640 4.861 8.153 1.00 0.00 H new ATOM 0 HA ALA A 51 23.922 3.746 10.570 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.248 6.058 11.423 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.505 5.621 10.242 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.159 6.680 9.758 1.00 0.00 H new ATOM 816 N GLU A 52 21.513 5.661 9.352 1.00 0.00 N ATOM 817 CA GLU A 52 20.094 5.956 9.426 1.00 0.00 C ATOM 818 C GLU A 52 19.297 4.683 9.147 1.00 0.00 C ATOM 819 O GLU A 52 18.321 4.414 9.841 1.00 0.00 O ATOM 820 CB GLU A 52 19.718 7.078 8.449 1.00 0.00 C ATOM 821 CG GLU A 52 20.592 8.330 8.641 1.00 0.00 C ATOM 822 CD GLU A 52 20.242 9.453 7.669 1.00 0.00 C ATOM 823 OE1 GLU A 52 19.368 9.225 6.804 1.00 0.00 O ATOM 824 OE2 GLU A 52 20.878 10.521 7.793 1.00 0.00 O ATOM 0 H GLU A 52 21.993 6.139 8.589 1.00 0.00 H new ATOM 0 HA GLU A 52 19.851 6.308 10.429 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.822 6.717 7.426 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.670 7.343 8.588 1.00 0.00 H new ATOM 0 HG2 GLU A 52 20.479 8.692 9.663 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.640 8.059 8.513 1.00 0.00 H new ATOM 831 N ILE A 53 19.720 3.887 8.157 1.00 0.00 N ATOM 832 CA ILE A 53 19.078 2.603 7.890 1.00 0.00 C ATOM 833 C ILE A 53 19.091 1.730 9.144 1.00 0.00 C ATOM 834 O ILE A 53 18.052 1.183 9.497 1.00 0.00 O ATOM 835 CB ILE A 53 19.678 1.861 6.677 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.744 2.728 5.408 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.877 0.578 6.396 1.00 0.00 C ATOM 838 CD1 ILE A 53 18.380 3.231 4.932 1.00 0.00 C ATOM 0 H ILE A 53 20.497 4.110 7.535 1.00 0.00 H new ATOM 0 HA ILE A 53 18.044 2.817 7.621 1.00 0.00 H new ATOM 0 HB ILE A 53 20.706 1.611 6.940 1.00 0.00 H new ATOM 0 HG12 ILE A 53 20.391 3.585 5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.207 2.150 4.608 1.00 0.00 H new ATOM 0 HG21 ILE A 53 19.307 0.061 5.538 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.915 -0.073 7.269 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.840 0.836 6.181 1.00 0.00 H new ATOM 0 HD11 ILE A 53 18.508 3.835 4.033 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.736 2.380 4.709 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.923 3.837 5.714 1.00 0.00 H new ATOM 850 N VAL A 54 20.228 1.576 9.829 1.00 0.00 N ATOM 851 CA VAL A 54 20.270 0.720 11.012 1.00 0.00 C ATOM 852 C VAL A 54 19.496 1.323 12.189 1.00 0.00 C ATOM 853 O VAL A 54 18.887 0.581 12.958 1.00 0.00 O ATOM 854 CB VAL A 54 21.680 0.231 11.379 1.00 0.00 C ATOM 855 CG1 VAL A 54 22.185 -0.729 10.295 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.689 1.352 11.618 1.00 0.00 C ATOM 0 H VAL A 54 21.113 2.023 9.590 1.00 0.00 H new ATOM 0 HA VAL A 54 19.740 -0.193 10.740 1.00 0.00 H new ATOM 0 HB VAL A 54 21.592 -0.285 12.335 1.00 0.00 H new ATOM 0 HG11 VAL A 54 23.185 -1.077 10.554 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.511 -1.583 10.223 1.00 0.00 H new ATOM 0 HG13 VAL A 54 22.218 -0.211 9.337 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.658 0.922 11.872 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.785 1.954 10.714 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.346 1.982 12.439 1.00 0.00 H new ATOM 866 N LYS A 55 19.465 2.652 12.332 1.00 0.00 N ATOM 867 CA LYS A 55 18.573 3.276 13.306 1.00 0.00 C ATOM 868 C LYS A 55 17.117 2.912 12.991 1.00 0.00 C ATOM 869 O LYS A 55 16.389 2.417 13.847 1.00 0.00 O ATOM 870 CB LYS A 55 18.808 4.794 13.336 1.00 0.00 C ATOM 871 CG LYS A 55 17.849 5.555 14.268 1.00 0.00 C ATOM 872 CD LYS A 55 17.804 5.033 15.715 1.00 0.00 C ATOM 873 CE LYS A 55 19.174 5.009 16.407 1.00 0.00 C ATOM 874 NZ LYS A 55 19.805 6.340 16.428 1.00 0.00 N ATOM 0 H LYS A 55 20.037 3.304 11.795 1.00 0.00 H new ATOM 0 HA LYS A 55 18.791 2.897 14.305 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.834 4.987 13.650 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.705 5.188 12.325 1.00 0.00 H new ATOM 0 HG2 LYS A 55 18.139 6.606 14.285 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.844 5.508 13.849 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.125 5.657 16.296 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.389 4.025 15.715 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.058 4.647 17.428 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.828 4.306 15.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.687 6.297 16.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 20.017 6.639 15.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 19.157 7.025 16.867 1.00 0.00 H new ATOM 888 N LEU A 56 16.696 3.132 11.747 1.00 0.00 N ATOM 889 CA LEU A 56 15.369 2.784 11.263 1.00 0.00 C ATOM 890 C LEU A 56 15.073 1.294 11.501 1.00 0.00 C ATOM 891 O LEU A 56 14.004 0.938 11.993 1.00 0.00 O ATOM 892 CB LEU A 56 15.274 3.229 9.794 1.00 0.00 C ATOM 893 CG LEU A 56 14.073 2.651 9.038 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.482 3.673 8.060 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.497 1.417 8.243 1.00 0.00 C ATOM 0 H LEU A 56 17.283 3.567 11.035 1.00 0.00 H new ATOM 0 HA LEU A 56 14.589 3.306 11.817 1.00 0.00 H new ATOM 0 HB2 LEU A 56 15.222 4.317 9.759 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.189 2.937 9.278 1.00 0.00 H new ATOM 0 HG LEU A 56 13.319 2.387 9.780 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.632 3.230 7.541 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.152 4.554 8.610 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.241 3.962 7.333 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.636 1.014 7.710 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.271 1.694 7.527 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.887 0.661 8.925 1.00 0.00 H new ATOM 907 N MET A 57 16.031 0.423 11.182 1.00 0.00 N ATOM 908 CA MET A 57 15.945 -1.015 11.389 1.00 0.00 C ATOM 909 C MET A 57 15.661 -1.282 12.862 1.00 0.00 C ATOM 910 O MET A 57 14.694 -1.968 13.183 1.00 0.00 O ATOM 911 CB MET A 57 17.268 -1.655 10.950 1.00 0.00 C ATOM 912 CG MET A 57 17.368 -3.172 11.137 1.00 0.00 C ATOM 913 SD MET A 57 19.045 -3.829 10.913 1.00 0.00 S ATOM 914 CE MET A 57 19.861 -3.217 12.407 1.00 0.00 C ATOM 0 H MET A 57 16.913 0.712 10.760 1.00 0.00 H new ATOM 0 HA MET A 57 15.138 -1.449 10.798 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.429 -1.426 9.896 1.00 0.00 H new ATOM 0 HB3 MET A 57 18.079 -1.185 11.506 1.00 0.00 H new ATOM 0 HG2 MET A 57 17.018 -3.429 12.137 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.699 -3.661 10.429 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.802 -3.748 12.551 1.00 0.00 H new ATOM 0 HE2 MET A 57 20.058 -2.150 12.303 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.215 -3.384 13.269 1.00 0.00 H new ATOM 924 N ASP A 58 16.483 -0.713 13.750 1.00 0.00 N ATOM 925 CA ASP A 58 16.259 -0.798 15.183 1.00 0.00 C ATOM 926 C ASP A 58 14.831 -0.365 15.511 1.00 0.00 C ATOM 927 O ASP A 58 14.108 -1.095 16.173 1.00 0.00 O ATOM 928 CB ASP A 58 17.299 0.018 15.956 1.00 0.00 C ATOM 929 CG ASP A 58 17.070 -0.111 17.459 1.00 0.00 C ATOM 930 OD1 ASP A 58 17.631 -1.065 18.038 1.00 0.00 O ATOM 931 OD2 ASP A 58 16.336 0.745 17.998 1.00 0.00 O ATOM 0 H ASP A 58 17.316 -0.185 13.490 1.00 0.00 H new ATOM 0 HA ASP A 58 16.379 -1.834 15.499 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.302 -0.328 15.704 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.240 1.066 15.662 1.00 0.00 H new ATOM 936 N ASP A 59 14.398 0.794 15.016 1.00 0.00 N ATOM 937 CA ASP A 59 13.061 1.311 15.298 1.00 0.00 C ATOM 938 C ASP A 59 11.950 0.385 14.790 1.00 0.00 C ATOM 939 O ASP A 59 10.865 0.366 15.374 1.00 0.00 O ATOM 940 CB ASP A 59 12.885 2.724 14.723 1.00 0.00 C ATOM 941 CG ASP A 59 13.904 3.733 15.249 1.00 0.00 C ATOM 942 OD1 ASP A 59 14.226 3.655 16.455 1.00 0.00 O ATOM 943 OD2 ASP A 59 14.327 4.585 14.436 1.00 0.00 O ATOM 0 H ASP A 59 14.959 1.396 14.413 1.00 0.00 H new ATOM 0 HA ASP A 59 12.970 1.357 16.383 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.961 2.677 13.637 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.881 3.079 14.957 1.00 0.00 H new ATOM 948 N LEU A 60 12.201 -0.366 13.714 1.00 0.00 N ATOM 949 CA LEU A 60 11.308 -1.416 13.240 1.00 0.00 C ATOM 950 C LEU A 60 11.336 -2.619 14.193 1.00 0.00 C ATOM 951 O LEU A 60 10.298 -3.003 14.731 1.00 0.00 O ATOM 952 CB LEU A 60 11.664 -1.812 11.793 1.00 0.00 C ATOM 953 CG LEU A 60 10.960 -0.915 10.760 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.756 -0.802 9.462 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.588 -1.491 10.389 1.00 0.00 C ATOM 0 H LEU A 60 13.040 -0.257 13.144 1.00 0.00 H new ATOM 0 HA LEU A 60 10.286 -1.036 13.231 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.743 -1.747 11.654 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.383 -2.851 11.622 1.00 0.00 H new ATOM 0 HG LEU A 60 10.867 0.066 11.226 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.222 -0.160 8.762 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.736 -0.373 9.672 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.880 -1.792 9.024 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.107 -0.842 9.657 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.714 -2.486 9.963 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.966 -1.555 11.282 1.00 0.00 H new ATOM 967 N ASP A 61 12.498 -3.243 14.394 1.00 0.00 N ATOM 968 CA ASP A 61 12.585 -4.476 15.176 1.00 0.00 C ATOM 969 C ASP A 61 12.223 -4.272 16.649 1.00 0.00 C ATOM 970 O ASP A 61 11.600 -5.148 17.247 1.00 0.00 O ATOM 971 CB ASP A 61 13.927 -5.193 14.972 1.00 0.00 C ATOM 972 CG ASP A 61 15.154 -4.383 15.377 1.00 0.00 C ATOM 973 OD1 ASP A 61 15.254 -4.021 16.568 1.00 0.00 O ATOM 974 OD2 ASP A 61 16.002 -4.170 14.484 1.00 0.00 O ATOM 0 H ASP A 61 13.391 -2.915 14.026 1.00 0.00 H new ATOM 0 HA ASP A 61 11.821 -5.149 14.786 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.917 -6.121 15.543 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.021 -5.467 13.921 1.00 0.00 H new ATOM 979 N ARG A 62 12.551 -3.105 17.212 1.00 0.00 N ATOM 980 CA ARG A 62 12.364 -2.751 18.617 1.00 0.00 C ATOM 981 C ARG A 62 10.986 -3.184 19.113 1.00 0.00 C ATOM 982 O ARG A 62 10.863 -3.745 20.201 1.00 0.00 O ATOM 983 CB ARG A 62 12.548 -1.233 18.758 1.00 0.00 C ATOM 984 CG ARG A 62 12.164 -0.657 20.133 1.00 0.00 C ATOM 985 CD ARG A 62 12.170 0.880 20.104 1.00 0.00 C ATOM 986 NE ARG A 62 11.376 1.414 18.985 1.00 0.00 N ATOM 987 CZ ARG A 62 10.073 1.175 18.778 1.00 0.00 C ATOM 988 NH1 ARG A 62 9.285 0.723 19.756 1.00 0.00 N ATOM 989 NH2 ARG A 62 9.552 1.346 17.562 1.00 0.00 N ATOM 0 H ARG A 62 12.973 -2.349 16.673 1.00 0.00 H new ATOM 0 HA ARG A 62 13.100 -3.271 19.230 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.591 -0.988 18.556 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.951 -0.737 17.993 1.00 0.00 H new ATOM 0 HG2 ARG A 62 11.175 -1.016 20.419 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.863 -1.013 20.889 1.00 0.00 H new ATOM 0 HD2 ARG A 62 11.773 1.262 21.045 1.00 0.00 H new ATOM 0 HD3 ARG A 62 13.197 1.237 20.023 1.00 0.00 H new ATOM 0 HE ARG A 62 11.856 2.014 18.314 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.671 0.552 20.684 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.297 0.548 19.575 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.145 1.658 16.793 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.561 1.165 17.402 1.00 0.00 H new ATOM 1003 N ASN A 63 9.953 -2.921 18.307 1.00 0.00 N ATOM 1004 CA ASN A 63 8.561 -3.169 18.667 1.00 0.00 C ATOM 1005 C ASN A 63 8.329 -4.607 19.136 1.00 0.00 C ATOM 1006 O ASN A 63 7.460 -4.834 19.973 1.00 0.00 O ATOM 1007 CB ASN A 63 7.616 -2.785 17.524 1.00 0.00 C ATOM 1008 CG ASN A 63 7.871 -1.356 17.050 1.00 0.00 C ATOM 1009 OD1 ASN A 63 7.438 -0.387 17.670 1.00 0.00 O ATOM 1010 ND2 ASN A 63 8.653 -1.220 15.984 1.00 0.00 N ATOM 0 H ASN A 63 10.066 -2.524 17.374 1.00 0.00 H new ATOM 0 HA ASN A 63 8.331 -2.526 19.517 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.749 -3.476 16.691 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.582 -2.881 17.856 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.912 -0.289 15.657 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.995 -2.046 15.493 1.00 0.00 H new ATOM 1017 N LYS A 64 9.095 -5.570 18.611 1.00 0.00 N ATOM 1018 CA LYS A 64 9.153 -6.927 19.143 1.00 0.00 C ATOM 1019 C LYS A 64 10.619 -7.371 19.208 1.00 0.00 C ATOM 1020 O LYS A 64 10.984 -8.466 18.779 1.00 0.00 O ATOM 1021 CB LYS A 64 8.241 -7.887 18.363 1.00 0.00 C ATOM 1022 CG LYS A 64 6.761 -7.516 18.533 1.00 0.00 C ATOM 1023 CD LYS A 64 5.827 -8.647 18.077 1.00 0.00 C ATOM 1024 CE LYS A 64 5.374 -9.550 19.233 1.00 0.00 C ATOM 1025 NZ LYS A 64 6.503 -10.211 19.910 1.00 0.00 N ATOM 0 H LYS A 64 9.695 -5.424 17.799 1.00 0.00 H new ATOM 0 HA LYS A 64 8.758 -6.947 20.159 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.505 -7.863 17.306 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.404 -8.908 18.709 1.00 0.00 H new ATOM 0 HG2 LYS A 64 6.564 -7.283 19.579 1.00 0.00 H new ATOM 0 HG3 LYS A 64 6.545 -6.615 17.960 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.950 -8.215 17.595 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.337 -9.253 17.328 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.818 -8.955 19.958 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.690 -10.308 18.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.140 -10.860 20.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 7.060 -10.747 19.