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 75 THR OG1 : rot 83:sc= 1.14 USER MOD Set 1.2: B 75 THR OG1 : rot 72:sc= 0.792 USER MOD Set 2.1: B 19 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: B 35 LYS NZ :NH3+ -158:sc= 0.617 (180deg=-0.206) USER MOD Set 3.2: B 39 GLN : amide:sc= 1.14 K(o=1.8,f=-0.42) USER MOD Set 4.1: B 28 THR OG1 : rot 50:sc=-0.00919 USER MOD Set 4.2: B 69 ASN : amide:sc= 0.553 K(o=0.54,f=1.2) USER MOD Set 5.1: A 85 ASN : amide:sc= 1.29 K(o=3.2,f=1.7) USER MOD Set 5.2: B 17 HIS : no HE2:sc= 0.2 K(o=3.2,f=-8.8!) USER MOD Set 5.3: B 27 HIS : no HE2:sc= 1.68 K(o=3.2,f=-9.1!) USER MOD Set 6.1: A 31 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00681) USER MOD Set 6.2: A 66 GLN : amide:sc= 1.22 K(o=1.2,f=-0.095) USER MOD Set 7.1: A 17 HIS : no HE2:sc= 1.87 K(o=2.9,f=-9.8!) USER MOD Set 7.2: A 27 HIS : no HE2:sc= 1.06 K(o=2.9,f=-8.1!) USER MOD Single : A 3 SER OG : rot 11:sc= 0.79 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 17:sc= 1.11 USER MOD Single : A 20 SER OG : rot 170:sc= 0 USER MOD Single : A 28 THR OG1 : rot 40:sc= 0.678 USER MOD Single : A 30 SER OG : rot 44:sc= 0.147 USER MOD Single : A 32 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00851) USER MOD Single : A 35 LYS NZ :NH3+ 147:sc= 0.34 (180deg=0.126) USER MOD Single : A 39 GLN : amide:sc= 0.51 K(o=0.51,f=-0.15) USER MOD Single : A 40 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0326) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 167:sc= 0 (180deg=-0.163) USER MOD Single : A 63 ASN : amide:sc= 0.667 K(o=0.67,f=-0.24) USER MOD Single : A 64 LYS NZ :NH3+ -168:sc=-0.00688 (180deg=-0.156) USER MOD Single : A 69 ASN : amide:sc= 1.13 K(o=1.1,f=-2.5!) USER MOD Single : A 71 GLN : amide:sc= 0.737 K(o=0.74,f=-0.49) USER MOD Single : A 73 TYR OH : rot 153:sc= 0.00506 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 3 SER OG : rot 18:sc= 0.747 USER MOD Single : B 7 GLN : amide:sc=-0.00209 X(o=-0.0021,f=-0.48) USER MOD Single : B 18 LYS NZ :NH3+ 167:sc= -0.0321 (180deg=-0.793) USER MOD Single : B 20 SER OG : rot -142:sc= -0.747 USER MOD Single : B 30 SER OG : rot 180:sc= 0.0237 USER MOD Single : B 31 LYS NZ :NH3+ 175:sc= -0.117 (180deg=-0.205) USER MOD Single : B 32 LYS NZ :NH3+ 143:sc= 0.829 (180deg=0.157) USER MOD Single : B 55 LYS NZ :NH3+ 179:sc= 0.739 (180deg=0.719) USER MOD Single : B 57 MET CE :methyl 168:sc= 0 (180deg=-0.0743) USER MOD Single : B 71 GLN : amide:sc= -0.0457 X(o=-0.046,f=0) USER MOD Single : B 73 TYR OH : rot 152:sc= 1.14 USER MOD Single : B 82 MET CE :methyl -172:sc= 0 (180deg=-0.101) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= 0.503 K(o=0.5,f=-0.25) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.900 -3.479 -5.857 1.00 0.00 N ATOM 31 CA SER A 3 -8.651 -3.839 -6.498 1.00 0.00 C ATOM 32 C SER A 3 -7.489 -2.898 -6.157 1.00 0.00 C ATOM 33 O SER A 3 -6.450 -3.401 -5.738 1.00 0.00 O ATOM 34 CB SER A 3 -8.877 -4.011 -8.008 1.00 0.00 C ATOM 35 OG SER A 3 -10.259 -4.232 -8.257 1.00 0.00 O ATOM 0 HA SER A 3 -8.330 -4.798 -6.091 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.538 -3.123 -8.541 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.290 -4.850 -8.381 1.00 0.00 H new ATOM 0 HG SER A 3 -10.772 -4.046 -7.443 1.00 0.00 H new ATOM 41 N PRO A 4 -7.630 -1.565 -6.309 1.00 0.00 N ATOM 42 CA PRO A 4 -6.573 -0.606 -6.015 1.00 0.00 C ATOM 43 C PRO A 4 -5.981 -0.790 -4.613 1.00 0.00 C ATOM 44 O PRO A 4 -4.770 -0.938 -4.454 1.00 0.00 O ATOM 45 CB PRO A 4 -7.202 0.781 -6.203 1.00 0.00 C ATOM 46 CG PRO A 4 -8.325 0.519 -7.202 1.00 0.00 C ATOM 47 CD PRO A 4 -8.815 -0.858 -6.769 1.00 0.00 C ATOM 0 HA PRO A 4 -5.724 -0.748 -6.684 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.583 1.181 -5.264 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -6.481 1.502 -6.587 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -9.112 1.271 -7.139 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.965 0.520 -8.231 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.558 -0.779 -5.975 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -9.289 -1.384 -7.597 1.00 0.00 H new ATOM 55 N LEU A 5 -6.824 -0.790 -3.579 1.00 0.00 N ATOM 56 CA LEU A 5 -6.322 -0.983 -2.231 1.00 0.00 C ATOM 57 C LEU A 5 -5.756 -2.392 -2.082 1.00 0.00 C ATOM 58 O LEU A 5 -4.668 -2.556 -1.532 1.00 0.00 O ATOM 59 CB LEU A 5 -7.406 -0.697 -1.188 1.00 0.00 C ATOM 60 CG LEU A 5 -6.876 -0.870 0.244 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.688 0.045 0.554 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.974 -0.535 1.246 1.00 0.00 C ATOM 0 H LEU A 5 -7.833 -0.661 -3.652 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.516 -0.271 -2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.777 0.319 -1.318 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.250 -1.368 -1.347 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.553 -1.908 0.324 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.358 -0.122 1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.870 -0.176 -0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.990 1.086 0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.592 -0.660 2.259 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.294 0.497 1.103 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.822 -1.203 1.093 1.00 0.00 H new ATOM 74 N ASP A 6 -6.481 -3.403 -2.571 1.00 0.00 N ATOM 75 CA ASP A 6 -6.065 -4.796 -2.440 1.00 0.00 C ATOM 76 C ASP A 6 -4.646 -4.988 -2.973 1.00 0.00 C ATOM 77 O ASP A 6 -3.803 -5.556 -2.282 1.00 0.00 O ATOM 78 CB ASP A 6 -7.028 -5.741 -3.175 1.00 0.00 C ATOM 79 CG ASP A 6 -8.456 -5.725 -2.639 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.639 -5.343 -1.462 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.347 -6.113 -3.426 1.00 0.00 O ATOM 0 H ASP A 6 -7.365 -3.277 -3.064 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.085 -5.043 -1.379 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.046 -5.472 -4.231 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.640 -6.758 -3.111 1.00 0.00 H new ATOM 86 N GLN A 7 -4.364 -4.510 -4.189 1.00 0.00 N ATOM 87 CA GLN A 7 -3.026 -4.625 -4.754 1.00 0.00 C ATOM 88 C GLN A 7 -2.009 -3.880 -3.891 1.00 0.00 C ATOM 89 O GLN A 7 -0.911 -4.382 -3.671 1.00 0.00 O ATOM 90 CB GLN A 7 -2.983 -4.208 -6.234 1.00 0.00 C ATOM 91 CG GLN A 7 -3.294 -2.730 -6.498 1.00 0.00 C ATOM 92 CD GLN A 7 -3.311 -2.416 -7.989 1.00 0.00 C ATOM 93 OE1 GLN A 7 -4.360 -2.146 -8.564 1.00 0.00 O ATOM 94 NE2 GLN A 7 -2.148 -2.454 -8.632 1.00 0.00 N ATOM 0 H GLN A 7 -5.042 -4.044 -4.793 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.744 -5.678 -4.742 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.993 -4.432 -6.631 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.695 -4.819 -6.789 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.261 -2.478 -6.062 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.549 -2.107 -6.003 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -1.292 -2.682 -8.126 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -2.111 -2.255 -9.632 1.00 0.00 H new ATOM 103 N ALA A 8 -2.358 -2.693 -3.384 1.00 0.00 N ATOM 104 CA ALA A 8 -1.446 -1.933 -2.543 1.00 0.00 C ATOM 105 C ALA A 8 -1.098 -2.688 -1.259 1.00 0.00 C ATOM 106 O ALA A 8 0.080 -2.908 -0.985 1.00 0.00 O ATOM 107 CB ALA A 8 -2.017 -0.554 -2.251 1.00 0.00 C ATOM 0 H ALA A 8 -3.261 -2.246 -3.544 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.512 -1.801 -3.089 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.322 0.001 -1.621 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.167 -0.016 -3.187 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.972 -0.657 -1.735 1.00 0.00 H new ATOM 113 N ILE A 9 -2.095 -3.108 -0.473 1.00 0.00 N ATOM 114 CA ILE A 9 -1.818 -3.889 0.733 1.00 0.00 C ATOM 115 C ILE A 9 -1.058 -5.167 0.342 1.00 0.00 C ATOM 116 O ILE A 9 -0.044 -5.510 0.951 1.00 0.00 O ATOM 117 CB ILE A 9 -3.085 -4.109 1.596 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.168 -4.983 0.951 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.641 -2.747 2.033 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.377 -5.208 1.870 1.00 0.00 C ATOM 0 H ILE A 9 -3.083 -2.924 -0.647 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.163 -3.328 1.399 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.771 -4.686 2.466 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.503 -4.514 0.026 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.737 -5.948 0.682 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.533 -2.896 2.641 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.888 -2.217 2.617 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.897 -2.159 1.152 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.110 -5.833 1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.051 -5.703 2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.829 -4.248 2.118 1.00 0.00 H new ATOM 132 N GLY A 10 -1.498 -5.810 -0.744 1.00 0.00 N ATOM 133 CA GLY A 10 -0.812 -6.913 -1.395 1.00 0.00 C ATOM 134 C GLY A 10 0.676 -6.633 -1.608 1.00 0.00 C ATOM 135 O GLY A 10 1.499 -7.508 -1.366 1.00 0.00 O ATOM 0 H GLY A 10 -2.374 -5.562 -1.205 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.926 -7.814 -0.792 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.283 -7.112 -2.358 1.00 0.00 H new ATOM 139 N LEU A 11 1.035 -5.428 -2.057 1.00 0.00 N ATOM 140 CA LEU A 11 2.413 -5.034 -2.311 1.00 0.00 C ATOM 141 C LEU A 11 3.235 -5.150 -1.026 1.00 0.00 C ATOM 142 O LEU A 11 4.202 -5.907 -0.976 1.00 0.00 O ATOM 143 CB LEU A 11 2.437 -3.608 -2.896 1.00 0.00 C ATOM 144 CG LEU A 11 3.693 -3.205 -3.683 1.00 0.00 C ATOM 145 CD1 LEU A 11 4.989 -3.399 -2.902 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.751 -3.888 -5.051 1.00 0.00 C ATOM 0 H LEU A 11 0.360 -4.689 -2.256 1.00 0.00 H new ATOM 0 HA LEU A 11 2.867 -5.701 -3.043 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.574 -3.495 -3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.309 -2.902 -2.076 1.00 0.00 H new ATOM 0 HG LEU A 11 3.603 -2.132 -3.850 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.835 -3.094 -3.519 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.963 -2.792 -1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.097 -4.449 -2.631 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.654 -3.576 -5.575 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.764 -4.970 -4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.876 -3.605 -5.636 1.00 0.00 H new ATOM 158 N LEU A 12 2.842 -4.414 0.019 1.00 0.00 N ATOM 159 CA LEU A 12 3.502 -4.445 1.323 1.00 0.00 C ATOM 160 C LEU A 12 3.640 -5.892 1.801 1.00 0.00 C ATOM 161 O LEU A 12 4.715 -6.334 2.210 1.00 0.00 O ATOM 162 CB LEU A 12 2.681 -3.639 2.348 1.00 0.00 C ATOM 163 CG LEU A 12 2.874 -2.115 2.278 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.333 -1.489 0.988 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.169 -1.444 3.461 1.00 0.00 C ATOM 0 H LEU A 12 2.048 -3.774 -0.020 1.00 0.00 H new ATOM 0 HA LEU A 12 4.493 -4.000 1.228 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.624 -3.864 2.203 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.944 -3.978 3.350 1.00 0.00 H new ATOM 0 HG LEU A 12 3.951 -1.949 2.306 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.503 -0.412 1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.847 -1.922 0.130 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.264 -1.686 0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.310 -0.365 3.404 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.104 -1.673 3.427 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.591 -1.817 4.395 1.00 0.00 H new ATOM 177 N ILE A 13 2.531 -6.632 1.744 1.00 0.00 N ATOM 178 CA ILE A 13 2.476 -8.004 2.223 1.00 0.00 C ATOM 179 C ILE A 13 3.474 -8.869 1.454 1.00 0.00 C ATOM 180 O ILE A 13 4.256 -9.604 2.059 1.00 0.00 O ATOM 181 CB ILE A 13 1.032 -8.526 2.101 1.00 0.00 C ATOM 182 CG1 ILE A 13 0.118 -7.793 3.099 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.970 -10.034 2.353 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.364 -7.922 2.738 1.00 0.00 C ATOM 0 H ILE A 13 1.648 -6.292 1.363 1.00 0.00 H new ATOM 0 HA ILE A 13 2.760 -8.048 3.274 1.00 0.00 H new ATOM 0 HB ILE A 13 0.687 -8.332 1.085 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.282 -8.194 4.099 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.391 -6.738 3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.061 -10.376 2.261 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.591 -10.551 1.621 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.336 -10.250 3.357 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.965 -7.387 3.473 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.536 -7.496 1.750 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.647 -8.975 2.734 1.00 0.00 H new ATOM 196 N GLY A 14 3.427 -8.773 0.128 1.00 0.00 N ATOM 197 CA GLY A 14 4.283 -9.494 -0.788 1.00 0.00 C ATOM 198 C GLY A 14 5.741 -9.196 -0.480 1.00 0.00 C ATOM 199 O GLY A 14 6.509 -10.124 -0.247 1.00 0.00 O ATOM 0 H GLY A 14 2.762 -8.164 -0.349 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.097 -10.565 -0.706 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.054 -9.208 -1.815 1.00 0.00 H new ATOM 203 N ILE A 15 6.119 -7.911 -0.455 1.00 0.00 N ATOM 204 CA ILE A 15 7.473 -7.499 -0.117 1.00 0.00 C ATOM 205 C ILE A 15 7.879 -8.193 1.183 1.00 0.00 C ATOM 206 O ILE A 15 8.853 -8.945 1.205 1.00 0.00 O ATOM 207 CB ILE A 15 7.570 -5.954 -0.089 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.875 -5.456 -1.515 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.631 -5.453 0.897 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.929 -3.928 -1.652 1.00 0.00 C ATOM 0 H ILE A 15 5.491 -7.136 -0.669 1.00 0.00 H new ATOM 0 HA ILE A 15 8.191 -7.810 -0.876 1.00 0.00 H new ATOM 0 HB ILE A 15 6.617 -5.553 0.257 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.830 -5.872 -1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.115 -5.843 -2.193 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.659 -4.364 0.879 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.383 -5.793 1.902 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.607 -5.846 0.612 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.149 -3.663 -2.686 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.967 -3.503 -1.365 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.709 -3.532 -1.002 1.00 0.00 H new ATOM 222 N PHE A 16 7.101 -7.985 2.249 1.00 0.00 N ATOM 223 CA PHE A 16 7.421 -8.542 3.551 1.00 0.00 C ATOM 224 C PHE A 16 7.685 -10.047 3.454 1.00 0.00 C ATOM 225 O PHE A 16 8.770 -10.520 3.789 1.00 0.00 O ATOM 226 CB PHE A 16 6.287 -8.219 4.532 1.00 0.00 C ATOM 227 CG PHE A 16 6.568 -8.598 5.973 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.408 -9.927 6.402 1.00 0.00 C ATOM 229 CD2 PHE A 16 7.007 -7.624 6.885 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.632 -10.261 7.746 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.175 -7.947 8.242 1.00 0.00 C ATOM 232 CZ PHE A 16 6.956 -9.263 8.678 1.00 0.00 C ATOM 0 H PHE A 16 6.244 -7.432 2.228 1.00 0.00 H new ATOM 0 HA PHE A 16 8.339 -8.089 3.925 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.079 -7.150 4.486 