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 7.108 -9.493 20.358 1.00 0.00 H new ATOM 1039 N ASP A 65 11.440 -6.503 19.814 1.00 0.00 N ATOM 1040 CA ASP A 65 12.858 -6.675 20.094 1.00 0.00 C ATOM 1041 C ASP A 65 13.674 -7.223 18.917 1.00 0.00 C ATOM 1042 O ASP A 65 14.316 -6.463 18.198 1.00 0.00 O ATOM 1043 CB ASP A 65 13.082 -7.412 21.430 1.00 0.00 C ATOM 1044 CG ASP A 65 12.310 -8.723 21.571 1.00 0.00 C ATOM 1045 OD1 ASP A 65 12.825 -9.746 21.070 1.00 0.00 O ATOM 1046 OD2 ASP A 65 11.214 -8.678 22.172 1.00 0.00 O ATOM 0 H ASP A 65 11.099 -5.600 20.142 1.00 0.00 H new ATOM 0 HA ASP A 65 13.272 -5.675 20.224 1.00 0.00 H new ATOM 0 HB2 ASP A 65 14.146 -7.619 21.542 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.799 -6.749 22.247 1.00 0.00 H new ATOM 1051 N GLN A 66 13.717 -8.542 18.763 1.00 0.00 N ATOM 1052 CA GLN A 66 14.600 -9.223 17.835 1.00 0.00 C ATOM 1053 C GLN A 66 14.095 -9.106 16.392 1.00 0.00 C ATOM 1054 O GLN A 66 14.900 -8.995 15.470 1.00 0.00 O ATOM 1055 CB GLN A 66 14.758 -10.681 18.286 1.00 0.00 C ATOM 1056 CG GLN A 66 15.946 -11.365 17.599 1.00 0.00 C ATOM 1057 CD GLN A 66 16.070 -12.825 18.018 1.00 0.00 C ATOM 1058 OE1 GLN A 66 17.017 -13.207 18.696 1.00 0.00 O ATOM 1059 NE2 GLN A 66 15.113 -13.657 17.620 1.00 0.00 N ATOM 0 H GLN A 66 13.123 -9.178 19.295 1.00 0.00 H new ATOM 0 HA GLN A 66 15.581 -8.748 17.844 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.895 -10.714 19.367 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.844 -11.231 18.064 1.00 0.00 H new ATOM 0 HG2 GLN A 66 15.826 -11.305 16.517 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.865 -10.835 17.847 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.337 -13.310 17.056 1.00 0.00 H new ATOM 0 HE22 GLN A 66 15.154 -14.643 17.878 1.00 0.00 H new ATOM 1068 N GLU A 67 12.774 -9.153 16.193 1.00 0.00 N ATOM 1069 CA GLU A 67 12.135 -9.123 14.881 1.00 0.00 C ATOM 1070 C GLU A 67 11.067 -8.034 14.875 1.00 0.00 C ATOM 1071 O GLU A 67 10.496 -7.734 15.917 1.00 0.00 O ATOM 1072 CB GLU A 67 11.423 -10.462 14.612 1.00 0.00 C ATOM 1073 CG GLU A 67 12.272 -11.569 13.970 1.00 0.00 C ATOM 1074 CD GLU A 67 13.473 -11.981 14.807 1.00 0.00 C ATOM 1075 OE1 GLU A 67 13.239 -12.497 15.922 1.00 0.00 O ATOM 1076 OE2 GLU A 67 14.606 -11.800 14.311 1.00 0.00 O ATOM 0 H GLU A 67 12.106 -9.214 16.961 1.00 0.00 H new ATOM 0 HA GLU A 67 12.897 -8.938 14.124 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.031 -10.837 15.558 1.00 0.00 H new ATOM 0 HB3 GLU A 67 10.567 -10.270 13.966 1.00 0.00 H new ATOM 0 HG2 GLU A 67 11.644 -12.443 13.797 1.00 0.00 H new ATOM 0 HG3 GLU A 67 12.620 -11.229 12.995 1.00 0.00 H new ATOM 1083 N VAL A 68 10.752 -7.490 13.697 1.00 0.00 N ATOM 1084 CA VAL A 68 9.559 -6.671 13.530 1.00 0.00 C ATOM 1085 C VAL A 68 8.440 -7.627 13.111 1.00 0.00 C ATOM 1086 O VAL A 68 8.634 -8.449 12.215 1.00 0.00 O ATOM 1087 CB VAL A 68 9.779 -5.509 12.541 1.00 0.00 C ATOM 1088 CG1 VAL A 68 10.133 -5.921 11.108 1.00 0.00 C ATOM 1089 CG2 VAL A 68 8.534 -4.615 12.512 1.00 0.00 C ATOM 0 H VAL A 68 11.308 -7.604 12.849 1.00 0.00 H new ATOM 0 HA VAL A 68 9.292 -6.168 14.459 1.00 0.00 H new ATOM 0 HB VAL A 68 10.653 -4.978 12.918 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.266 -5.029 10.495 1.00 0.00 H new ATOM 0 HG12 VAL A 68 11.057 -6.499 11.113 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.328 -6.528 10.694 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.692 -3.794 11.812 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.672 -5.202 12.195 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.352 -4.212 13.508 1.00 0.00 H new ATOM 1099 N ASN A 69 7.281 -7.566 13.773 1.00 0.00 N ATOM 1100 CA ASN A 69 6.111 -8.317 13.334 1.00 0.00 C ATOM 1101 C ASN A 69 5.398 -7.545 12.230 1.00 0.00 C ATOM 1102 O ASN A 69 5.414 -6.317 12.222 1.00 0.00 O ATOM 1103 CB ASN A 69 5.148 -8.583 14.499 1.00 0.00 C ATOM 1104 CG ASN A 69 3.745 -8.947 14.007 1.00 0.00 C ATOM 1105 OD1 ASN A 69 2.839 -8.123 14.052 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.551 -10.141 13.454 1.00 0.00 N ATOM 0 H ASN A 69 7.132 -7.005 14.612 1.00 0.00 H new ATOM 0 HA ASN A 69 6.444 -9.282 12.952 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.538 -9.393 15.115 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.092 -7.698 15.133 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.640 -10.379 13.061 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.313 -10.818 13.423 1.00 0.00 H new ATOM 1113 N PHE A 70 4.731 -8.276 11.336 1.00 0.00 N ATOM 1114 CA PHE A 70 3.939 -7.734 10.245 1.00 0.00 C ATOM 1115 C PHE A 70 3.124 -6.489 10.630 1.00 0.00 C ATOM 1116 O PHE A 70 3.263 -5.445 9.994 1.00 0.00 O ATOM 1117 CB PHE A 70 3.052 -8.848 9.680 1.00 0.00 C ATOM 1118 CG PHE A 70 2.136 -8.359 8.584 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.692 -7.872 7.386 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.772 -8.160 8.856 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.885 -7.184 6.468 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -0.040 -7.497 7.924 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.521 -6.988 6.744 1.00 0.00 C ATOM 0 H PHE A 70 4.731 -9.296 11.357 1.00 0.00 H new ATOM 0 HA PHE A 70 4.625 -7.381 9.475 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.682 -9.648 9.292 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.454 -9.275 10.485 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.739 -8.028 7.174 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.349 -8.518 9.783 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.311 -6.806 5.551 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.096 -7.379 8.115 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.097 -6.444 6.045 1.00 0.00 H new ATOM 1133 N GLN A 71 2.286 -6.560 11.670 1.00 0.00 N ATOM 1134 CA GLN A 71 1.451 -5.418 12.027 1.00 0.00 C ATOM 1135 C GLN A 71 2.315 -4.216 12.411 1.00 0.00 C ATOM 1136 O GLN A 71 2.018 -3.091 12.013 1.00 0.00 O ATOM 1137 CB GLN A 71 0.451 -5.812 13.123 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.363 -4.624 13.662 1.00 0.00 C ATOM 1139 CD GLN A 71 0.277 -4.036 14.919 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.212 -4.650 15.978 1.00 0.00 O ATOM 1141 NE2 GLN A 71 0.916 -2.874 14.836 1.00 0.00 N ATOM 0 H GLN A 71 2.172 -7.380 12.266 1.00 0.00 H new ATOM 0 HA GLN A 71 0.866 -5.113 11.159 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.234 -6.562 12.727 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.991 -6.277 13.948 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.437 -3.853 12.895 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.379 -4.949 13.887 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.959 -2.378 13.946 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.363 -2.478 15.663 1.00 0.00 H new ATOM 1150 N GLU A 72 3.389 -4.444 13.168 1.00 0.00 N ATOM 1151 CA GLU A 72 4.285 -3.372 13.571 1.00 0.00 C ATOM 1152 C GLU A 72 5.018 -2.797 12.358 1.00 0.00 C ATOM 1153 O GLU A 72 5.224 -1.589 12.281 1.00 0.00 O ATOM 1154 CB GLU A 72 5.248 -3.861 14.659 1.00 0.00 C ATOM 1155 CG GLU A 72 4.503 -4.090 15.985 1.00 0.00 C ATOM 1156 CD GLU A 72 3.923 -2.791 16.550 1.00 0.00 C ATOM 1157 OE1 GLU A 72 4.674 -1.793 16.564 1.00 0.00 O ATOM 1158 OE2 GLU A 72 2.733 -2.807 16.932 1.00 0.00 O ATOM 0 H GLU A 72 3.656 -5.366 13.513 1.00 0.00 H new ATOM 0 HA GLU A 72 3.699 -2.560 14.001 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.724 -4.788 14.340 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.042 -3.128 14.804 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.698 -4.808 15.829 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.185 -4.529 16.713 1.00 0.00 H new ATOM 1165 N TYR A 73 5.381 -3.643 11.395 1.00 0.00 N ATOM 1166 CA TYR A 73 5.904 -3.199 10.111 1.00 0.00 C ATOM 1167 C TYR A 73 4.894 -2.278 9.417 1.00 0.00 C ATOM 1168 O TYR A 73 5.262 -1.178 9.012 1.00 0.00 O ATOM 1169 CB TYR A 73 6.317 -4.416 9.273 1.00 0.00 C ATOM 1170 CG TYR A 73 6.261 -4.237 7.770 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.395 -3.791 7.066 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.124 -4.669 7.061 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.406 -3.828 5.660 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.123 -4.668 5.657 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.274 -4.271 4.957 1.00 0.00 C ATOM 1176 OH TYR A 73 6.309 -4.354 3.599 1.00 0.00 O ATOM 0 H TYR A 73 5.319 -4.657 11.487 1.00 0.00 H new ATOM 0 HA TYR A 73 6.804 -2.601 10.252 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.335 -4.693 9.548 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.674 -5.254 9.543 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.255 -3.421 7.604 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.249 -5.002 7.599 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.287 -3.515 5.120 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.239 -4.972 5.116 1.00 0.00 H new ATOM 0 HH TYR A 73 5.665 -5.027 3.296 1.00 0.00 H new ATOM 1186 N ILE A 74 3.625 -2.690 9.299 1.00 0.00 N ATOM 1187 CA ILE A 74 2.596 -1.840 8.701 1.00 0.00 C ATOM 1188 C ILE A 74 2.505 -0.506 9.460 1.00 0.00 C ATOM 1189 O ILE A 74 2.611 0.558 8.851 1.00 0.00 O ATOM 1190 CB ILE A 74 1.237 -2.565 8.613 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.258 -3.828 7.729 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.152 -1.603 8.110 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.431 -3.569 6.229 1.00 0.00 C ATOM 0 H ILE A 74 3.291 -3.602 9.609 1.00 0.00 H new ATOM 0 HA ILE A 74 2.883 -1.617 7.673 1.00 0.00 H new ATOM 0 HB ILE A 74 1.012 -2.898 9.626 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.068 -4.475 8.066 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.328 -4.375 7.882 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.802 -2.128 8.053 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.063 -0.763 8.799 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.423 -1.234 7.121 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.433 -4.518 5.694 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.608 -2.951 5.869 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.375 -3.053 6.055 1.00 0.00 H new ATOM 1205 N THR A 75 2.336 -0.544 10.786 1.00 0.00 N ATOM 1206 CA THR A 75 2.307 0.652 11.622 1.00 0.00 C ATOM 1207 C THR A 75 3.521 1.549 11.353 1.00 0.00 C ATOM 1208 O THR A 75 3.376 2.755 11.155 1.00 0.00 O ATOM 1209 CB THR A 75 2.231 0.230 13.096 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.076 -0.562 13.274 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.166 1.425 14.053 1.00 0.00 C ATOM 0 H THR A 75 2.215 -1.412 11.308 1.00 0.00 H new ATOM 0 HA THR A 75 1.424 1.242 11.376 1.00 0.00 H new ATOM 0 HB THR A 75 3.140 -0.323 13.331 1.00 0.00 H new ATOM 0 HG1 THR A 75 0.278 0.003 13.207 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.114 1.066 15.081 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.057 2.040 13.928 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.281 2.021 13.831 1.00 0.00 H new ATOM 1219 N PHE A 76 4.720 0.963 11.331 1.00 0.00 N ATOM 1220 CA PHE A 76 5.943 1.701 11.062 1.00 0.00 C ATOM 1221 C PHE A 76 5.887 2.338 9.677 1.00 0.00 C ATOM 1222 O PHE A 76 6.221 3.507 9.537 1.00 0.00 O ATOM 1223 CB PHE A 76 7.175 0.807 11.198 1.00 0.00 C ATOM 1224 CG PHE A 76 8.469 1.576 10.999 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.994 1.755 9.703 1.00 0.00 C ATOM 1226 CD2 PHE A 76 9.070 2.236 12.088 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.124 2.562 9.504 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.175 3.080 11.879 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.692 3.255 10.584 1.00 0.00 C ATOM 0 H PHE A 76 4.864 -0.033 11.499 1.00 0.00 H new ATOM 0 HA PHE A 76 6.027 2.493 11.806 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.178 0.344 12.185 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.118 0.000 10.467 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.525 1.269 8.860 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.682 2.094 13.086 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.557 2.650 8.519 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.627 3.594 12.714 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.525 3.922 10.420 1.00 0.00 H new ATOM 1239 N LEU A 77 5.456 1.604 8.648 1.00 0.00 N ATOM 1240 CA LEU A 77 5.260 2.196 7.330 1.00 0.00 C ATOM 1241 C LEU A 77 4.255 3.349 7.402 1.00 0.00 C ATOM 1242 O LEU A 77 4.432 4.356 6.723 1.00 0.00 O ATOM 1243 CB LEU A 77 4.862 1.136 6.296 1.00 0.00 C ATOM 1244 CG LEU A 77 6.033 0.212 5.918 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.516 -0.930 5.043 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.121 0.950 5.128 1.00 0.00 C ATOM 0 H LEU A 77 5.239 0.609 8.704 1.00 0.00 H new ATOM 0 HA LEU A 77 6.209 2.614 6.994 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.043 0.536 6.693 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.489 1.630 5.399 1.00 0.00 H new ATOM 0 HG LEU A 77 6.464 -0.158 6.848 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.344 -1.586 4.774 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.766 -1.499 5.593 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.069 -0.521 4.137 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.926 0.257 4.884 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.695 1.350 4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.516 1.768 5.730 1.00 0.00 H new ATOM 1258 N GLY A 78 3.234 3.243 8.253 1.00 0.00 N ATOM 1259 CA GLY A 78 2.355 4.362 8.562 1.00 0.00 C ATOM 1260 C GLY A 78 3.148 5.554 9.101 1.00 0.00 C ATOM 1261 O GLY A 78 3.027 6.668 8.594 1.00 0.00 O ATOM 0 H GLY A 78 2.997 2.381 8.744 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.811 4.659 7.666 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.613 4.053 9.298 1.00 0.00 H new ATOM 1265 N ALA A 79 3.982 5.333 10.117 1.00 0.00 N ATOM 1266 CA ALA A 79 4.849 6.385 10.634 1.00 0.00 C ATOM 1267 C ALA A 79 5.719 6.974 9.516 1.00 0.00 C ATOM 1268 O ALA A 79 5.811 8.189 9.377 1.00 0.00 O ATOM 1269 CB ALA A 79 5.689 5.867 11.805 1.00 0.00 C ATOM 0 H ALA A 79 4.074 4.437 10.595 1.00 0.00 H new ATOM 0 HA ALA A 79 4.226 7.194 11.015 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.329 6.668 12.176 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.030 5.530 12.605 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.307 5.035 11.469 1.00 0.00 H new ATOM 1275 N LEU A 80 6.333 6.124 8.693 1.00 0.00 N ATOM 1276 CA LEU A 80 7.168 6.528 7.570 1.00 0.00 C ATOM 1277 C LEU A 80 6.372 7.407 6.602 1.00 0.00 C ATOM 1278 O LEU A 80 6.838 8.461 6.176 1.00 0.00 O ATOM 1279 CB LEU A 80 7.731 5.282 6.870 1.00 0.00 C ATOM 1280 CG LEU A 80 9.042 5.575 6.126 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.239 5.672 7.077 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.321 4.428 5.150 1.00 0.00 C ATOM 0 H LEU A 80 6.260 5.112 8.794 1.00 0.00 H new ATOM 0 HA LEU A 80 8.006 7.121 7.936 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.902 4.499 7.609 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.993 4.899 6.165 1.00 0.00 H new ATOM 0 HG LEU A 80 8.922 6.531 5.616 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.143 5.880 6.504 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.070 6.476 7.794 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.357 4.729 7.611 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.250 4.624 4.615 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.411 3.493 5.703 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.501 4.350 4.437 1.00 0.00 H new ATOM 1294 N ALA A 81 5.144 6.996 6.280 1.00 0.00 N ATOM 1295 CA ALA A 81 4.226 7.802 5.495 1.00 0.00 C ATOM 1296 C ALA A 81 4.024 9.163 6.161 1.00 0.00 C ATOM 1297 O ALA A 81 4.091 10.190 5.495 1.00 0.00 O ATOM 1298 CB ALA A 81 2.907 7.064 5.288 1.00 0.00 C ATOM 0 H ALA A 81 4.764 6.092 6.560 1.00 0.00 H new ATOM 0 HA ALA A 81 4.654 7.976 4.508 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.232 7.684 4.698 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.093 6.127 4.762 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.452 6.853 6.256 1.00 0.00 H new ATOM 1304 N MET A 82 3.811 9.183 7.478 1.00 0.00 N ATOM 1305 CA MET A 82 3.693 10.429 8.220 1.00 0.00 C ATOM 1306 C MET A 82 4.970 11.280 8.104 1.00 0.00 C ATOM 1307 O MET A 82 4.868 12.495 7.945 1.00 0.00 O ATOM 1308 CB MET A 82 3.259 10.144 9.664 1.00 0.00 C ATOM 1309 CG MET A 82 2.798 11.412 10.392 1.00 0.00 C ATOM 1310 SD MET A 82 1.900 11.125 11.942 1.00 0.00 S ATOM 1311 CE MET A 82 3.122 10.184 12.884 1.00 0.00 C ATOM 0 H MET A 82 3.717 8.344 8.050 1.00 0.00 H new ATOM 0 HA MET A 82 2.908 11.040 7.775 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.449 9.414 9.661 1.00 0.00 H new ATOM 0 HB3 MET A 82 4.090 9.696 10.209 1.00 0.00 H new ATOM 0 HG2 MET A 82 3.672 12.028 10.605 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.159 11.986 9.721 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.734 9.980 13.882 1.00 0.00 H new ATOM 0 HE2 MET A 82 3.327 9.242 12.375 1.00 0.00 H new ATOM 0 HE3 MET A 82 4.043 10.761 12.964 1.00 0.00 H new ATOM 1321 N ILE A 83 6.168 10.672 8.139 1.00 0.00 N ATOM 1322 CA ILE A 83 7.404 11.394 7.815 1.00 0.00 C ATOM 1323 C ILE A 83 7.259 12.018 6.426 1.00 0.00 C ATOM 1324 O ILE A 83 7.471 13.221 6.258 1.00 0.00 O ATOM 1325 CB ILE A 83 8.675 10.516 7.887 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.846 9.734 9.198 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.925 11.374 7.634 1.00 0.00 C ATOM 1328 CD1 ILE A 83 8.800 10.595 10.460 1.00 0.00 C ATOM 0 H ILE A 83 6.304 9.692 8.386 1.00 0.00 H new ATOM 0 HA ILE A 83 7.540 12.165 8.573 1.00 0.00 H new ATOM 0 HB ILE A 83 8.550 9.766 7.106 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.063 8.978 9.260 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.798 9.205 9.169 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.814 10.746 7.687 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.860 11.829 6.645 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.988 12.157 8.390 1.00 0.00 H new ATOM 0 HD11 ILE A 83 8.929 9.961 11.338 1.00 0.00 H new ATOM 0 HD12 ILE A 83 9.600 11.334 10.425 1.00 0.00 H new ATOM 0 HD13 ILE A 83 7.838 11.104 10.518 1.00 0.00 H new ATOM 1340 N TYR A 84 6.817 11.229 5.441 1.00 0.00 N ATOM 1341 CA TYR A 84 6.531 11.686 4.082 1.00 0.00 C ATOM 1342 C TYR A 84 5.257 12.549 4.000 1.00 0.00 C ATOM 1343 O TYR A 84 4.510 12.462 3.027 1.00 0.00 O ATOM 1344 CB TYR A 84 6.427 10.476 3.135 1.00 0.00 C ATOM 1345 CG TYR A 84 7.558 9.463 3.174 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.888 9.867 3.401 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.284 8.117 2.867 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.931 8.926 3.346 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.327 7.179 2.802 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.651 7.584 3.037 1.00 0.00 C ATOM 1351 OH TYR A 84 10.662 6.675 2.953 1.00 0.00 O ATOM 0 H TYR A 84 6.645 10.232 5.572 1.00 0.00 H new ATOM 0 HA TYR A 84 7.359 12.324 3.772 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.497 9.952 3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.345 10.852 2.115 1.00 0.00 H new ATOM 0 HD1 TYR A 84 9.107 10.902 3.618 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.267 7.804 2.681 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.947 9.234 3.541 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.111 6.146 2.571 1.00 0.00 H new ATOM 0 HH TYR A 84 10.293 5.795 2.732 1.00 0.00 H new ATOM 1361 N ASN A 85 5.033 13.419 4.990 1.00 0.00 N ATOM 1362 CA ASN A 85 3.942 14.372 5.124 1.00 0.00 C ATOM 1363 C ASN A 85 3.487 14.988 3.798 1.00 0.00 C ATOM 1364 O ASN A 85 2.284 15.094 3.565 1.00 0.00 O ATOM 1365 CB ASN A 85 4.334 15.461 6.134 1.00 0.00 C ATOM 1366 CG ASN A 85 5.446 16.374 5.622 1.00 0.00 C ATOM 1367 OD1 ASN A 85 5.187 17.501 5.218 1.00 0.00 O ATOM 1368 ND2 ASN A 85 6.692 15.903 5.610 1.00 0.00 N ATOM 0 H ASN A 85 5.670 13.474 5.785 1.00 0.00 H new ATOM 0 HA ASN A 85 3.079 13.816 5.490 1.00 0.00 H new ATOM 0 HB2 ASN A 85 3.457 16.063 6.370 1.00 0.00 H new ATOM 0 HB3 ASN A 85 4.657 14.989 7.062 1.00 0.00 H new ATOM 0 HD21 ASN A 85 7.454 16.484 5.259 1.00 0.00 H new ATOM 0 HD22 ASN A 85 6.885 14.961 5.951 1.00 0.00 H new ATOM 1375 N GLU A 86 4.417 15.371 2.917 1.00 0.00 N ATOM 1376 CA GLU A 86 4.101 15.920 1.603 1.00 0.00 C ATOM 1377 C GLU A 86 3.087 15.054 0.844 1.00 0.00 C ATOM 1378 O GLU A 86 2.155 15.579 0.241 1.00 0.00 O ATOM 1379 CB GLU A 86 5.379 16.215 0.797 1.00 0.00 C ATOM 1380 CG GLU A 86 6.209 15.003 0.335 1.00 0.00 C ATOM 1381 CD GLU A 86 6.915 14.235 1.452 1.00 0.00 C ATOM 1382 OE1 GLU A 86 7.069 14.808 2.553 1.00 0.00 O ATOM 1383 OE2 GLU A 86 7.296 13.078 1.177 1.00 0.00 O ATOM 0 H GLU A 86 5.418 15.306 3.102 1.00 0.00 H new ATOM 0 HA GLU A 86 3.607 16.880 1.753 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.098 16.789 -0.086 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.021 16.855 1.402 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.553 14.315 -0.199 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.958 15.346 -0.378 1.00 0.00 H new ATOM 1390 N ALA A 87 3.236 13.729 0.910 1.00 0.00 N ATOM 1391 CA ALA A 87 2.318 12.786 0.287 1.00 0.00 C ATOM 1392 C ALA A 87 0.906 12.910 0.861 1.00 0.00 C ATOM 1393 O ALA A 87 -0.075 12.709 0.150 1.00 0.00 O ATOM 1394 CB ALA A 87 2.848 11.367 0.495 1.00 0.00 C ATOM 0 H ALA A 87 4.007 13.281 1.404 1.00 0.00 H new ATOM 0 HA ALA A 87 2.257 13.012 -0.778 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.167 10.653 0.032 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.834 11.276 0.039 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.921 11.159 1.562 1.00 0.00 H new ATOM 1400 N LEU A 88 0.803 13.201 2.160 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.460 13.246 2.875 1.00 0.00 C ATOM 1402 C LEU A 88 -1.139 14.588 2.613 1.00 0.00 C ATOM 1403 O LEU A 88 -2.304 14.636 2.228 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.228 13.042 4.380 1.00 0.00 C ATOM 1405 CG LEU A 88 0.129 11.608 4.805 1.00 0.00 C ATOM 1406 CD1 LEU A 88 1.435 11.088 4.207 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.257 11.578 6.330 1.00 0.00 C ATOM 0 H LEU A 88 1.610 13.414 2.746 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.107 12.443 2.521 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.574 13.708 4.700 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.128 13.347 4.914 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.667 10.962 4.435 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.615 10.071 4.555 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.364 11.092 3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.259 11.730 4.519 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.510 10.569 6.654 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.041 12.267 6.643 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.689 11.877 6.781 1.00 0.00 H new ATOM 1479 N SER B 3 9.871 3.149 -5.914 1.00 0.00 N ATOM 1480 CA SER B 3 8.653 3.168 -6.695 1.00 0.00 C ATOM 1481 C SER B 3 7.663 2.055 -6.320 1.00 0.00 C ATOM 1482 O SER B 3 6.481 2.361 -6.147 1.00 0.00 O ATOM 1483 CB SER B 3 9.013 3.158 -8.191 1.00 0.00 C ATOM 1484 OG SER B 3 10.241 3.835 -8.421 1.00 0.00 O ATOM 0 HA SER B 3 8.119 4.089 -6.462 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.088 2.130 -8.544 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.217 3.634 -8.764 1.00 0.00 H new ATOM 0 HG SER B 3 10.766 3.851 -7.593 1.00 0.00 H new ATOM 1490 N PRO B 4 8.083 0.778 -6.214 1.00 0.00 N ATOM 1491 CA PRO B 4 7.159 -0.320 -5.972 1.00 0.00 C ATOM 1492 C PRO B 4 6.423 -0.190 -4.641 1.00 0.00 C ATOM 1493 O PRO B 4 5.211 -0.371 -4.590 1.00 0.00 O ATOM 1494 CB PRO B 4 7.992 -1.607 -6.033 1.00 0.00 C ATOM 1495 CG PRO B 4 9.219 -1.200 -6.846 1.00 0.00 C ATOM 1496 CD PRO B 4 9.426 0.249 -6.411 1.00 0.00 C ATOM 0 HA PRO B 4 6.372 -0.321 -6.726 1.00 0.00 H new ATOM 0 HB2 PRO B 4 8.268 -1.954 -5.037 1.00 0.00 H new ATOM 0 HB3 PRO B 4 7.444 -2.418 -6.513 1.00 0.00 H new ATOM 0 HG2 PRO B 4 10.084 -1.822 -6.617 1.00 0.00 H new ATOM 0 HG3 PRO B 4 9.043 -1.282 -7.919 1.00 0.00 H new ATOM 0 HD2 PRO B 4 10.011 0.306 -5.493 1.00 0.00 H new ATOM 0 HD3 PRO B 4 9.966 0.816 -7.169 1.00 0.00 H new ATOM 1504 N LEU B 5 7.141 0.118 -3.558 1.00 0.00 N ATOM 1505 CA LEU B 5 6.490 0.297 -2.270 1.00 0.00 C ATOM 1506 C LEU B 5 5.825 1.670 -2.229 1.00 0.00 C ATOM 1507 O LEU B 5 4.676 1.794 -1.804 1.00 0.00 O ATOM 1508 CB LEU B 5 7.488 0.100 -1.125 1.00 0.00 C ATOM 1509 CG LEU B 5 6.830 0.289 0.253 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.610 -0.612 0.471 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.830 -0.044 1.357 1.00 0.00 C ATOM 0 H LEU B 5 8.153 0.245 -3.551 1.00 0.00 H new ATOM 0 HA LEU B 5 5.716 -0.459 -2.140 1.00 0.00 H new ATOM 0 HB2 LEU B 5 7.918 -0.900 -1.187 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.310 0.808 -1.234 1.00 0.00 H new ATOM 0 HG LEU B 5 6.509 1.330 0.287 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.194 -0.428 1.462 1.00 0.00 H new ATOM 0 HD12 LEU B 5 4.856 -0.393 -0.285 1.00 0.00 H new ATOM 0 HD13 LEU B 5 5.910 -1.657 0.392 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.357 0.092 2.330 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.155 -1.079 1.253 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.693 0.617 1.278 1.00 0.00 H new ATOM 1523 N ASP B 6 6.547 2.699 -2.686 1.00 0.00 N ATOM 1524 CA ASP B 6 6.094 4.082 -2.663 1.00 0.00 C ATOM 1525 C ASP B 6 4.702 4.205 -3.272 1.00 0.00 C ATOM 1526 O ASP B 6 3.834 4.833 -2.670 1.00 0.00 O ATOM 1527 CB ASP B 6 7.080 5.003 -3.393 1.00 0.00 C ATOM 1528 CG ASP B 6 8.395 5.226 -2.647 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.625 4.537 -1.629 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.157 6.093 -3.124 1.00 0.00 O ATOM 0 H ASP B 6 7.478 2.585 -3.088 1.00 0.00 H new ATOM 0 HA ASP B 6 6.046 4.397 -1.621 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.298 4.580 -4.373 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.602 5.968 -3.562 1.00 0.00 H new ATOM 1535 N GLN B 7 4.465 3.603 -4.445 1.00 0.00 N ATOM 1536 CA GLN B 7 3.142 3.692 -5.054 1.00 0.00 C ATOM 1537 C GLN B 7 2.077 3.043 -4.161 1.00 0.00 C ATOM 1538 O GLN B 7 0.971 3.561 -4.043 1.00 0.00 O ATOM 1539 CB GLN B 7 3.151 3.124 -6.479 1.00 0.00 C ATOM 1540 CG GLN B 7 3.299 1.599 -6.520 1.00 0.00 C ATOM 1541 CD GLN B 7 3.690 1.115 -7.908 1.00 0.00 C ATOM 1542 OE1 GLN B 7 2.903 0.492 -8.613 1.00 0.00 O ATOM 1543 NE2 GLN B 7 4.921 1.408 -8.313 1.00 0.00 N ATOM 0 H GLN B 7 5.152 3.066 -4.974 1.00 0.00 H new ATOM 0 HA GLN B 7 2.873 4.745 -5.141 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.226 3.406 -6.982 1.00 0.00 H new ATOM 0 HB3 GLN B 7 3.969 3.577 -7.039 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.053 1.286 -5.798 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.360 1.133 -6.222 1.00 0.00 H new ATOM 0 HE21 GLN B 7 5.549 1.928 -7.700 1.00 0.00 H new ATOM 0 HE22 GLN B 7 5.238 1.113 -9.237 1.00 0.00 H new ATOM 1552 N ALA B 8 2.405 1.917 -3.522 1.00 0.00 N ATOM 1553 CA ALA B 8 1.456 1.195 -2.692 1.00 0.00 C ATOM 1554 C ALA B 8 1.108 1.993 -1.440 1.00 0.00 C ATOM 1555 O ALA B 8 -0.071 2.217 -1.173 1.00 0.00 O ATOM 1556 CB ALA B 8 1.988 -0.189 -2.350 1.00 0.00 C ATOM 0 H ALA B 8 3.329 1.489 -3.569 1.00 0.00 H new ATOM 0 HA ALA B 8 0.533 1.063 -3.257 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.263 -0.714 -1.728 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.154 -0.752 -3.268 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.929 -0.093 -1.808 1.00 0.00 H new ATOM 1562 N ILE B 9 2.107 2.451 -0.677 1.00 0.00 N ATOM 1563 CA ILE B 9 1.808 3.319 0.460 1.00 0.00 C ATOM 1564 C ILE B 9 1.048 4.552 -0.053 1.00 0.00 C ATOM 1565 O ILE B 9 -0.025 4.879 0.456 1.00 0.00 O ATOM 1566 CB ILE B 9 3.046 3.618 1.339 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.175 4.373 0.625 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.556 2.306 1.949 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.358 4.700 1.548 1.00 0.00 C ATOM 0 H ILE B 9 3.095 2.243 -0.820 1.00 0.00 H new ATOM 0 HA ILE B 9 1.152 2.802 1.160 1.00 0.00 H new ATOM 0 HB ILE B 9 2.716 4.302 2.121 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.531 3.774 -0.214 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.779 5.300 0.210 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.429 2.508 2.570 