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.384 -8.734 4.205 1.00 0.00 H new ATOM 0 HD1 PHE A 16 6.113 -10.690 5.697 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.216 -6.622 6.541 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.555 -11.290 8.065 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.472 -7.185 8.947 1.00 0.00 H new ATOM 0 HZ PHE A 16 7.037 -9.507 9.727 1.00 0.00 H new ATOM 242 N HIS A 17 6.698 -10.808 2.983 1.00 0.00 N ATOM 243 CA HIS A 17 6.781 -12.260 3.020 1.00 0.00 C ATOM 244 C HIS A 17 7.832 -12.804 2.055 1.00 0.00 C ATOM 245 O HIS A 17 8.441 -13.830 2.350 1.00 0.00 O ATOM 246 CB HIS A 17 5.398 -12.885 2.837 1.00 0.00 C ATOM 247 CG HIS A 17 4.514 -12.568 4.015 1.00 0.00 C ATOM 248 ND1 HIS A 17 3.827 -11.393 4.197 1.00 0.00 N ATOM 249 CD2 HIS A 17 4.479 -13.257 5.199 1.00 0.00 C ATOM 250 CE1 HIS A 17 3.379 -11.379 5.463 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.752 -12.491 6.117 1.00 0.00 N ATOM 0 H HIS A 17 5.838 -10.442 2.574 1.00 0.00 H new ATOM 0 HA HIS A 17 7.129 -12.557 4.009 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.941 -12.510 1.921 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.493 -13.965 2.726 1.00 0.00 H new ATOM 0 HD1 HIS A 17 3.683 -10.664 3.498 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.931 -14.219 5.389 1.00 0.00 H new ATOM 0 HE1 HIS A 17 2.796 -10.580 5.897 1.00 0.00 H new ATOM 259 N LYS A 18 8.095 -12.115 0.938 1.00 0.00 N ATOM 260 CA LYS A 18 9.214 -12.482 0.080 1.00 0.00 C ATOM 261 C LYS A 18 10.514 -12.420 0.881 1.00 0.00 C ATOM 262 O LYS A 18 11.294 -13.371 0.852 1.00 0.00 O ATOM 263 CB LYS A 18 9.289 -11.592 -1.168 1.00 0.00 C ATOM 264 CG LYS A 18 8.243 -12.000 -2.215 1.00 0.00 C ATOM 265 CD LYS A 18 8.407 -11.234 -3.536 1.00 0.00 C ATOM 266 CE LYS A 18 8.207 -9.723 -3.369 1.00 0.00 C ATOM 267 NZ LYS A 18 8.242 -9.029 -4.667 1.00 0.00 N ATOM 0 H LYS A 18 7.554 -11.313 0.615 1.00 0.00 H new ATOM 0 HA LYS A 18 9.060 -13.503 -0.271 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.134 -10.551 -0.884 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.286 -11.658 -1.604 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.323 -13.070 -2.406 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.245 -11.821 -1.816 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.401 -11.423 -3.940 1.00 0.00 H new ATOM 0 HD3 LYS A 18 7.690 -11.614 -4.264 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.252 -9.533 -2.879 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.984 -9.321 -2.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 8.104 -8.009 -4.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 9.163 -9.191 -5.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.484 -9.396 -5.277 1.00 0.00 H new ATOM 281 N TYR A 19 10.744 -11.326 1.616 1.00 0.00 N ATOM 282 CA TYR A 19 11.929 -11.249 2.459 1.00 0.00 C ATOM 283 C TYR A 19 11.908 -12.325 3.541 1.00 0.00 C ATOM 284 O TYR A 19 12.897 -13.045 3.662 1.00 0.00 O ATOM 285 CB TYR A 19 12.163 -9.836 3.001 1.00 0.00 C ATOM 286 CG TYR A 19 12.822 -8.957 1.962 1.00 0.00 C ATOM 287 CD1 TYR A 19 12.027 -8.251 1.046 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.207 -9.069 1.735 1.00 0.00 C ATOM 289 CE1 TYR A 19 12.563 -7.826 -0.176 1.00 0.00 C ATOM 290 CE2 TYR A 19 14.764 -8.562 0.548 1.00 0.00 C ATOM 291 CZ TYR A 19 13.924 -8.028 -0.446 1.00 0.00 C ATOM 292 OH TYR A 19 14.428 -7.693 -1.664 1.00 0.00 O ATOM 0 H TYR A 19 10.139 -10.505 1.642 1.00 0.00 H new ATOM 0 HA TYR A 19 12.798 -11.461 1.836 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.212 -9.397 3.303 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.789 -9.884 3.892 1.00 0.00 H new ATOM 0 HD1 TYR A 19 10.996 -8.034 1.285 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.840 -9.543 2.471 1.00 0.00 H new ATOM 0 HE1 TYR A 19 11.931 -7.345 -0.907 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.834 -8.582 0.400 1.00 0.00 H new ATOM 0 HH TYR A 19 13.801 -7.098 -2.125 1.00 0.00 H new ATOM 302 N SER A 20 10.801 -12.485 4.282 1.00 0.00 N ATOM 303 CA SER A 20 10.684 -13.564 5.262 1.00 0.00 C ATOM 304 C SER A 20 11.141 -14.888 4.650 1.00 0.00 C ATOM 305 O SER A 20 11.943 -15.603 5.246 1.00 0.00 O ATOM 306 CB SER A 20 9.250 -13.717 5.780 1.00 0.00 C ATOM 307 OG SER A 20 8.717 -12.505 6.268 1.00 0.00 O ATOM 0 H SER A 20 9.981 -11.882 4.219 1.00 0.00 H new ATOM 0 HA SER A 20 11.324 -13.302 6.104 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.615 -14.091 4.977 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.232 -14.463 6.574 1.00 0.00 H new ATOM 0 HG SER A 20 7.758 -12.613 6.435 1.00 0.00 H new ATOM 313 N GLY A 21 10.651 -15.175 3.439 1.00 0.00 N ATOM 314 CA GLY A 21 10.967 -16.343 2.634 1.00 0.00 C ATOM 315 C GLY A 21 12.445 -16.737 2.639 1.00 0.00 C ATOM 316 O GLY A 21 12.743 -17.922 2.513 1.00 0.00 O ATOM 0 H GLY A 21 9.985 -14.558 2.974 1.00 0.00 H new ATOM 0 HA2 GLY A 21 10.378 -17.187 2.994 1.00 0.00 H new ATOM 0 HA3 GLY A 21 10.658 -16.154 1.606 1.00 0.00 H new ATOM 398 N HIS A 27 5.497 -14.336 9.533 1.00 0.00 N ATOM 399 CA HIS A 27 4.928 -12.999 9.682 1.00 0.00 C ATOM 400 C HIS A 27 5.838 -12.092 10.527 1.00 0.00 C ATOM 401 O HIS A 27 5.373 -11.128 11.134 1.00 0.00 O ATOM 402 CB HIS A 27 3.520 -13.121 10.277 1.00 0.00 C ATOM 403 CG HIS A 27 2.629 -14.048 9.487 1.00 0.00 C ATOM 404 ND1 HIS A 27 2.590 -14.153 8.115 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.786 -14.999 9.996 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.738 -15.144 7.809 1.00 0.00 C ATOM 407 NE2 HIS A 27 1.219 -15.689 8.921 1.00 0.00 N ATOM 0 HA HIS A 27 4.854 -12.525 8.703 1.00 0.00 H new ATOM 0 HB2 HIS A 27 3.594 -13.482 11.303 1.00 0.00 H new ATOM 0 HB3 HIS A 27 3.062 -12.133 10.320 1.00 0.00 H new ATOM 0 HD1 HIS A 27 3.113 -13.582 7.452 1.00 0.00 H new ATOM 0 HD2 HIS A 27 1.593 -15.183 11.043 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.502 -15.460 6.804 1.00 0.00 H new ATOM 415 N THR A 28 7.140 -12.390 10.550 1.00 0.00 N ATOM 416 CA THR A 28 8.148 -11.716 11.348 1.00 0.00 C ATOM 417 C THR A 28 9.427 -11.621 10.527 1.00 0.00 C ATOM 418 O THR A 28 10.025 -12.662 10.252 1.00 0.00 O ATOM 419 CB THR A 28 8.431 -12.539 12.614 1.00 0.00 C ATOM 420 OG1 THR A 28 8.651 -13.893 12.264 1.00 0.00 O ATOM 421 CG2 THR A 28 7.287 -12.465 13.623 1.00 0.00 C ATOM 0 H THR A 28 7.530 -13.144 9.984 1.00 0.00 H new ATOM 0 HA THR A 28 7.799 -10.722 11.629 1.00 0.00 H new ATOM 0 HB THR A 28 9.319 -12.114 13.083 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.184 -13.936 11.443 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.536 -13.063 14.500 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.133 -11.428 13.923 1.00 0.00 H new ATOM 0 HG23 THR A 28 6.375 -12.851 13.168 1.00 0.00 H new ATOM 429 N LEU A 29 9.854 -10.411 10.161 1.00 0.00 N ATOM 430 CA LEU A 29 11.185 -10.222 9.605 1.00 0.00 C ATOM 431 C LEU A 29 12.141 -10.049 10.786 1.00 0.00 C ATOM 432 O LEU A 29 11.716 -9.608 11.850 1.00 0.00 O ATOM 433 CB LEU A 29 11.237 -8.977 8.708 1.00 0.00 C ATOM 434 CG LEU A 29 10.433 -9.083 7.410 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.342 -7.693 6.773 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.095 -10.029 6.413 1.00 0.00 C ATOM 0 H LEU A 29 9.300 -9.558 10.240 1.00 0.00 H new ATOM 0 HA LEU A 29 11.461 -11.079 8.990 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.870 -8.122 9.276 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.278 -8.771 8.458 1.00 0.00 H new ATOM 0 HG LEU A 29 9.445 -9.474 7.653 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.771 -7.754 5.846 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.845 -7.009 7.461 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.345 -7.325 6.558 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.495 -10.078 5.504 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.092 -9.662 6.170 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.172 -11.024 6.851 1.00 0.00 H new ATOM 448 N SER A 30 13.422 -10.381 10.625 1.00 0.00 N ATOM 449 CA SER A 30 14.444 -10.038 11.613 1.00 0.00 C ATOM 450 C SER A 30 15.122 -8.716 11.218 1.00 0.00 C ATOM 451 O SER A 30 14.786 -8.106 10.203 1.00 0.00 O ATOM 452 CB SER A 30 15.447 -11.193 11.749 1.00 0.00 C ATOM 453 OG SER A 30 16.378 -10.917 12.784 1.00 0.00 O ATOM 0 H SER A 30 13.777 -10.890 9.815 1.00 0.00 H new ATOM 0 HA SER A 30 13.986 -9.891 12.591 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.917 -12.121 11.965 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.974 -11.339 10.806 1.00 0.00 H new ATOM 0 HG SER A 30 15.904 -10.557 13.563 1.00 0.00 H new ATOM 459 N LYS A 31 16.093 -8.279 12.022 1.00 0.00 N ATOM 460 CA LYS A 31 16.708 -6.959 11.938 1.00 0.00 C ATOM 461 C LYS A 31 17.455 -6.778 10.610 1.00 0.00 C ATOM 462 O LYS A 31 17.061 -5.990 9.749 1.00 0.00 O ATOM 463 CB LYS A 31 17.648 -6.753 13.139 1.00 0.00 C ATOM 464 CG LYS A 31 16.943 -6.958 14.484 1.00 0.00 C ATOM 465 CD LYS A 31 17.777 -6.421 15.658 1.00 0.00 C ATOM 466 CE LYS A 31 19.173 -7.050 15.780 1.00 0.00 C ATOM 467 NZ LYS A 31 19.116 -8.515 15.932 1.00 0.00 N ATOM 0 H LYS A 31 16.482 -8.853 12.770 1.00 0.00 H new ATOM 0 HA LYS A 31 15.924 -6.202 11.970 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.485 -7.447 13.063 1.00 0.00 H new ATOM 0 HB3 LYS A 31 18.064 -5.746 13.101 1.00 0.00 H new ATOM 0 HG2 LYS A 31 15.976 -6.456 14.467 1.00 0.00 H new ATOM 0 HG3 LYS A 31 16.748 -8.020 14.633 1.00 0.00 H new ATOM 0 HD2 LYS A 31 17.886 -5.342 15.548 1.00 0.00 H new ATOM 0 HD3 LYS A 31 17.231 -6.594 16.585 1.00 0.00 H new ATOM 0 HE2 LYS A 31 19.759 -6.801 14.895 1.00 0.00 H new ATOM 0 HE3 LYS A 31 19.690 -6.618 16.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 20.079 -8.890 16.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 18.551 -8.755 16.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 18.678 -8.935 15.088 1.00 0.00 H new ATOM 481 N LYS A 32 18.544 -7.527 10.429 1.00 0.00 N ATOM 482 CA LYS A 32 19.357 -7.444 9.223 1.00 0.00 C ATOM 483 C LYS A 32 18.524 -7.810 7.994 1.00 0.00 C ATOM 484 O LYS A 32 18.736 -7.267 6.916 1.00 0.00 O ATOM 485 CB LYS A 32 20.616 -8.310 9.390 1.00 0.00 C ATOM 486 CG LYS A 32 21.500 -8.376 8.133 1.00 0.00 C ATOM 487 CD LYS A 32 21.166 -9.587 7.243 1.00 0.00 C ATOM 488 CE LYS A 32 21.886 -9.515 5.891 1.00 0.00 C ATOM 489 NZ LYS A 32 23.351 -9.538 6.042 1.00 0.00 N ATOM 0 H LYS A 32 18.883 -8.204 11.113 1.00 0.00 H new ATOM 0 HA LYS A 32 19.695 -6.420 9.065 1.00 0.00 H new ATOM 0 HB2 LYS A 32 21.207 -7.918 10.218 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.315 -9.321 9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.376 -7.459 7.556 1.00 0.00 H new ATOM 0 HG3 LYS A 32 22.547 -8.425 8.431 1.00 0.00 H new ATOM 0 HD2 LYS A 32 21.449 -10.505 7.757 1.00 0.00 H new ATOM 0 HD3 LYS A 32 20.089 -9.632 7.080 1.00 0.00 H new ATOM 0 HE2 LYS A 32 21.573 -10.353 5.269 1.00 0.00 H new ATOM 0 HE3 LYS A 32 21.590 -8.604 5.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.797 -9.539 5.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 23.659 -8.697 6.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.633 -10.395 6.560 1.00 0.00 H new ATOM 503 N GLU A 33 17.571 -8.728 8.151 1.00 0.00 N ATOM 504 CA GLU A 33 16.657 -9.112 7.090 1.00 0.00 C ATOM 505 C GLU A 33 15.822 -7.907 6.639 1.00 0.00 C ATOM 506 O GLU A 33 15.702 -7.637 5.445 1.00 0.00 O ATOM 507 CB GLU A 33 15.791 -10.258 7.608 1.00 0.00 C ATOM 508 CG GLU A 33 14.922 -10.875 6.510 1.00 0.00 C ATOM 509 CD GLU A 33 14.109 -12.033 7.074 1.00 0.00 C ATOM 510 OE1 GLU A 33 13.646 -11.886 8.227 1.00 0.00 O ATOM 511 OE2 GLU A 33 13.989 -13.046 6.358 1.00 0.00 O ATOM 0 H GLU A 33 17.415 -9.227 9.027 1.00 0.00 H new ATOM 0 HA GLU A 33 17.204 -9.452 6.210 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.432 -11.029 8.037 1.00 0.00 H new ATOM 0 HB3 GLU A 33 15.151 -9.892 8.411 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.254 -10.119 6.096 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.551 -11.227 5.692 1.00 0.00 H new ATOM 518 N LEU A 34 15.260 -7.155 7.588 1.00 0.00 N ATOM 519 CA LEU A 34 14.608 -5.893 7.274 1.00 0.00 C ATOM 520 C LEU A 34 15.600 -4.973 6.563 1.00 0.00 C ATOM 521 O LEU A 34 15.285 -4.397 5.523 1.00 0.00 O ATOM 522 CB LEU A 34 14.015 -5.281 8.553 1.00 0.00 C ATOM 523 CG LEU A 34 13.433 -3.863 8.419 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.513 -2.776 8.286 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.409 -3.777 7.281 1.00 0.00 C ATOM 0 H LEU A 34 15.246 -7.402 8.577 1.00 0.00 H new ATOM 0 HA LEU A 34 13.773 -6.049 6.590 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.228 -5.942 8.916 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.793 -5.262 9.316 1.00 0.00 H new ATOM 0 HG LEU A 34 12.912 -3.663 9.355 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.037 -1.800 8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.152 -2.788 9.169 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.117 -2.969 7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.020 -2.761 7.217 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.889 -4.042 6.339 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.589 -4.468 7.477 1.00 0.00 H new ATOM 537 N LYS A 35 16.814 -4.817 7.099 1.00 0.00 N ATOM 538 CA LYS A 35 17.784 -3.952 6.444 1.00 0.00 C ATOM 539 C LYS A 35 17.988 -4.371 4.981 1.00 0.00 C ATOM 540 O LYS A 35 17.989 -3.519 4.094 1.00 0.00 O ATOM 541 CB LYS A 35 19.095 -3.889 7.237 1.00 0.00 C ATOM 542 CG LYS A 35 19.944 -2.725 6.717 1.00 0.00 C ATOM 543 CD LYS A 35 21.213 -2.513 7.544 1.00 0.00 C ATOM 544 CE LYS A 35 21.857 -1.190 7.113 1.00 0.00 C ATOM 545 NZ LYS A 35 23.209 -1.034 7.677 1.00 0.00 N ATOM 0 H LYS A 35 17.137 -5.265 7.957 1.00 0.00 H new ATOM 0 HA LYS A 35 17.389 -2.936 6.426 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.886 -3.756 8.298 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.641 -4.827 7.135 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.218 -2.914 5.679 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.349 -1.812 6.729 1.00 0.00 H new ATOM 0 HD2 LYS A 35 20.973 -2.489 8.607 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.907 -3.340 7.392 1.00 0.00 H new ATOM 0 HE2 LYS A 35 21.909 -1.148 6.025 1.00 0.00 H new ATOM 0 HE3 LYS A 35 21.230 -0.358 7.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 23.806 -0.509 7.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 23.153 -0.511 8.