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.771 1.860 2.560 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.831 1.616 1.151 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.123 5.234 0.984 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.014 5.324 2.373 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.778 3.775 1.943 1.00 0.00 H new ATOM 1581 N GLY B 10 1.547 5.167 -1.130 1.00 0.00 N ATOM 1582 CA GLY B 10 0.886 6.239 -1.858 1.00 0.00 C ATOM 1583 C GLY B 10 -0.606 5.972 -2.051 1.00 0.00 C ATOM 1584 O GLY B 10 -1.421 6.853 -1.801 1.00 0.00 O ATOM 0 H GLY B 10 2.453 4.919 -1.527 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.019 7.177 -1.319 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.360 6.361 -2.832 1.00 0.00 H new ATOM 1588 N LEU B 11 -0.969 4.757 -2.469 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.351 4.337 -2.653 1.00 0.00 C ATOM 1590 C LEU B 11 -3.156 4.555 -1.365 1.00 0.00 C ATOM 1591 O LEU B 11 -4.129 5.307 -1.367 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.373 2.870 -3.127 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.605 2.426 -3.928 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.904 2.667 -3.171 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.632 3.039 -5.329 1.00 0.00 C ATOM 0 H LEU B 11 -0.293 4.026 -2.692 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.830 4.945 -3.421 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.488 2.696 -3.739 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.286 2.227 -2.251 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.518 1.347 -4.059 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.746 2.337 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.890 2.107 -2.236 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -5.007 3.730 -2.955 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.521 2.697 -5.859 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.652 4.126 -5.250 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.742 2.732 -5.878 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.749 3.924 -0.258 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.410 4.067 1.040 1.00 0.00 C ATOM 1609 C LEU B 12 -3.513 5.543 1.433 1.00 0.00 C ATOM 1610 O LEU B 12 -4.564 5.991 1.902 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.639 3.309 2.135 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.878 1.791 2.168 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.276 1.062 0.963 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.263 1.215 3.448 1.00 0.00 C ATOM 0 H LEU B 12 -1.946 3.296 -0.240 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.411 3.644 0.948 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.573 3.491 1.999 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.912 3.725 3.105 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.957 1.637 2.137 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.479 -0.006 1.045 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.722 1.446 0.045 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.199 1.226 0.940 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.429 0.138 3.479 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.192 1.418 3.460 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.730 1.679 4.317 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.413 6.285 1.280 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.347 7.686 1.679 1.00 0.00 C ATOM 1628 C ILE B 13 -3.365 8.489 0.868 1.00 0.00 C ATOM 1629 O ILE B 13 -4.139 9.265 1.435 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.900 8.221 1.547 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -0.057 7.896 2.797 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.867 9.746 1.376 1.00 0.00 C ATOM 1633 CD1 ILE B 13 0.352 6.426 2.907 1.00 0.00 C ATOM 0 H ILE B 13 -1.547 5.929 0.876 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.612 7.793 2.731 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.488 7.730 0.666 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.842 8.513 2.787 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.623 8.172 3.686 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.167 10.080 1.287 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.417 10.023 0.476 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.328 10.219 2.243 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.942 6.279 3.812 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.541 5.802 2.950 1.00 0.00 H new ATOM 0 HD13 ILE B 13 0.947 6.148 2.037 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.363 8.285 -0.450 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.270 8.919 -1.384 1.00 0.00 C ATOM 1647 C GLY B 14 -5.708 8.605 -1.000 1.00 0.00 C ATOM 1648 O GLY B 14 -6.486 9.519 -0.758 1.00 0.00 O ATOM 0 H GLY B 14 -2.705 7.651 -0.903 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -4.111 9.997 -1.384 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -4.069 8.567 -2.396 1.00 0.00 H new ATOM 1652 N ILE B 15 -6.054 7.317 -0.910 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.380 6.862 -0.510 1.00 0.00 C ATOM 1654 C ILE B 15 -7.833 7.563 0.774 1.00 0.00 C ATOM 1655 O ILE B 15 -8.971 8.017 0.864 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.395 5.319 -0.420 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.720 4.771 -1.822 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.377 4.792 0.634 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.728 3.242 -1.906 1.00 0.00 C ATOM 0 H ILE B 15 -5.409 6.554 -1.117 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.114 7.140 -1.266 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.415 4.971 -0.092 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.695 5.147 -2.131 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -6.989 5.160 -2.531 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.343 3.703 0.651 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.100 5.179 1.615 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.387 5.120 0.387 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.965 2.935 -2.925 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.746 2.857 -1.630 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.479 2.844 -1.223 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.946 7.669 1.764 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.274 8.367 2.996 1.00 0.00 C ATOM 1673 C PHE B 16 -7.583 9.843 2.727 1.00 0.00 C ATOM 1674 O PHE B 16 -8.691 10.319 2.978 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.119 8.200 3.987 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.416 8.694 5.384 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.242 10.047 5.711 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.883 7.800 6.361 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.392 10.470 7.038 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -6.987 8.210 7.699 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.694 9.537 8.044 1.00 0.00 C ATOM 0 H PHE B 16 -6.003 7.282 1.733 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.175 7.934 3.431 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.850 7.145 4.038 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.248 8.733 3.604 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.993 10.762 4.941 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -7.163 6.795 6.082 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.275 11.514 7.288 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.291 7.506 8.460 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.700 9.841 9.080 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.593 10.581 2.221 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.683 12.033 2.131 1.00 0.00 C ATOM 1693 C HIS B 17 -7.747 12.480 1.128 1.00 0.00 C ATOM 1694 O HIS B 17 -8.363 13.527 1.315 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.297 12.636 1.884 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.408 12.433 3.085 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -3.760 11.263 3.406 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.369 13.241 4.192 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -3.338 11.368 4.677 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.680 12.557 5.201 1.00 0.00 N ATOM 0 H HIS B 17 -5.719 10.192 1.867 1.00 0.00 H new ATOM 0 HA HIS B 17 -7.026 12.426 3.088 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.844 12.173 1.007 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -5.391 13.701 1.670 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -3.624 10.461 2.791 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -4.795 14.230 4.272 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -2.796 10.599 5.207 1.00 0.00 H new ATOM 1708 N LYS B 18 -8.002 11.660 0.106 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.125 11.796 -0.812 1.00 0.00 C ATOM 1710 C LYS B 18 -10.412 11.981 -0.010 1.00 0.00 C ATOM 1711 O LYS B 18 -11.221 12.854 -0.321 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.178 10.535 -1.689 1.00 0.00 C ATOM 1713 CG LYS B 18 -10.389 10.412 -2.622 1.00 0.00 C ATOM 1714 CD LYS B 18 -10.263 9.085 -3.386 1.00 0.00 C ATOM 1715 CE LYS B 18 -11.386 8.872 -4.407 1.00 0.00 C ATOM 1716 NZ LYS B 18 -12.694 8.670 -3.761 1.00 0.00 N ATOM 0 H LYS B 18 -7.410 10.858 -0.109 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.008 12.668 -1.455 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -8.273 10.501 -2.295 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.158 9.662 -1.036 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.316 10.436 -2.049 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -10.422 11.251 -3.317 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -9.302 9.058 -3.900 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -10.266 8.260 -2.673 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -11.440 9.735 -5.071 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -11.152 8.007 -5.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -13.453 8.915 -4.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -12.791 7.674 -3.477 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -12.763 9.278 -2.920 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.599 11.160 1.027 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.751 11.268 1.897 1.00 0.00 C ATOM 1732 C TYR B 19 -11.586 12.432 2.867 1.00 0.00 C ATOM 1733 O TYR B 19 -12.456 13.297 2.878 1.00 0.00 O ATOM 1734 CB TYR B 19 -12.065 9.921 2.551 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.999 9.112 1.677 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -14.389 9.254 1.846 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -12.498 8.454 0.541 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -15.271 8.721 0.894 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -13.384 7.892 -0.394 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.771 8.028 -0.219 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.623 7.300 -0.991 1.00 0.00 O ATOM 0 H TYR B 19 -9.955 10.410 1.278 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.637 11.511 1.310 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -11.141 9.367 2.717 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.520 10.082 3.528 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.777 9.774 2.709 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -11.432 8.380 0.386 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -16.337 8.844 1.018 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -12.998 7.355 -1.248 1.00 0.00 H new ATOM 0 HH TYR B 19 -16.114 6.666 -0.428 1.00 0.00 H new ATOM 1751 N SER B 20 -10.492 12.506 3.635 1.00 0.00 N ATOM 1752 CA SER B 20 -10.299 13.596 4.595 1.00 0.00 C ATOM 1753 C SER B 20 -10.614 14.965 3.979 1.00 0.00 C ATOM 1754 O SER B 20 -11.368 15.758 4.546 1.00 0.00 O ATOM 1755 CB SER B 20 -8.876 13.570 5.159 1.00 0.00 C ATOM 1756 OG SER B 20 -8.579 12.286 5.671 1.00 0.00 O ATOM 0 H SER B 20 -9.731 11.827 3.610 1.00 0.00 H new ATOM 0 HA SER B 20 -11.003 13.440 5.413 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.162 13.833 4.378 1.00 0.00 H new ATOM 0 HB3 SER B 20 -8.775 14.316 5.947 1.00 0.00 H new ATOM 0 HG SER B 20 -8.819 12.249 6.620 1.00 0.00 H new ATOM 1762 N GLY B 21 -10.064 15.220 2.789 1.00 0.00 N ATOM 1763 CA GLY B 21 -10.261 16.448 2.039 1.00 0.00 C ATOM 1764 C GLY B 21 -11.736 16.809 1.855 1.00 0.00 C ATOM 1765 O GLY B 21 -12.079 17.987 1.932 1.00 0.00 O ATOM 0 H GLY B 21 -9.454 14.555 2.314 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.754 17.265 2.552 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.793 16.348 1.060 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.291 14.797 9.130 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.796 13.433 8.951 1.00 0.00 C ATOM 1849 C HIS B 27 -5.653 12.450 9.765 1.00 0.00 C ATOM 1850 O HIS B 27 -5.143 11.595 10.488 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.308 13.374 9.315 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.470 14.296 8.462 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.481 14.353 7.086 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.636 15.284 8.912 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.670 15.360 6.719 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -1.128 15.953 7.795 1.00 0.00 N ATOM 0 HA HIS B 27 -4.884 13.134 7.907 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.183 13.640 10.364 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -2.949 12.351 9.201 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -3.008 13.743 6.461 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.411 15.506 9.945 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.480 15.653 5.697 1.00 0.00 H new ATOM 1864 N THR B 28 -6.971 12.565 9.612 1.00 0.00 N ATOM 1865 CA THR B 28 -8.002 11.921 10.396 1.00 0.00 C ATOM 1866 C THR B 28 -9.182 11.639 9.464 1.00 0.00 C ATOM 1867 O THR B 28 -9.307 12.269 8.410 1.00 0.00 O ATOM 1868 CB THR B 28 -8.388 12.833 11.579 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.218 14.196 11.238 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.512 12.574 12.805 1.00 0.00 C ATOM 0 H THR B 28 -7.366 13.156 8.881 1.00 0.00 H new ATOM 0 HA THR B 28 -7.660 10.978 10.822 1.00 0.00 H new ATOM 0 HB THR B 28 -9.430 12.609 11.806 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.470 14.758 12.001 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.816 13.236 13.616 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.626 11.537 13.121 1.00 0.00 H new ATOM 0 HG23 THR B 28 -6.469 12.764 12.553 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.023 10.677 9.848 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.300 10.397 9.194 1.00 0.00 C ATOM 1880 C LEU B 29 -12.360 10.199 10.272 1.00 0.00 C ATOM 1881 O LEU B 29 -12.107 9.481 11.234 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.221 9.111 8.357 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.354 9.204 7.096 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.236 7.808 6.476 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.963 10.132 6.044 1.00 0.00 C ATOM 0 H LEU B 29 -9.831 10.060 10.637 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.547 11.231 8.538 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -10.833 8.310 8.987 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.231 8.825 8.064 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.384 9.603 7.392 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.621 7.860 5.577 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.774 7.129 7.193 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.229 7.440 6.216 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.314 10.166 5.169 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.945 9.758 5.753 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -11.065 11.135 6.459 1.00 0.00 H new ATOM 1897 N SER B 30 -13.556 10.767 10.105 1.00 0.00 N ATOM 1898 CA SER B 30 -14.674 10.459 10.996 1.00 0.00 C ATOM 1899 C SER B 30 -15.269 9.104 10.596 1.00 0.00 C ATOM 1900 O SER B 30 -15.135 8.694 9.447 1.00 0.00 O ATOM 1901 CB SER B 30 -15.710 11.584 10.930 1.00 0.00 C ATOM 1902 OG SER B 30 -15.099 12.808 11.284 1.00 0.00 O ATOM 0 H SER B 30 -13.773 11.437 9.367 1.00 0.00 H new ATOM 0 HA SER B 30 -14.334 10.389 12.029 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.127 11.651 9.925 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.538 11.370 11.605 1.00 0.00 H new ATOM 0 HG SER B 30 -15.761 13.529 11.240 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.910 8.377 11.512 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.287 6.992 11.245 1.00 0.00 C ATOM 1910 C LYS B 31 -17.255 6.835 10.066 1.00 0.00 C ATOM 1911 O LYS B 31 -17.087 5.940 9.243 1.00 0.00 O ATOM 1912 CB LYS B 31 -16.742 6.287 12.526 1.00 0.00 C ATOM 1913 CG LYS B 31 -17.946 6.919 13.236 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.049 6.261 14.616 1.00 0.00 C ATOM 1915 CE LYS B 31 -19.100 6.921 15.509 1.00 0.00 C ATOM 1916 NZ LYS B 31 -18.962 6.443 16.896 1.00 0.00 N ATOM 0 H LYS B 31 -16.176 8.721 12.435 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.388 6.475 10.909 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -16.987 5.253 12.283 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -15.904 6.261 13.223 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -17.815 7.997 13.332 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -18.859 6.758 12.663 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.294 5.206 14.493 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.078 6.308 15.109 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.986 8.005 15.477 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -20.099 6.694 15.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -19.681 6.898 17.493 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -19.092 5.412 16.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -18.015 6.681 17.253 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.264 7.700 9.945 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.195 7.621 8.819 1.00 0.00 C ATOM 1932 C LYS B 32 -18.501 8.000 7.499 1.00 0.00 C ATOM 1933 O LYS B 32 -18.728 7.377 6.462 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.441 8.464 9.116 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.448 8.435 7.959 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.731 9.178 8.351 1.00 0.00 C ATOM 1937 CE LYS B 32 -23.694 9.314 7.164 1.00 0.00 C ATOM 1938 NZ LYS B 32 -24.124 8.005 6.644 1.00 0.00 N ATOM 0 H LYS B 32 -18.456 8.454 10.604 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.528 6.591 8.691 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.920 8.094 10.022 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.143 9.494 9.311 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -21.009 8.896 7.074 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.683 7.403 7.698 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -23.227 8.645 9.162 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -22.477 10.168 8.729 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -24.569 9.886 7.472 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -23.209 9.878 6.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -24.837 8.144 5.900 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -23.304 7.502 6.248 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -24.535 7.443 7.416 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.630 9.010 7.536 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.788 9.380 6.405 1.00 0.00 C ATOM 1954 C GLU B 33 -15.961 8.163 5.970 1.00 0.00 C ATOM 1955 O GLU B 33 -15.920 7.809 4.793 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.918 10.565 6.838 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.886 11.024 5.803 1.00 0.00 C ATOM 1958 CD GLU B 33 -13.946 12.078 6.385 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -13.789 12.098 7.627 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -13.398 12.848 5.573 1.00 0.00 O ATOM 0 H GLU B 33 -17.491 9.596 8.359 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.378 9.685 5.541 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.569 11.406 7.077 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.395 10.296 7.756 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.307 10.167 5.460 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.398 11.432 4.932 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.331 7.496 6.938 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.644 6.234 6.733 1.00 0.00 C ATOM 1969 C LEU B 34 -15.604 5.206 6.126 1.00 0.00 C ATOM 1970 O LEU B 34 -15.237 4.520 5.180 1.00 0.00 O ATOM 1971 CB LEU B 34 -13.978 5.797 8.050 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.511 4.335 8.169 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.687 3.349 8.271 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.509 3.965 7.068 1.00 0.00 C ATOM 0 H LEU B 34 -15.287 7.829 7.901 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.838 6.337 6.007 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.113 6.439 8.217 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.680 5.991 8.861 1.00 0.00 H new ATOM 0 HG LEU B 34 -12.974 4.248 9.113 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.303 2.332 8.353 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.283 3.584 9.153 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.309 3.431 7.380 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.204 2.925 7.188 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.976 4.096 6.092 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.634 4.610 7.141 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.841 5.087 6.613 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.796 4.173 5.997 1.00 0.00 C ATOM 1988 C LYS B 35 -17.907 4.468 4.500 1.00 0.00 C ATOM 1989 O LYS B 35 -17.834 3.552 3.681 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.165 4.235 6.689 1.00 0.00 C ATOM 1991 CG LYS B 35 -19.939 2.942 6.405 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.312 2.930 7.085 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.857 1.497 7.096 1.00 0.00 C ATOM 1994 NZ LYS B 35 -23.194 1.432 7.711 1.00 0.00 N ATOM 0 H LYS B 35 -17.197 5.603 7.417 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.429 3.154 6.122 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.036 4.366 7.763 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.728 5.096 6.328 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.067 2.826 5.329 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.356 2.088 6.751 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.230 3.308 8.104 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -21.999 3.589 6.555 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.906 1.118 6.075 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -21.172 0.850 7.644 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -23.533 0.449 7.702 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -23.141 1.771 8.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -23.853 2.030 7.173 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.049 5.748 4.151 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.113 6.203 2.769 1.00 0.00 C ATOM 2010 C GLU B 36 -16.819 5.879 2.003 1.00 0.00 C ATOM 2011 O GLU B 36 -16.867 5.547 0.816 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.447 7.703 2.746 1.00 0.00 C ATOM 2013 CG GLU B 36 -19.086 8.135 1.418 1.00 0.00 C ATOM 2014 CD GLU B 36 -20.479 7.541 1.236 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -21.393 8.017 1.943 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.600 6.614 0.405 1.00 0.00 O ATOM 0 H GLU B 36 -18.123 6.504 4.832 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.907 5.665 2.251 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.126 7.935 3.566 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.537 8.279 2.913 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -19.148 9.223 1.382 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -18.448 7.824 0.590 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.659 5.976 2.665 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.397 5.486 2.116 1.00 0.00 C ATOM 2025 C LEU B 37 -14.550 4.018 1.761 1.00 0.00 C ATOM 2026 O LEU B 37 -14.349 3.641 0.612 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.213 5.779 3.063 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.826 5.292 2.596 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.733 6.061 3.348 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.579 3.808 2.909 1.00 0.00 C ATOM 0 H LEU B 37 -15.573 6.395 3.591 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.157 6.023 1.198 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.161 6.856 3.223 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.428 5.324 4.030 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.798 5.453 1.518 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.753 5.717 3.018 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.831 7.127 3.143 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.837 5.887 4.419 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.588 3.522 2.558 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.643 3.648 3.985 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.331 3.200 2.407 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.928 3.186 2.725 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.040 1.754 2.515 1.00 0.00 C ATOM 2044 C ILE B 38 -16.005 1.455 1.372 1.00 0.00 C ATOM 2045 O ILE B 38 -15.663 0.677 0.487 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.411 1.066 3.837 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.216 1.250 4.785 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.742 -0.424 3.660 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.436 0.559 6.121 1.00 0.00 C ATOM 0 H ILE B 38 -15.164 3.488 3.670 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.080 1.341 2.206 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.316 1.519 4.241 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.316 0.852 4.315 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.046 2.314 4.951 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.997 -0.858 4.627 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.588 -0.531 2.981 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.877 -0.942 3.247 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.566 0.715 6.759 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.320 0.975 6.604 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.580 -0.509 5.959 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.187 2.073 1.356 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.187 1.739 0.352 1.00 0.00 C ATOM 2063 C GLN B 39 -17.641 1.939 -1.065 1.00 0.00 C ATOM 2064 O GLN B 39 -17.942 1.145 -1.954 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.489 2.530 0.555 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.212 2.333 1.900 1.00 0.00 C ATOM 2067 CD GLN B 39 -19.930 0.995 2.581 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -20.561 -0.011 2.278 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -18.988 0.975 3.519 1.00 0.00 N ATOM 0 H GLN B 39 -17.469 2.796 2.018 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.424 0.682 0.477 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.265 3.591 0.441 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.179 2.262 -0.245 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.922 3.138 2.575 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.286 2.424 1.738 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -18.480 1.829 3.749 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -18.774 0.106 4.008 1.00 0.00 H new ATOM 2078 N LYS B 40 -16.856 3.000 -1.283 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.271 3.259 -2.589 1.00 0.00 C ATOM 2080 C LYS B 40 -15.011 2.418 -2.810 1.00 0.00 C ATOM 2081 O LYS B 40 -14.891 1.699 -3.799 1.00 0.00 O ATOM 2082 CB LYS B 40 -15.969 4.760 -2.692 1.00 0.00 C ATOM 2083 CG LYS B 40 -15.499 5.223 -4.079 1.00 0.00 C ATOM 2084 CD LYS B 40 -16.512 4.988 -5.208 1.00 0.00 C ATOM 2085 CE LYS B 40 -17.887 5.598 -4.906 1.00 0.00 C ATOM 2086 NZ LYS B 40 -18.779 5.513 -6.076 1.00 0.00 N ATOM 0 H LYS B 40 -16.616 3.688 -0.569 1.00 0.00 H new ATOM 0 HA LYS B 40 -16.974 2.973 -3.371 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.866 5.317 -2.422 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.203 5.014 -1.959 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -15.266 6.287 -4.033 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -14.573 4.705 -4.326 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -16.125 5.415 -6.133 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.623 3.916 -5.374 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.340 5.078 -4.062 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -17.768 6.641 -4.612 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -19.701 5.933 -5.