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 23.624 -1.972 7.849 1.00 0.00 H new ATOM 559 N GLU A 36 18.118 -5.679 4.736 1.00 0.00 N ATOM 560 CA GLU A 36 18.220 -6.283 3.414 1.00 0.00 C ATOM 561 C GLU A 36 17.030 -5.865 2.544 1.00 0.00 C ATOM 562 O GLU A 36 17.235 -5.355 1.444 1.00 0.00 O ATOM 563 CB GLU A 36 18.319 -7.810 3.566 1.00 0.00 C ATOM 564 CG GLU A 36 18.775 -8.522 2.289 1.00 0.00 C ATOM 565 CD GLU A 36 18.702 -10.032 2.476 1.00 0.00 C ATOM 566 OE1 GLU A 36 19.585 -10.562 3.185 1.00 0.00 O ATOM 567 OE2 GLU A 36 17.745 -10.625 1.934 1.00 0.00 O ATOM 0 H GLU A 36 18.156 -6.369 5.487 1.00 0.00 H new ATOM 0 HA GLU A 36 19.120 -5.931 2.910 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.016 -8.043 4.371 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.346 -8.202 3.863 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.146 -8.221 1.451 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.795 -8.227 2.044 1.00 0.00 H new ATOM 574 N LEU A 37 15.800 -6.050 3.043 1.00 0.00 N ATOM 575 CA LEU A 37 14.580 -5.563 2.401 1.00 0.00 C ATOM 576 C LEU A 37 14.769 -4.119 1.959 1.00 0.00 C ATOM 577 O LEU A 37 14.573 -3.796 0.791 1.00 0.00 O ATOM 578 CB LEU A 37 13.368 -5.765 3.339 1.00 0.00 C ATOM 579 CG LEU A 37 11.988 -5.271 2.855 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.903 -5.953 3.700 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.773 -3.760 3.042 1.00 0.00 C ATOM 0 H LEU A 37 15.627 -6.549 3.915 1.00 0.00 H new ATOM 0 HA LEU A 37 14.372 -6.141 1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.285 -6.831 3.553 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.589 -5.266 4.283 1.00 0.00 H new ATOM 0 HG LEU A 37 11.937 -5.507 1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.920 -5.615 3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.974 -7.034 3.580 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.043 -5.695 4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.782 -3.486 2.680 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.855 -3.509 4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.529 -3.213 2.479 1.00 0.00 H new ATOM 593 N ILE A 38 15.178 -3.243 2.872 1.00 0.00 N ATOM 594 CA ILE A 38 15.329 -1.837 2.535 1.00 0.00 C ATOM 595 C ILE A 38 16.413 -1.628 1.475 1.00 0.00 C ATOM 596 O ILE A 38 16.206 -0.870 0.525 1.00 0.00 O ATOM 597 CB ILE A 38 15.545 -1.019 3.815 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.236 -1.098 4.618 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.914 0.436 3.495 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.295 -0.312 5.918 1.00 0.00 C ATOM 0 H ILE A 38 15.407 -3.480 3.837 1.00 0.00 H new ATOM 0 HA ILE A 38 14.411 -1.471 2.075 1.00 0.00 H new ATOM 0 HB ILE A 38 16.378 -1.422 4.392 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.417 -0.720 4.007 1.00 0.00 H new ATOM 0 HG13 ILE A 38 14.013 -2.142 4.839 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.060 0.987 4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.834 0.458 2.912 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.110 0.898 2.922 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.344 -0.404 6.442 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.095 -0.706 6.545 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.489 0.738 5.700 1.00 0.00 H new ATOM 612 N GLN A 39 17.565 -2.290 1.612 1.00 0.00 N ATOM 613 CA GLN A 39 18.653 -2.108 0.662 1.00 0.00 C ATOM 614 C GLN A 39 18.200 -2.545 -0.729 1.00 0.00 C ATOM 615 O GLN A 39 18.470 -1.855 -1.710 1.00 0.00 O ATOM 616 CB GLN A 39 19.923 -2.873 1.070 1.00 0.00 C ATOM 617 CG GLN A 39 20.539 -2.514 2.433 1.00 0.00 C ATOM 618 CD GLN A 39 20.213 -1.105 2.913 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.884 -0.146 2.552 1.00 0.00 O ATOM 620 NE2 GLN A 39 19.181 -0.970 3.737 1.00 0.00 N ATOM 0 H GLN A 39 17.762 -2.949 2.365 1.00 0.00 H new ATOM 0 HA GLN A 39 18.907 -1.048 0.654 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.693 -3.938 1.071 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.679 -2.711 0.302 1.00 0.00 H new ATOM 0 HG2 GLN A 39 20.189 -3.229 3.177 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.622 -2.623 2.370 1.00 0.00 H new ATOM 0 HE21 GLN A 39 18.642 -1.789 4.018 1.00 0.00 H new ATOM 0 HE22 GLN A 39 18.927 -0.047 4.089 1.00 0.00 H new ATOM 629 N LYS A 40 17.526 -3.692 -0.820 1.00 0.00 N ATOM 630 CA LYS A 40 17.185 -4.276 -2.102 1.00 0.00 C ATOM 631 C LYS A 40 15.976 -3.587 -2.725 1.00 0.00 C ATOM 632 O LYS A 40 15.969 -3.337 -3.927 1.00 0.00 O ATOM 633 CB LYS A 40 16.983 -5.785 -1.926 1.00 0.00 C ATOM 634 CG LYS A 40 16.707 -6.530 -3.243 1.00 0.00 C ATOM 635 CD LYS A 40 17.774 -6.337 -4.333 1.00 0.00 C ATOM 636 CE LYS A 40 19.194 -6.697 -3.875 1.00 0.00 C ATOM 637 NZ LYS A 40 19.278 -8.081 -3.377 1.00 0.00 N ATOM 0 H LYS A 40 17.208 -4.231 -0.014 1.00 0.00 H new ATOM 0 HA LYS A 40 18.004 -4.122 -2.804 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.871 -6.209 -1.458 1.00 0.00 H new ATOM 0 HB3 LYS A 40 16.151 -5.954 -1.242 1.00 0.00 H new ATOM 0 HG2 LYS A 40 16.616 -7.595 -3.029 1.00 0.00 H new ATOM 0 HG3 LYS A 40 15.745 -6.201 -3.635 1.00 0.00 H new ATOM 0 HD2 LYS A 40 17.514 -6.949 -5.196 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.760 -5.298 -4.663 1.00 0.00 H new ATOM 0 HE2 LYS A 40 19.887 -6.568 -4.706 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.507 -6.009 -3.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.268 -8.311 -3.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 18.701 -8.176 -2.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 18.924 -8.734 -4.105 1.00 0.00 H new ATOM 651 N GLU A 41 14.950 -3.295 -1.923 1.00 0.00 N ATOM 652 CA GLU A 41 13.753 -2.637 -2.411 1.00 0.00 C ATOM 653 C GLU A 41 13.988 -1.133 -2.540 1.00 0.00 C ATOM 654 O GLU A 41 13.837 -0.585 -3.624 1.00 0.00 O ATOM 655 CB GLU A 41 12.551 -2.935 -1.498 1.00 0.00 C ATOM 656 CG GLU A 41 12.261 -4.437 -1.356 1.00 0.00 C ATOM 657 CD GLU A 41 11.980 -5.113 -2.693 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.984 -4.716 -3.335 1.00 0.00 O ATOM 659 OE2 GLU A 41 12.759 -6.031 -3.039 1.00 0.00 O ATOM 0 H GLU A 41 14.932 -3.509 -0.926 1.00 0.00 H new ATOM 0 HA GLU A 41 13.522 -3.032 -3.400 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.738 -2.512 -0.511 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.667 -2.436 -1.896 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.112 -4.923 -0.880 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.404 -4.576 -0.696 1.00 0.00 H new ATOM 666 N LEU A 42 14.316 -0.447 -1.442 1.00 0.00 N ATOM 667 CA LEU A 42 14.327 1.014 -1.447 1.00 0.00 C ATOM 668 C LEU A 42 15.615 1.534 -2.078 1.00 0.00 C ATOM 669 O LEU A 42 15.570 2.422 -2.927 1.00 0.00 O ATOM 670 CB LEU A 42 14.092 1.617 -0.050 1.00 0.00 C ATOM 671 CG LEU A 42 12.833 1.121 0.688 1.00 0.00 C ATOM 672 CD1 LEU A 42 12.506 2.060 1.857 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.596 1.036 -0.213 1.00 0.00 C ATOM 0 H LEU A 42 14.573 -0.874 -0.552 1.00 0.00 H new ATOM 0 HA LEU A 42 13.486 1.343 -2.058 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.963 1.402 0.570 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.030 2.701 -0.148 1.00 0.00 H new ATOM 0 HG LEU A 42 13.066 0.115 1.037 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.615 1.702 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 42 13.345 2.080 2.553 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.326 3.065 1.477 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.746 0.680 0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.372 2.023 -0.617 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.790 0.344 -1.033 1.00 0.00 H new ATOM 794 N ASP A 50 23.306 4.753 6.234 1.00 0.00 N ATOM 795 CA ASP A 50 23.209 3.496 6.972 1.00 0.00 C ATOM 796 C ASP A 50 22.906 3.712 8.454 1.00 0.00 C ATOM 797 O ASP A 50 22.109 2.969 9.014 1.00 0.00 O ATOM 798 CB ASP A 50 24.465 2.634 6.790 1.00 0.00 C ATOM 799 CG ASP A 50 24.407 1.786 5.521 1.00 0.00 C ATOM 800 OD1 ASP A 50 23.981 2.325 4.476 1.00 0.00 O ATOM 801 OD2 ASP A 50 24.764 0.592 5.629 1.00 0.00 O ATOM 0 HA ASP A 50 22.364 2.955 6.546 1.00 0.00 H new ATOM 0 HB2 ASP A 50 25.343 3.279 6.754 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.584 1.982 7.655 1.00 0.00 H new ATOM 806 N ALA A 51 23.500 4.731 9.084 1.00 0.00 N ATOM 807 CA ALA A 51 23.171 5.106 10.458 1.00 0.00 C ATOM 808 C ALA A 51 21.662 5.327 10.624 1.00 0.00 C ATOM 809 O ALA A 51 21.030 4.785 11.533 1.00 0.00 