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -18.356 6.030 -6.873 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -18.911 4.516 -6.340 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.052 2.555 -1.898 1.00 0.00 N ATOM 2101 CA GLU B 41 -12.687 2.072 -2.030 1.00 0.00 C ATOM 2102 C GLU B 41 -12.519 0.583 -1.728 1.00 0.00 C ATOM 2103 O GLU B 41 -11.585 -0.030 -2.230 1.00 0.00 O ATOM 2104 CB GLU B 41 -11.759 2.927 -1.161 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.888 4.436 -1.444 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.626 4.818 -2.897 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.755 4.171 -3.518 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -12.294 5.769 -3.360 1.00 0.00 O ATOM 0 H GLU B 41 -14.216 3.027 -1.009 1.00 0.00 H new ATOM 0 HA GLU B 41 -12.413 2.175 -3.080 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -11.980 2.740 -0.110 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -10.727 2.619 -1.329 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.891 4.763 -1.168 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.189 4.976 -0.805 1.00 0.00 H new ATOM 2115 N LEU B 42 -13.391 -0.004 -0.912 1.00 0.00 N ATOM 2116 CA LEU B 42 -13.489 -1.446 -0.733 1.00 0.00 C ATOM 2117 C LEU B 42 -14.855 -1.823 -1.290 1.00 0.00 C ATOM 2118 O LEU B 42 -15.799 -2.088 -0.552 1.00 0.00 O ATOM 2119 CB LEU B 42 -13.309 -1.834 0.741 1.00 0.00 C ATOM 2120 CG LEU B 42 -11.846 -1.747 1.211 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -11.792 -1.915 2.733 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -10.973 -2.836 0.565 1.00 0.00 C ATOM 0 H LEU B 42 -14.060 0.520 -0.348 1.00 0.00 H new ATOM 0 HA LEU B 42 -12.700 -1.988 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -13.923 -1.181 1.361 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -13.673 -2.850 0.891 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.459 -0.773 0.912 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -10.757 -1.854 3.069 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -12.375 -1.125 3.207 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.206 -2.886 3.007 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -9.948 -2.740 0.923 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -11.360 -3.819 0.833 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -10.991 -2.722 -0.519 1.00 0.00 H new ATOM 2243 N ASP B 50 -23.638 -4.727 6.534 1.00 0.00 N ATOM 2244 CA ASP B 50 -23.563 -3.438 7.207 1.00 0.00 C ATOM 2245 C ASP B 50 -23.088 -3.606 8.643 1.00 0.00 C ATOM 2246 O ASP B 50 -22.203 -2.883 9.088 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.910 -2.700 7.129 1.00 0.00 C ATOM 2248 CG ASP B 50 -26.007 -3.306 8.003 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -26.120 -4.553 8.001 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -26.701 -2.513 8.673 1.00 0.00 O ATOM 0 HA ASP B 50 -22.827 -2.821 6.692 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.760 -1.661 7.422 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -25.249 -2.693 6.093 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.649 -4.592 9.343 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.252 -4.960 10.693 1.00 0.00 C ATOM 2257 C ALA B 51 -21.737 -5.174 10.782 1.00 0.00 C ATOM 2258 O ALA B 51 -21.076 -4.656 11.684 1.00 0.00 O ATOM 2259 CB ALA B 51 -24.014 -6.217 11.108 1.00 0.00 C ATOM 0 H ALA B 51 -24.408 -5.166 8.975 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.500 -4.149 11.377 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -23.723 -6.501 12.119 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.085 -6.019 11.081 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.778 -7.029 10.421 1.00 0.00 H new ATOM 2265 N GLU B 52 -21.180 -5.916 9.822 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.757 -6.197 9.788 1.00 0.00 C ATOM 2267 C GLU B 52 -18.997 -4.901 9.530 1.00 0.00 C ATOM 2268 O GLU B 52 -17.999 -4.631 10.195 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.432 -7.266 8.733 1.00 0.00 C ATOM 2270 CG GLU B 52 -20.342 -8.500 8.831 1.00 0.00 C ATOM 2271 CD GLU B 52 -20.367 -9.089 10.239 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -19.310 -9.615 10.652 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -21.438 -8.993 10.877 1.00 0.00 O ATOM 0 H GLU B 52 -21.706 -6.333 9.054 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.444 -6.600 10.751 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.527 -6.829 7.739 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.393 -7.577 8.846 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -21.355 -8.226 8.536 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -19.999 -9.259 8.128 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.484 -4.084 8.590 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.892 -2.775 8.349 1.00 0.00 C ATOM 2282 C ILE B 53 -18.858 -1.963 9.647 1.00 0.00 C ATOM 2283 O ILE B 53 -17.809 -1.422 9.974 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.570 -2.008 7.196 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -19.647 -2.802 5.880 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.827 -0.688 6.940 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -18.292 -3.302 5.370 1.00 0.00 C ATOM 0 H ILE B 53 -20.279 -4.308 7.992 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.866 -2.936 8.019 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.596 -1.827 7.518 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -20.307 -3.657 6.023 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -20.101 -2.173 5.115 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -19.311 -0.151 6.124 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.851 -0.076 7.842 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.792 -0.899 6.672 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -18.434 -3.851 4.439 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -17.634 -2.452 5.193 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.843 -3.959 6.115 1.00 0.00 H new ATOM 2299 N VAL B 54 -19.957 -1.862 10.402 1.00 0.00 N ATOM 2300 CA VAL B 54 -19.943 -1.051 11.620 1.00 0.00 C ATOM 2301 C VAL B 54 -19.100 -1.669 12.739 1.00 0.00 C ATOM 2302 O VAL B 54 -18.459 -0.933 13.487 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.327 -0.561 12.075 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -21.852 0.479 11.075 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.343 -1.680 12.302 1.00 0.00 C ATOM 0 H VAL B 54 -20.845 -2.319 10.198 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.426 -0.133 11.341 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.197 -0.103 13.055 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -22.834 0.828 11.395 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.163 1.322 11.032 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -21.933 0.025 10.087 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.293 -1.250 12.621 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.489 -2.233 11.374 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -21.974 -2.356 13.073 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.035 -3.000 12.853 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.063 -3.621 13.751 1.00 0.00 C ATOM 2317 C LYS B 55 -16.650 -3.173 13.351 1.00 0.00 C ATOM 2318 O LYS B 55 -15.874 -2.687 14.172 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.228 -5.150 13.728 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.115 -5.919 14.457 1.00 0.00 C ATOM 2321 CD LYS B 55 -16.883 -5.438 15.897 1.00 0.00 C ATOM 2322 CE LYS B 55 -15.831 -6.315 16.583 1.00 0.00 C ATOM 2323 NZ LYS B 55 -15.359 -5.701 17.836 1.00 0.00 N ATOM 0 H LYS B 55 -19.631 -3.654 12.346 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.234 -3.300 14.779 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.186 -5.407 14.180 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.265 -5.484 12.691 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -17.366 -6.980 14.472 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.187 -5.820 13.895 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -16.554 -4.399 15.893 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -17.818 -5.474 16.456 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -16.254 -7.297 16.793 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -14.987 -6.469 15.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -14.957 -6.436 18.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -14.630 -4.991 17.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -16.157 -5.242 18.320 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.324 -3.300 12.068 1.00 0.00 N ATOM 2338 CA LEU B 56 -15.058 -2.843 11.526 1.00 0.00 C ATOM 2339 C LEU B 56 -14.839 -1.344 11.805 1.00 0.00 C ATOM 2340 O LEU B 56 -13.743 -0.943 12.193 1.00 0.00 O ATOM 2341 CB LEU B 56 -14.998 -3.258 10.050 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.849 -2.617 9.269 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.306 -3.593 8.219 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.348 -1.366 8.549 1.00 0.00 C ATOM 0 H LEU B 56 -16.938 -3.726 11.374 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.212 -3.317 12.024 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.903 -4.342 9.992 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.941 -2.995 9.571 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.059 -2.359 9.974 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.489 -3.122 7.672 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.940 -4.493 8.713 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -14.102 -3.859 7.524 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.526 -0.913 7.994 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.146 -1.638 7.858 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.729 -0.653 9.280 1.00 0.00 H new ATOM 2356 N MET B 57 -15.874 -0.510 11.652 1.00 0.00 N ATOM 2357 CA MET B 57 -15.800 0.909 11.978 1.00 0.00 C ATOM 2358 C MET B 57 -15.437 1.089 13.440 1.00 0.00 C ATOM 2359 O MET B 57 -14.540 1.862 13.737 1.00 0.00 O ATOM 2360 CB MET B 57 -17.116 1.635 11.697 1.00 0.00 C ATOM 2361 CG MET B 57 -17.366 1.788 10.199 1.00 0.00 C ATOM 2362 SD MET B 57 -19.054 2.189 9.715 1.00 0.00 S ATOM 2363 CE MET B 57 -19.384 3.626 10.758 1.00 0.00 C ATOM 0 H MET B 57 -16.784 -0.805 11.298 1.00 0.00 H new ATOM 0 HA MET B 57 -15.030 1.344 11.341 1.00 0.00 H new ATOM 0 HB2 MET B 57 -17.940 1.083 12.149 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.096 2.619 12.165 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.706 2.567 9.819 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.079 0.859 9.707 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.336 4.073 10.471 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.429 3.315 11.802 1.00 0.00 H new ATOM 0 HE3 MET B 57 -18.587 4.358 10.632 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.116 0.385 14.347 1.00 0.00 N ATOM 2374 CA ASP B 58 -15.788 0.400 15.766 1.00 0.00 C ATOM 2375 C ASP B 58 -14.306 0.071 15.956 1.00 0.00 C ATOM 2376 O ASP B 58 -13.574 0.824 16.597 1.00 0.00 O ATOM 2377 CB ASP B 58 -16.736 -0.552 16.510 1.00 0.00 C ATOM 2378 CG ASP B 58 -16.554 -0.523 18.021 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -16.473 0.595 18.574 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.513 -1.623 18.614 1.00 0.00 O ATOM 0 H ASP B 58 -16.910 -0.212 14.114 1.00 0.00 H new ATOM 0 HA ASP B 58 -15.936 1.391 16.195 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -17.766 -0.289 16.270 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.575 -1.568 16.151 1.00 0.00 H new ATOM 2385 N ASP B 59 -13.848 -1.019 15.339 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.455 -1.446 15.418 1.00 0.00 C ATOM 2387 C ASP B 59 -11.489 -0.356 14.928 1.00 0.00 C ATOM 2388 O ASP B 59 -10.463 -0.126 15.559 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.241 -2.765 14.663 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.143 -3.903 15.142 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.452 -3.932 16.353 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -13.496 -4.740 14.283 1.00 0.00 O ATOM 0 H ASP B 59 -14.435 -1.630 14.770 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.228 -1.619 16.470 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.417 -2.597 13.600 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.200 -3.069 14.770 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.800 0.322 13.819 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.025 1.467 13.336 1.00 0.00 C ATOM 2399 C LEU B 60 -11.073 2.624 14.349 1.00 0.00 C ATOM 2400 O LEU B 60 -10.042 3.114 14.813 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.564 1.909 11.956 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.932 1.153 10.774 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.866 1.087 9.564 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.657 1.851 10.283 1.00 0.00 C ATOM 0 H LEU B 60 -12.600 0.091 13.229 1.00 0.00 H new ATOM 0 HA LEU B 60 -9.981 1.173 13.226 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.644 1.763 11.934 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.384 2.977 11.831 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.721 0.153 11.154 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.376 0.544 8.756 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.786 0.572 9.842 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.102 2.098 9.231 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.235 1.292 9.448 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.898 2.863 9.958 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.931 1.895 11.094 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.281 3.083 14.679 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.524 4.264 15.493 1.00 0.00 C ATOM 2418 C ASP B 61 -12.101 4.084 16.947 1.00 0.00 C ATOM 2419 O ASP B 61 -12.045 5.082 17.661 1.00 0.00 O ATOM 2420 CB ASP B 61 -13.947 4.818 15.320 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.056 4.012 15.995 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -14.875 3.634 17.173 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.093 3.819 15.324 1.00 0.00 O ATOM 0 H ASP B 61 -13.141 2.626 14.375 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.865 5.043 15.108 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.972 5.835 15.712 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.166 4.881 14.254 1.00 0.00 H new ATOM 2428 N ARG B 62 -11.757 2.859 17.378 1.00 0.00 N ATOM 2429 CA ARG B 62 -11.065 2.595 18.644 1.00 0.00 C ATOM 2430 C ARG B 62 -10.067 3.713 18.942 1.00 0.00 C ATOM 2431 O ARG B 62 -9.979 4.181 20.074 1.00 0.00 O ATOM 2432 CB ARG B 62 -10.272 1.284 18.539 1.00 0.00 C ATOM 2433 CG ARG B 62 -11.087 0.030 18.841 1.00 0.00 C ATOM 2434 CD ARG B 62 -11.308 -0.143 20.350 1.00 0.00 C ATOM 2435 NE ARG B 62 -12.342 -1.150 20.613 1.00 0.00 N ATOM 2436 CZ ARG B 62 -13.643 -0.966 20.346 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -14.079 0.227 19.925 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -14.497 -1.984 20.479 1.00 0.00 N ATOM 0 H ARG B 62 -11.957 2.012 16.845 1.00 0.00 H new ATOM 0 HA ARG B 62 -11.813 2.533 19.434 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -9.860 1.202 17.533 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -9.427 1.328 19.226 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -12.051 0.090 18.335 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -10.572 -0.845 18.444 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -10.374 -0.441 20.827 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -11.601 0.810 20.791 1.00 0.00 H new ATOM 0 HE ARG B 62 -12.055 -2.039 21.022 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -13.421 0.998 19.807 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -15.069 0.366 19.722 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.159 -2.897 20.783 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -15.488 -1.848 20.277 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.687 9.148 15.524 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.762 9.243 14.404 1.00 0.00 C ATOM 2519 C GLU B 67 -11.562 8.304 14.506 1.00 0.00 C ATOM 2520 O GLU B 67 -11.158 7.870 15.587 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.327 10.705 14.221 1.00 0.00 C ATOM 2522 CG GLU B 67 -11.625 11.277 15.455 1.00 0.00 C ATOM 2523 CD GLU B 67 -11.244 12.736 15.235 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -10.344 12.965 14.399 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -11.857 13.593 15.908 1.00 0.00 O ATOM 0 HA GLU B 67 -13.298 8.907 13.517 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.658 10.775 13.364 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.202 11.313 13.993 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.280 11.195 16.322 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -10.731 10.692 15.674 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.990 8.037 13.333 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.757 7.320 13.083 1.00 0.00 C ATOM 2534 C VAL B 68 -8.685 8.371 12.787 1.00 0.00 C ATOM 2535 O VAL B 68 -8.991 9.388 12.165 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.929 6.399 11.861 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.845 5.314 11.864 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.312 5.737 11.799 1.00 0.00 C ATOM 0 H VAL B 68 -11.421 8.347 12.462 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.481 6.706 13.940 1.00 0.00 H new ATOM 0 HB VAL B 68 -9.832 7.031 10.978 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -8.975 4.668 10.996 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.861 5.782 11.824 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.927 4.720 12.774 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.371 5.101 10.916 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.467 5.133 12.693 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.082 6.507 11.744 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.438 8.118 13.194 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.286 8.933 12.832 1.00 0.00 C ATOM 2550 C ASN B 69 -5.386 8.126 11.903 1.00 0.00 C ATOM 2551 O ASN B 69 -5.301 6.904 12.029 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.529 9.378 14.087 1.00 0.00 C ATOM 2553 CG ASN B 69 -4.214 10.072 13.741 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -4.203 11.233 13.352 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.091 9.369 13.864 1.00 0.00 N ATOM 0 H ASN B 69 -7.202 7.327 13.794 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.617 9.833 12.315 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -6.155 10.055 14.668 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.328 8.511 14.716 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.194 9.796 13.632 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -3.127 8.403 14.190 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.736 8.813 10.964 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.965 8.237 9.874 1.00 0.00 C ATOM 2564 C PHE B 70 -3.130 7.006 10.268 1.00 0.00 C ATOM 2565 O PHE B 70 -3.294 5.930 9.695 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.123 9.353 9.251 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.195 8.854 8.176 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.740 8.303 7.003 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.823 8.718 8.453 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.916 7.587 6.121 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.001 8.009 7.568 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.552 7.422 6.419 1.00 0.00 C ATOM 0 H PHE B 70 -4.736 9.833 10.946 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.659 7.836 9.135 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.785 10.110 8.830 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.539 9.840 10.032 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.789 8.430 6.781 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.404 9.159 9.346 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.328 7.164 5.217 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.056 7.914 7.770 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.075 6.840 5.760 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.244 7.137 11.257 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.377 6.033 11.670 1.00 0.00 C ATOM 2584 C GLN B 71 -2.198 4.806 12.093 1.00 0.00 C ATOM 2585 O GLN B 71 -1.835 3.659 11.812 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.464 6.520 12.802 1.00 0.00 C ATOM 2587 CG GLN B 71 0.546 5.452 13.240 1.00 0.00 C ATOM 2588 CD GLN B 71 1.389 5.950 14.408 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.565 6.261 14.246 1.00 0.00 O ATOM 2590 NE2 GLN B 71 0.794 6.036 15.594 1.00 0.00 N ATOM 0 H GLN B 71 -2.108 7.998 11.787 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.763 5.718 10.826 1.00 0.00 H new ATOM 0 HB2 GLN B 71 0.072 7.411 12.475 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.074 6.811 13.657 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.018 4.543 13.528 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.194 5.193 12.403 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.185 5.769 15.694 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.317 6.369 16.404 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.311 5.045 12.788 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.175 3.996 13.300 1.00 0.00 C ATOM 2601 C GLU B 72 -4.977 3.395 12.145 1.00 0.00 C ATOM 2602 O GLU B 72 -5.194 2.188 12.119 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.051 4.532 14.442 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.231 4.762 15.726 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.097 5.773 15.559 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.385 6.877 15.046 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -1.948 5.416 15.901 1.00 0.00 O ATOM 0 H GLU B 72 -3.636 5.986 13.010 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.581 3.191 13.733 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.517 5.468 14.135 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.856 3.826 14.645 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.899 5.106 16.516 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.812 3.811 16.054 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.372 4.213 11.165 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.935 3.726 9.911 1.00 0.00 C ATOM 2616 C TYR B 73 -4.958 2.751 9.245 1.00 0.00 C ATOM 2617 O TYR B 73 -5.342 1.625 8.933 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.316 4.909 9.006 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.277 4.644 7.512 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.427 4.179 6.849 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.138 5.007 6.763 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.453 4.123 5.444 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.146 4.892 5.364 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.306 4.457 4.703 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.350 4.431 3.342 1.00 0.00 O ATOM 0 H TYR B 73 -5.309 5.229 11.222 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.854 3.173 10.104 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.322 5.234 9.271 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.645 5.739 9.225 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.289 3.865 7.418 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.257 5.375 7.268 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.356 3.823 4.933 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.261 5.138 4.796 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.664 5.030 2.981 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.696 3.156 9.051 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.685 2.277 8.462 1.00 0.00 C ATOM 2637 C ILE B 74 -2.586 0.983 9.284 1.00 0.00 C ATOM 2638 O ILE B 74 -2.700 -0.115 8.742 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.320 2.988 8.345 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.335 4.225 7.428 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.244 2.000 7.870 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.470 3.918 5.933 1.00 0.00 C ATOM 0 H ILE B 74 -3.354 4.086 9.294 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.989 2.019 7.447 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.086 3.351 9.346 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.160 4.871 7.727 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.415 4.788 7.587 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.714 2.515 7.792 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.159 1.183 8.586 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.522 1.601 6.895 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.471 4.851 5.369 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.632 3.300 5.611 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.404 3.385 5.754 1.00 0.00 H new ATOM 2654 N THR B 75 -2.400 1.108 10.600 1.00 0.00 N ATOM 2655 CA THR B 75 -2.314 -0.040 11.498 1.00 0.00 C ATOM 2656 C THR B 75 -3.520 -0.971 11.328 1.00 0.00 C ATOM 2657 O THR B 75 -3.366 -2.188 11.221 1.00 0.00 O ATOM 2658 CB THR B 75 -2.174 0.448 12.944 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.024 1.267 13.036 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.046 -0.717 13.932 1.00 0.00 C ATOM 0 H THR B 75 -2.305 2.008 11.070 1.00 0.00 H new ATOM 0 HA THR B 75 -1.429 -0.623 11.243 1.00 0.00 H new ATOM 0 HB THR B 75 -3.073 1.006 13.205 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.233 2.164 12.700 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.949 -0.326 14.945 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.934 -1.346 13.869 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.164 -1.308 13.685 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.727 -0.406 11.287 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.930 -1.190 11.089 1.00 0.00 C ATOM 2670 C PHE B 76 -5.904 -1.873 9.726 1.00 0.00 C ATOM 2671 O PHE B 76 -6.236 -3.046 9.639 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.193 -0.347 11.237 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.435 -1.199 11.057 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.970 -1.395 9.768 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.900 -1.988 12.127 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.004 -2.319 9.566 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.877 -2.973 11.903 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.431 -3.138 10.622 1.00 0.00 C ATOM 0 H PHE B 76 -4.890 0.596 11.389 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.953 -1.952 11.868 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.209 