O ATOM 810 CB ALA A 51 23.951 6.368 10.838 1.00 0.00 C ATOM 0 H ALA A 51 24.219 5.315 8.656 1.00 0.00 H new ATOM 0 HA ALA A 51 23.456 4.293 11.125 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.708 6.651 11.862 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.020 6.172 10.759 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.680 7.180 10.163 1.00 0.00 H new ATOM 816 N GLU A 52 21.077 6.107 9.712 1.00 0.00 N ATOM 817 CA GLU A 52 19.651 6.380 9.688 1.00 0.00 C ATOM 818 C GLU A 52 18.899 5.067 9.492 1.00 0.00 C ATOM 819 O GLU A 52 17.933 4.792 10.201 1.00 0.00 O ATOM 820 CB GLU A 52 19.298 7.382 8.573 1.00 0.00 C ATOM 821 CG GLU A 52 20.273 8.563 8.457 1.00 0.00 C ATOM 822 CD GLU A 52 20.484 9.273 9.791 1.00 0.00 C ATOM 823 OE1 GLU A 52 19.488 9.838 10.295 1.00 0.00 O ATOM 824 OE2 GLU A 52 21.631 9.229 10.285 1.00 0.00 O ATOM 0 H GLU A 52 21.593 6.569 8.963 1.00 0.00 H new ATOM 0 HA GLU A 52 19.356 6.831 10.636 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.270 6.853 7.620 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.295 7.769 8.752 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.232 8.204 8.083 1.00 0.00 H new ATOM 0 HG3 GLU A 52 19.892 9.275 7.725 1.00 0.00 H new ATOM 831 N ILE A 53 19.358 4.246 8.541 1.00 0.00 N ATOM 832 CA ILE A 53 18.751 2.946 8.292 1.00 0.00 C ATOM 833 C ILE A 53 18.731 2.111 9.571 1.00 0.00 C ATOM 834 O ILE A 53 17.703 1.521 9.873 1.00 0.00 O ATOM 835 CB ILE A 53 19.428 2.176 7.144 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.538 2.972 5.833 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.671 0.863 6.895 1.00 0.00 C ATOM 838 CD1 ILE A 53 18.186 3.372 5.244 1.00 0.00 C ATOM 0 H ILE A 53 20.148 4.464 7.934 1.00 0.00 H new ATOM 0 HA ILE A 53 17.726 3.133 7.973 1.00 0.00 H new ATOM 0 HB ILE A 53 20.452 1.982 7.464 1.00 0.00 H new ATOM 0 HG12 ILE A 53 20.127 3.871 6.012 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.082 2.376 5.100 1.00 0.00 H new ATOM 0 HG21 ILE A 53 19.149 0.316 6.082 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.688 0.256 7.800 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.638 1.084 6.626 1.00 0.00 H new ATOM 0 HD11 ILE A 53 18.342 3.930 4.321 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.602 2.476 5.032 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.648 3.995 5.958 1.00 0.00 H new ATOM 850 N VAL A 54 19.836 2.026 10.318 1.00 0.00 N ATOM 851 CA VAL A 54 19.853 1.195 11.518 1.00 0.00 C ATOM 852 C VAL A 54 19.025 1.800 12.653 1.00 0.00 C ATOM 853 O VAL A 54 18.418 1.053 13.417 1.00 0.00 O ATOM 854 CB VAL A 54 21.256 0.733 11.943 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.816 -0.228 10.884 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.232 1.868 12.243 1.00 0.00 C ATOM 0 H VAL A 54 20.710 2.512 10.117 1.00 0.00 H new ATOM 0 HA VAL A 54 19.350 0.267 11.244 1.00 0.00 H new ATOM 0 HB VAL A 54 21.143 0.215 12.896 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.811 -0.558 11.182 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.159 -1.093 10.794 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.876 0.284 9.924 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.196 1.451 12.535 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.358 2.485 11.353 1.00 0.00 H new ATOM 0 HG23 VAL A 54 21.840 2.480 13.056 1.00 0.00 H new ATOM 866 N LYS A 55 18.943 3.131 12.764 1.00 0.00 N ATOM 867 CA LYS A 55 17.980 3.733 13.686 1.00 0.00 C ATOM 868 C LYS A 55 16.563 3.297 13.293 1.00 0.00 C ATOM 869 O LYS A 55 15.803 2.788 14.113 1.00 0.00 O ATOM 870 CB LYS A 55 18.148 5.260 13.707 1.00 0.00 C ATOM 871 CG LYS A 55 17.073 5.999 14.525 1.00 0.00 C ATOM 872 CD LYS A 55 16.850 5.467 15.951 1.00 0.00 C ATOM 873 CE LYS A 55 18.116 5.525 16.812 1.00 0.00 C ATOM 874 NZ LYS A 55 17.848 5.034 18.175 1.00 0.00 N ATOM 0 H LYS A 55 19.516 3.794 12.242 1.00 0.00 H new ATOM 0 HA LYS A 55 18.162 3.386 14.703 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.130 5.501 14.115 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.129 5.631 12.682 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.347 7.052 14.587 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.128 5.947 13.984 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.063 6.048 16.431 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.499 4.436 15.898 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.901 4.924 16.353 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.484 6.550 16.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.720 5.083 18.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.115 5.624 18.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.519 4.048 18.131 1.00 0.00 H new ATOM 888 N LEU A 56 16.214 3.460 12.019 1.00 0.00 N ATOM 889 CA LEU A 56 14.940 3.022 11.470 1.00 0.00 C ATOM 890 C LEU A 56 14.704 1.523 11.737 1.00 0.00 C ATOM 891 O LEU A 56 13.618 1.129 12.158 1.00 0.00 O ATOM 892 CB LEU A 56 14.906 3.438 9.992 1.00 0.00 C ATOM 893 CG LEU A 56 13.790 2.795 9.164 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.292 3.776 8.097 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.318 1.547 8.451 1.00 0.00 C ATOM 0 H LEU A 56 16.820 3.907 11.331 1.00 0.00 H new ATOM 0 HA LEU A 56 14.097 3.504 11.965 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.800 4.521 9.937 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.865 3.188 9.538 1.00 0.00 H new ATOM 0 HG LEU A 56 12.976 2.529 9.839 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.499 3.308 7.514 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.906 4.674 8.580 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.117 4.045 7.437 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.517 1.097 7.865 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.139 1.825 7.790 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.674 0.829 9.190 1.00 0.00 H new ATOM 907 N MET A 57 15.725 0.688 11.530 1.00 0.00 N ATOM 908 CA MET A 57 15.685 -0.744 11.789 1.00 0.00 C ATOM 909 C MET A 57 15.340 -0.973 13.255 1.00 0.00 C ATOM 910 O MET A 57 14.411 -1.716 13.554 1.00 0.00 O ATOM 911 CB MET A 57 17.040 -1.370 11.436 1.00 0.00 C ATOM 912 CG MET A 57 17.086 -2.896 11.580 1.00 0.00 C ATOM 913 SD MET A 57 18.716 -3.625 11.265 1.00 0.00 S ATOM 914 CE MET A 57 19.635 -3.048 12.711 1.00 0.00 C ATOM 0 H MET A 57 16.625 1.003 11.168 1.00 0.00 H new ATOM 0 HA MET A 57 14.922 -1.218 11.171 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.293 -1.106 10.409 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.807 -0.933 12.076 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.769 -3.164 12.588 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.365 -3.336 10.892 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.576 -3.594 12.786 1.00 0.00 H new ATOM 0 HE2 MET A 57 19.841 -1.982 12.610 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.044 -3.220 13.610 1.00 0.00 H new ATOM 924 N ASP A 58 16.069 -0.317 14.163 1.00 0.00 N ATOM 925 CA ASP A 58 15.787 -0.360 15.589 1.00 0.00 C ATOM 926 C ASP A 58 14.323 0.003 15.842 1.00 0.00 C ATOM 927 O ASP A 58 13.615 -0.722 16.529 1.00 0.00 O ATOM 928 CB ASP A 58 16.752 0.543 16.363 1.00 0.00 C ATOM 929 CG ASP A 58 16.417 0.553 17.851 1.00 0.00 C ATOM 930 OD1 ASP A 58 16.743 -0.455 18.513 1.00 0.00 O ATOM 931 OD2 ASP A 58 15.847 1.571 18.298 1.00 0.00 O ATOM 0 H ASP A 58 16.874 0.260 13.921 1.00 0.00 H new ATOM 0 HA ASP A 58 15.945 -1.374 15.956 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.775 0.196 16.219 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.702 1.558 15.968 1.00 0.00 H new ATOM 936 N ASP A 59 13.848 1.104 15.261 1.00 