0.123 12.220 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.188 0.456 10.500 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.582 -0.831 8.933 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.505 -1.836 13.121 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.473 -2.401 8.596 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.203 -3.604 12.717 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.184 -3.893 10.451 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.507 -1.179 8.657 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.322 -1.847 7.373 1.00 0.00 C ATOM 2690 C LEU B 77 -4.316 -2.994 7.509 1.00 0.00 C ATOM 2691 O LEU B 77 -4.472 -4.022 6.858 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.974 -0.847 6.262 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.194 -0.003 5.847 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.766 1.118 4.900 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.255 -0.838 5.117 1.00 0.00 C ATOM 0 H LEU B 77 -5.312 -0.178 8.655 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.267 -2.297 7.067 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.176 -0.188 6.604 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.593 -1.386 5.394 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.619 0.397 6.768 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.638 1.706 4.615 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.042 1.761 5.401 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.312 0.687 4.008 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.096 -0.200 4.844 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.821 -1.271 4.216 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.603 -1.637 5.772 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.327 -2.865 8.397 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.474 -3.978 8.788 1.00 0.00 C ATOM 2709 C GLY B 78 -3.296 -5.123 9.387 1.00 0.00 C ATOM 2710 O GLY B 78 -3.186 -6.267 8.953 1.00 0.00 O ATOM 0 H GLY B 78 -3.099 -1.986 8.861 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.922 -4.339 7.920 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.737 -3.637 9.515 1.00 0.00 H new ATOM 2714 N ALA B 79 -4.147 -4.837 10.374 1.00 0.00 N ATOM 2715 CA ALA B 79 -5.047 -5.847 10.926 1.00 0.00 C ATOM 2716 C ALA B 79 -5.892 -6.500 9.821 1.00 0.00 C ATOM 2717 O ALA B 79 -5.987 -7.721 9.739 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.924 -5.247 12.031 1.00 0.00 C ATOM 0 H ALA B 79 -4.231 -3.917 10.805 1.00 0.00 H new ATOM 0 HA ALA B 79 -4.442 -6.634 11.376 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.586 -6.016 12.428 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -5.290 -4.865 12.832 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.520 -4.432 11.620 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.480 -5.699 8.933 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.261 -6.179 7.802 1.00 0.00 C ATOM 2726 C LEU B 80 -6.404 -7.086 6.913 1.00 0.00 C ATOM 2727 O LEU B 80 -6.837 -8.155 6.493 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.827 -4.981 7.025 1.00 0.00 C ATOM 2729 CG LEU B 80 -9.091 -5.354 6.237 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.318 -5.389 7.158 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.341 -4.308 5.144 1.00 0.00 C ATOM 0 H LEU B 80 -6.424 -4.682 8.983 1.00 0.00 H new ATOM 0 HA LEU B 80 -8.100 -6.776 8.159 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -8.058 -4.174 7.720 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.070 -4.603 6.338 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.939 -6.340 5.799 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -11.201 -5.655 6.577 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -10.163 -6.129 7.943 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.463 -4.407 7.609 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.238 -4.573 4.585 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.475 -3.328 5.602 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.487 -4.278 4.467 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.159 -6.686 6.657 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.195 -7.515 5.959 1.00 0.00 C ATOM 2745 C ALA B 81 -3.967 -8.841 6.696 1.00 0.00 C ATOM 2746 O ALA B 81 -3.801 -9.871 6.049 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.898 -6.740 5.738 1.00 0.00 C ATOM 0 H ALA B 81 -4.796 -5.773 6.932 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.595 -7.773 4.978 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.181 -7.372 5.213 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.103 -5.851 5.142 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.483 -6.443 6.701 1.00 0.00 H new ATOM 2753 N MET B 82 -3.994 -8.850 8.033 1.00 0.00 N ATOM 2754 CA MET B 82 -3.979 -10.107 8.773 1.00 0.00 C ATOM 2755 C MET B 82 -5.258 -10.918 8.534 1.00 0.00 C ATOM 2756 O MET B 82 -5.179 -12.132 8.356 1.00 0.00 O ATOM 2757 CB MET B 82 -3.685 -9.915 10.269 1.00 0.00 C ATOM 2758 CG MET B 82 -2.293 -9.315 10.493 1.00 0.00 C ATOM 2759 SD MET B 82 -1.818 -9.002 12.211 1.00 0.00 S ATOM 2760 CE MET B 82 -1.820 -10.679 12.886 1.00 0.00 C ATOM 0 H MET B 82 -4.026 -8.012 8.614 1.00 0.00 H new ATOM 0 HA MET B 82 -3.147 -10.690 8.378 1.00 0.00 H new ATOM 0 HB2 MET B 82 -4.439 -9.262 10.709 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.756 -10.874 10.781 1.00 0.00 H new ATOM 0 HG2 MET B 82 -1.557 -9.987 10.052 1.00 0.00 H new ATOM 0 HG3 MET B 82 -2.234 -8.374 9.946 1.00 0.00 H new ATOM 0 HE1 MET B 82 -1.394 -10.668 13.889 1.00 0.00 H new ATOM 0 HE2 MET B 82 -2.843 -11.052 12.931 1.00 0.00 H new ATOM 0 HE3 MET B 82 -1.224 -11.330 12.246 1.00 0.00 H new ATOM 2770 N ILE B 83 -6.431 -10.269 8.502 1.00 0.00 N ATOM 2771 CA ILE B 83 -7.668 -10.945 8.099 1.00 0.00 C ATOM 2772 C ILE B 83 -7.484 -11.580 6.713 1.00 0.00 C ATOM 2773 O ILE B 83 -7.917 -12.717 6.496 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.903 -10.018 8.151 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -9.097 -9.317 9.509 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -10.177 -10.793 7.780 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -9.226 -10.266 10.702 1.00 0.00 C ATOM 0 H ILE B 83 -6.547 -9.286 8.748 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.868 -11.735 8.823 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.715 -9.233 7.418 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.253 -8.649 9.682 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -9.991 -8.695 9.458 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -11.036 -10.123 7.822 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -10.079 -11.193 6.771 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -10.322 -11.613 8.483 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -9.359 -9.686 11.615 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -10.088 -10.918 10.557 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -8.323 -10.871 10.785 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.787 -10.889 5.798 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.348 -11.438 4.515 1.00 0.00 C ATOM 2791 C TYR B 84 -5.195 -12.438 4.740 1.00 0.00 C ATOM 2792 O TYR B 84 -4.112 -12.337 4.164 1.00 0.00 O ATOM 2793 CB TYR B 84 -5.930 -10.330 3.528 1.00 0.00 C ATOM 2794 CG TYR B 84 -6.981 -9.395 2.941 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.123 -8.981 3.658 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -6.724 -8.827 1.677 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -8.977 -7.998 3.124 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -7.590 -7.863 1.135 1.00 0.00 C ATOM 2799 CZ TYR B 84 -8.704 -7.428 1.869 1.00 0.00 C ATOM 2800 OH TYR B 84 -9.509 -6.440 1.385 1.00 0.00 O ATOM 0 H TYR B 84 -6.510 -9.917 5.936 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.192 -11.962 4.066 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.190 -9.709 4.032 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -5.424 -10.814 2.693 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.343 -9.420 4.620 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -5.852 -9.136 1.119 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -9.846 -7.680 3.681 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -7.398 -7.456 0.153 1.00 0.00 H new ATOM 0 HH TYR B 84 -9.076 -6.012 0.617 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.461 -13.466 5.543 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.606 -14.605 5.829 1.00 0.00 C ATOM 2812 C ASN B 85 -4.028 -15.208 4.546 1.00 0.00 C ATOM 2813 O ASN B 85 -2.876 -15.632 4.520 1.00 0.00 O ATOM 2814 CB ASN B 85 -5.413 -15.643 6.624 1.00 0.00 C ATOM 2815 CG ASN B 85 -6.564 -16.223 5.804 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -6.424 -17.287 5.212 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -7.694 -15.522 5.718 1.00 0.00 N ATOM 0 H ASN B 85 -6.347 -13.524 6.046 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.756 -14.276 6.426 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.752 -16.449 6.942 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -5.809 -15.180 7.528 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -8.467 -15.868 5.150 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -7.786 -14.639 6.220 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.810 -15.211 3.464 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.368 -15.668 2.158 1.00 0.00 C ATOM 2826 C GLU B 86 -3.148 -14.856 1.714 1.00 0.00 C ATOM 2827 O GLU B 86 -2.154 -15.410 1.249 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.509 -15.553 1.132 1.00 0.00 C ATOM 2829 CG GLU B 86 -6.805 -16.281 1.546 1.00 0.00 C ATOM 2830 CD GLU B 86 -7.682 -15.516 2.540 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -7.354 -14.341 2.817 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -8.655 -16.126 3.034 1.00 0.00 O ATOM 0 H GLU B 86 -5.778 -14.891 3.477 1.00 0.00 H new ATOM 0 HA GLU B 86 -4.084 -16.718 2.224 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -5.733 -14.499 0.971 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.168 -15.956 0.178 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -7.391 -16.488 0.650 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -6.540 -17.244 1.983 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.219 -13.532 1.878 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.125 -12.637 1.555 1.00 0.00 C ATOM 2841 C ALA B 87 -0.968 -12.853 2.530 1.00 0.00 C ATOM 2842 O ALA B 87 0.179 -12.882 2.097 1.00 0.00 O ATOM 2843 CB ALA B 87 -2.609 -11.183 1.540 1.00 0.00 C ATOM 0 H ALA B 87 -4.045 -13.057 2.241 1.00 0.00 H new ATOM 0 HA ALA B 87 -1.756 -12.861 0.554 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -1.775 -10.525 1.296 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -3.393 -11.068 0.792 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.003 -10.921 2.522 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.245 -13.034 3.830 1.00 0.00 N ATOM 2850 CA LEU B 88 -0.184 -13.388 4.777 1.00 0.00 C ATOM 2851 C LEU B 88 0.592 -14.618 4.297 1.00 0.00 C ATOM 2852 O LEU B 88 1.818 -14.629 4.339 1.00 0.00 O ATOM 2853 CB LEU B 88 -0.705 -13.678 6.193 1.00 0.00 C ATOM 2854 CG LEU B 88 -1.324 -12.524 6.993 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -1.557 -13.064 8.414 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.406 -11.299 7.057 1.00 0.00 C ATOM 0 H LEU B 88 -2.174 -12.943 4.241 1.00 0.00 H new ATOM 0 HA LEU B 88 0.465 -12.513 4.821 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -1.453 -14.468 6.117 1.00 0.00 H new ATOM 0 HB3 LEU B 88 0.124 -14.079 6.776 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.245 -12.195 6.512 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.998 -12.282 9.032 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -2.232 -13.919 8.372 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.606 -13.374 8.846 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.890 -10.511 7.634 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.534 -11.573 7.535 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.208 -10.940 6.047 1.00 0.00 H new ATOM 2868 N LYS B 89 -0.118 -15.673 3.883 1.00 0.00 N ATOM 2869 CA LYS B 89 0.518 -16.881 3.373 1.00 0.00 C ATOM 2870 C LYS B 89 1.279 -16.554 2.083 1.00 0.00 C ATOM 2871 O LYS B 89 2.410 -16.999 1.904 1.00 0.00 O ATOM 2872 CB LYS B 89 -0.521 -17.993 3.145 1.00 0.00 C ATOM 2873 CG LYS B 89 -0.658 -19.008 4.295 1.00 0.00 C ATOM 2874 CD LYS B 89 -1.484 -18.548 5.510 1.00 0.00 C ATOM 2875 CE LYS B 89 -0.721 -17.709 6.545 1.00 0.00 C ATOM 2876 NZ LYS B 89 0.386 -18.455 7.169 1.00 0.00 N ATOM 0 H LYS B 89 -1.137 -15.709 3.893 1.00 0.00 H new ATOM 0 HA LYS B 89 1.229 -17.250 4.112 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -1.493 -17.530 2.972 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -0.259 -18.532 2.235 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -1.109 -19.917 3.898 1.00 0.00 H new ATOM 0 HG3 LYS B 89 0.342 -19.272 4.640 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -2.334 -17.967 5.151 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -1.888 -19.429 6.008 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -0.326 -16.814 6.063 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -1.412 -17.376 7.319 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 0.826 -17.870 7.907 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 0.019 -19.330 7.594 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 1.095 -18.693 6.446 1.00 0.00 H new ATOM 2890 N GLY B 90 0.647 -15.800 1.178 1.00 0.00 N ATOM 2891 CA GLY B 90 1.266 -15.335 -0.055 1.00 0.00 C ATOM 2892 C GLY B 90 2.115 -14.082 0.177 1.00 0.00 C ATOM 2893 O GLY B 90 3.039 -14.150 1.016 1.00 0.00 O ATOM 2894 OXT GLY B 90 1.845 -13.078 -0.521 1.00 0.00 O ATOM 0 H GLY B 90 -0.320 -15.495 1.288 1.00 0.00 H new ATOM 0 HA2 GLY B 90 1.890 -16.126 -0.470 1.00 0.00 H new ATOM 0 HA3 GLY B 90 0.493 -15.120 -0.792 1.00 0.00 H new