0.00 N ATOM 937 CA ASP A 59 12.467 1.540 15.444 1.00 0.00 C ATOM 938 C ASP A 59 11.470 0.486 14.950 1.00 0.00 C ATOM 939 O ASP A 59 10.425 0.292 15.567 1.00 0.00 O ATOM 940 CB ASP A 59 12.217 2.888 14.748 1.00 0.00 C ATOM 941 CG ASP A 59 13.146 4.007 15.217 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.458 4.034 16.427 1.00 0.00 O ATOM 943 OD2 ASP A 59 13.512 4.834 14.353 1.00 0.00 O ATOM 0 H ASP A 59 14.403 1.711 14.658 1.00 0.00 H new ATOM 0 HA ASP A 59 12.309 1.670 16.515 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.335 2.758 13.672 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.184 3.190 14.921 1.00 0.00 H new ATOM 948 N LEU A 60 11.778 -0.191 13.840 1.00 0.00 N ATOM 949 CA LEU A 60 10.968 -1.287 13.319 1.00 0.00 C ATOM 950 C LEU A 60 10.991 -2.496 14.259 1.00 0.00 C ATOM 951 O LEU A 60 9.936 -3.016 14.625 1.00 0.00 O ATOM 952 CB LEU A 60 11.442 -1.660 11.898 1.00 0.00 C ATOM 953 CG LEU A 60 10.789 -0.799 10.804 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.670 -0.685 9.561 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.468 -1.426 10.345 1.00 0.00 C ATOM 0 H LEU A 60 12.604 0.011 13.276 1.00 0.00 H new ATOM 0 HA LEU A 60 9.931 -0.956 13.260 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.525 -1.551 11.841 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.217 -2.710 11.709 1.00 0.00 H new ATOM 0 HG LEU A 60 10.636 0.185 11.246 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.169 -0.068 8.815 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.622 -0.227 9.830 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.849 -1.678 9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.020 -0.804 9.571 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.658 -2.422 9.945 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.786 -1.499 11.192 1.00 0.00 H new ATOM 967 N ASP A 61 12.177 -2.971 14.637 1.00 0.00 N ATOM 968 CA ASP A 61 12.313 -4.200 15.410 1.00 0.00 C ATOM 969 C ASP A 61 11.866 -4.020 16.857 1.00 0.00 C ATOM 970 O ASP A 61 11.290 -4.944 17.430 1.00 0.00 O ATOM 971 CB ASP A 61 13.719 -4.809 15.280 1.00 0.00 C ATOM 972 CG ASP A 61 14.876 -3.942 15.772 1.00 0.00 C ATOM 973 OD1 ASP A 61 14.807 -3.452 16.917 1.00 0.00 O ATOM 974 OD2 ASP A 61 15.845 -3.813 14.992 1.00 0.00 O ATOM 0 H ASP A 61 13.063 -2.517 14.417 1.00 0.00 H new ATOM 0 HA ASP A 61 11.630 -4.931 14.978 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.737 -5.750 15.830 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.893 -5.050 14.231 1.00 0.00 H new ATOM 979 N ARG A 62 12.077 -2.832 17.435 1.00 0.00 N ATOM 980 CA ARG A 62 11.908 -2.601 18.864 1.00 0.00 C ATOM 981 C ARG A 62 10.527 -3.049 19.333 1.00 0.00 C ATOM 982 O ARG A 62 10.391 -3.609 20.423 1.00 0.00 O ATOM 983 CB ARG A 62 12.171 -1.123 19.196 1.00 0.00 C ATOM 984 CG ARG A 62 11.828 -0.737 20.644 1.00 0.00 C ATOM 985 CD ARG A 62 12.632 -1.534 21.680 1.00 0.00 C ATOM 986 NE ARG A 62 12.186 -1.227 23.044 1.00 0.00 N ATOM 987 CZ ARG A 62 11.109 -1.759 23.643 1.00 0.00 C ATOM 988 NH1 ARG A 62 10.320 -2.631 23.003 1.00 0.00 N ATOM 989 NH2 ARG A 62 10.824 -1.409 24.901 1.00 0.00 N ATOM 0 H ARG A 62 12.371 -2.004 16.918 1.00 0.00 H new ATOM 0 HA ARG A 62 12.639 -3.203 19.404 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.222 -0.901 19.011 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.589 -0.500 18.517 1.00 0.00 H new ATOM 0 HG2 ARG A 62 12.016 0.327 20.786 1.00 0.00 H new ATOM 0 HG3 ARG A 62 10.764 -0.898 20.815 1.00 0.00 H new ATOM 0 HD2 ARG A 62 12.520 -2.601 21.489 1.00 0.00 H new ATOM 0 HD3 ARG A 62 13.692 -1.301 21.580 1.00 0.00 H new ATOM 0 HE ARG A 62 12.738 -0.557 23.579 1.00 0.00 H new ATOM 0 HH11 ARG A 62 10.533 -2.902 22.043 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.506 -3.024 23.475 1.00 0.00 H new ATOM 0 HH21 ARG A 62 11.422 -0.745 25.394 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.009 -1.805 25.368 1.00 0.00 H new ATOM 1003 N ASN A 63 9.513 -2.818 18.495 1.00 0.00 N ATOM 1004 CA ASN A 63 8.123 -3.163 18.779 1.00 0.00 C ATOM 1005 C ASN A 63 7.972 -4.612 19.249 1.00 0.00 C ATOM 1006 O ASN A 63 7.104 -4.897 20.070 1.00 0.00 O ATOM 1007 CB ASN A 63 7.233 -2.882 17.564 1.00 0.00 C ATOM 1008 CG ASN A 63 7.427 -1.462 17.046 1.00 0.00 C ATOM 1009 OD1 ASN A 63 6.852 -0.514 17.570 1.00 0.00 O ATOM 1010 ND2 ASN A 63 8.288 -1.311 16.046 1.00 0.00 N ATOM 0 H ASN A 63 9.641 -2.378 17.584 1.00 0.00 H new ATOM 0 HA ASN A 63 7.794 -2.527 19.601 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.462 -3.594 16.771 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.188 -3.032 17.835 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.493 -0.379 15.686 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.745 -2.127 15.639 1.00 0.00 H new ATOM 1017 N LYS A 64 8.818 -5.517 18.747 1.00 0.00 N ATOM 1018 CA LYS A 64 8.955 -6.868 19.273 1.00 0.00 C ATOM 1019 C LYS A 64 10.450 -7.202 19.320 1.00 0.00 C ATOM 1020 O LYS A 64 10.913 -8.196 18.760 1.00 0.00 O ATOM 1021 CB LYS A 64 8.073 -7.848 18.478 1.00 0.00 C ATOM 1022 CG LYS A 64 8.081 -9.306 18.970 1.00 0.00 C ATOM 1023 CD LYS A 64 7.722 -9.442 20.458 1.00 0.00 C ATOM 1024 CE LYS A 64 7.684 -10.909 20.900 1.00 0.00 C ATOM 1025 NZ LYS A 64 6.619 -11.670 20.221 1.00 0.00 N ATOM 0 H LYS A 64 9.431 -5.324 17.955 1.00 0.00 H new ATOM 0 HA LYS A 64 8.583 -6.956 20.294 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.046 -7.483 18.500 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.395 -7.834 17.437 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.374 -9.887 18.377 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.068 -9.735 18.800 1.00 0.00 H new ATOM 0 HD2 LYS A 64 8.451 -8.899 21.059 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.751 -8.981 20.642 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.648 -11.374 20.693 1.00 0.00 H new ATOM 0 HE3 LYS A 64 7.532 -10.958 21.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.496 -12.590 20.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.728 -11.136 20.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 6.881 -11.821 19.226 1.00 0.00 H new ATOM 1039 N ASP A 65 11.194 -6.350 20.036 1.00 0.00 N ATOM 1040 CA ASP A 65 12.621 -6.462 20.313 1.00 0.00 C ATOM 1041 C ASP A 65 13.473 -6.735 19.065 1.00 0.00 C ATOM 1042 O ASP A 65 13.999 -5.803 18.466 1.00 0.00 O ATOM 1043 CB ASP A 65 12.900 -7.395 21.509 1.00 0.00 C ATOM 1044 CG ASP A 65 12.265 -8.781 21.406 1.00 0.00 C ATOM 1045 OD1 ASP A 65 12.903 -9.652 20.776 1.00 0.00 O ATOM 1046 OD2 ASP A 65 11.154 -8.943 21.957 1.00 0.00 O ATOM 0 H ASP A 65 10.786 -5.517 20.460 1.00 0.00 H new ATOM 0 HA ASP A 65 12.960 -5.476 20.630 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.978 -7.513 21.615 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.541 -6.913 22.418 1.00 0.00 H new ATOM 1051 N GLN A 66 13.657 -8.000 18.699 1.00 0.00 N ATOM 1052 CA GLN A 66 14.461 -8.420 17.564 1.00 0.00 C ATOM 1053 C GLN A 66 13.614 -8.520 16.293 1.00 0.00 C ATOM 1054 O GLN A 66 14.120 -8.271 15.199 1.00 0.00 O ATOM 1055 CB GLN A 66 15.128 -9.759 17.909 1.00 0.00 C ATOM 1056 CG GLN A 66 15.920 -10.334 16.727 1.00 0.00 C ATOM 1057 CD GLN A 66 16.704 -11.576 17.127 1.00 0.00 C ATOM 1058 OE1 GLN A 66 17.927 -11.539 17.218 1.00 0.00 O ATOM 1059 NE2 GLN A 66 16.011 -12.684 17.361 1.00 0.00 N ATOM 0 H GLN A 66 13.237 -8.782 19.201 1.00 0.00 H new ATOM 0 HA GLN A 66 15.232 -7.676 17.363 1.00 0.00 H new ATOM 0 HB2 GLN A 66 15.796 -9.622 18.759 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.365 -10.475 18.215 1.00 0.00 H new ATOM 0 HG2 GLN A 66 15.235 -10.581 15.916 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.606 -9.577 16.346 1.00 0.00 H new ATOM 0 HE21 GLN A 66 14.995 -12.677 17.276 1.00 0.00 H new ATOM 0 HE22 GLN A 66 16.495 -13.542 17.626 1.00 0.00 H new ATOM 1068 N GLU A 67 12.351 -8.933 16.417 1.00 0.00 N ATOM 1069 CA GLU A 67 11.529 -9.270 15.270 1.00 0.00 C ATOM 1070 C GLU A 67 10.722 -8.052 14.824 1.00 0.00 C ATOM 1071 O GLU A 67 9.929 -7.495 15.578 1.00 0.00 O ATOM 1072 CB GLU A 67 10.566 -10.415 15.621 1.00 0.00 C ATOM 1073 CG GLU A 67 11.260 -11.777 15.777 1.00 0.00 C ATOM 1074 CD GLU A 67 12.159 -11.869 17.007 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.714 -11.407 18.080 1.00 0.00 O ATOM 1076 OE2 GLU A 67 13.278 -12.406 16.854 1.00 0.00 O ATOM 0 H GLU A 67 11.878 -9.040 17.314 1.00 0.00 H new ATOM 0 HA GLU A 67 12.185 -9.587 14.459 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.049 -10.172 16.549 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.806 -10.491 14.843 1.00 0.00 H new ATOM 0 HG2 GLU A 67 10.501 -12.557 15.833 1.00 0.00 H new ATOM 0 HG3 GLU A 67 11.856 -11.975 14.886 1.00 0.00 H new ATOM 1083 N VAL A 68 10.867 -7.685 13.558 1.00 0.00 N ATOM 1084 CA VAL A 68 10.016 -6.728 12.890 1.00 0.00 C ATOM 1085 C VAL A 68 8.744 -7.499 12.521 1.00 0.00 C ATOM 1086 O VAL A 68 8.672 -8.140 11.470 1.00 0.00 O ATOM 1087 CB VAL A 68 10.761 -6.186 11.661 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.895 -5.196 10.882 1.00 0.00 C ATOM 1089 CG2 VAL A 68 12.098 -5.537 12.032 1.00 0.00 C ATOM 0 H VAL A 68 11.602 -8.059 12.957 1.00 0.00 H new ATOM 0 HA VAL A 68 9.757 -5.865 13.504 1.00 0.00 H new ATOM 0 HB VAL A 68 10.975 -7.045 11.024 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.449 -4.829 10.018 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.986 -5.694 10.545 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.632 -4.357 11.527 1.00 0.00 H new ATOM 0 HG21 VAL A 68 12.587 -5.169 11.130 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.922 -4.705 12.714 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.738 -6.274 12.517 1.00 0.00 H new ATOM 1099 N ASN A 69 7.750 -7.484 13.414 1.00 0.00 N ATOM 1100 CA ASN A 69 6.531 -8.263 13.233 1.00 0.00 C ATOM 1101 C ASN A 69 5.611 -7.576 12.225 1.00 0.00 C ATOM 1102 O ASN A 69 5.572 -6.349 12.153 1.00 0.00 O ATOM 1103 CB ASN A 69 5.821 -8.470 14.575 1.00 0.00 C ATOM 1104 CG ASN A 69 4.563 -9.317 14.389 1.00 0.00 C ATOM 1105 OD1 ASN A 69 4.650 -10.509 14.128 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.380 -8.720 14.494 1.00 0.00 N ATOM 0 H ASN A 69 7.771 -6.935 14.274 1.00 0.00 H new ATOM 0 HA ASN A 69 6.796 -9.244 12.840 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.495 -8.959 15.278 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.556 -7.504 15.006 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.524 -9.257 14.356 1.00 0.00 H new ATOM 0 HD22 ASN A 69 3.328 -7.725 14.712 1.00 0.00 H new ATOM 1113 N PHE A 70 4.886 -8.363 11.428 1.00 0.00 N ATOM 1114 CA PHE A 70 4.123 -7.886 10.283 1.00 0.00 C ATOM 1115 C PHE A 70 3.292 -6.625 10.567 1.00 0.00 C ATOM 1116 O PHE A 70 3.473 -5.601 9.907 1.00 0.00 O ATOM 1117 CB PHE A 70 3.276 -9.034 9.727 1.00 0.00 C ATOM 1118 CG PHE A 70 2.359 -8.587 8.615 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.910 -8.178 7.389 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.008 -8.322 8.903 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.106 -7.522 6.442 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.205 -7.666 7.960 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.755 -7.260 6.731 1.00 0.00 C ATOM 0 H PHE A 70 4.814 -9.371 11.567 1.00 0.00 H new ATOM 0 HA PHE A 70 4.836 -7.565 9.523 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.933 -9.821 9.358 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.682 -9.467 10.532 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.951 -8.368 7.175 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.589 -8.624 9.851 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.525 -7.219 5.494 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.835 -7.472 8.177 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.139 -6.746 6.008 1.00 0.00 H new ATOM 1133 N GLN A 71 2.382 -6.662 11.546 1.00 0.00 N ATOM 1134 CA GLN A 71 1.546 -5.492 11.797 1.00 0.00 C ATOM 1135 C GLN A 71 2.402 -4.287 12.198 1.00 0.00 C ATOM 1136 O GLN A 71 2.079 -3.157 11.843 1.00 0.00 O ATOM 1137 CB GLN A 71 0.448 -5.784 12.828 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.512 -4.583 12.915 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.737 -4.840 13.781 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -1.756 -5.756 14.596 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -2.777 -4.028 13.618 1.00 0.00 N ATOM 0 H GLN A 71 2.211 -7.461 12.156 1.00 0.00 H new ATOM 0 HA GLN A 71 1.038 -5.241 10.866 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.101 -6.682 12.545 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.894 -5.978 13.804 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.029 -3.725 13.313 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.838 -4.316 11.910 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.733 -3.274 12.932 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.619 -4.159 14.179 1.00 0.00 H new ATOM 1150 N GLU A 72 3.497 -4.513 12.924 1.00 0.00 N ATOM 1151 CA GLU A 72 4.395 -3.456 13.360 1.00 0.00 C ATOM 1152 C GLU A 72 5.111 -2.864 12.145 1.00 0.00 C ATOM 1153 O GLU A 72 5.260 -1.650 12.056 1.00 0.00 O ATOM 1154 CB GLU A 72 5.375 -3.983 14.417 1.00 0.00 C ATOM 1155 CG GLU A 72 4.714 -4.171 15.793 1.00 0.00 C ATOM 1156 CD GLU A 72 3.392 -4.931 15.757 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.431 -6.113 15.352 1.00 0.00 O ATOM 1158 OE2 GLU A 72 2.363 -4.312 16.103 1.00 0.00 O ATOM 0 H GLU A 72 3.784 -5.444 13.226 1.00 0.00 H new ATOM 0 HA GLU A 72 3.824 -2.658 13.834 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.787 -4.935 14.083 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.210 -3.289 14.511 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.407 -4.702 16.446 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.544 -3.191 16.238 1.00 0.00 H new ATOM 1165 N TYR A 73 5.512 -3.705 11.189 1.00 0.00 N ATOM 1166 CA TYR A 73 6.008 -3.254 9.897 1.00 0.00 C ATOM 1167 C TYR A 73 4.977 -2.348 9.219 1.00 0.00 C ATOM 1168 O TYR A 73 5.313 -1.228 8.840 1.00 0.00 O ATOM 1169 CB TYR A 73 6.416 -4.462 9.042 1.00 0.00 C ATOM 1170 CG TYR A 73 6.514 -4.224 7.549 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.749 -3.876 6.972 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.426 -4.564 6.723 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.900 -3.881 5.574 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.571 -4.545 5.326 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.805 -4.202 4.751 1.00 0.00 C ATOM 1176 OH TYR A 73 6.916 -4.128 3.396 1.00 0.00 O ATOM 0 H TYR A 73 5.500 -4.719 11.294 1.00 0.00 H new ATOM 0 HA TYR A 73 6.905 -2.649 10.031 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.383 -4.821 9.396 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.696 -5.262 9.215 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.582 -3.605 7.604 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.479 -4.840 7.164 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.855 -3.639 5.133 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.732 -4.795 4.693 1.00 0.00 H new ATOM 0 HH TYR A 73 6.290 -4.757 2.982 1.00 0.00 H new ATOM 1186 N ILE A 74 3.724 -2.798 9.083 1.00 0.00 N ATOM 1187 CA ILE A 74 2.680 -1.974 8.471 1.00 0.00 C ATOM 1188 C ILE A 74 2.541 -0.639 9.222 1.00 0.00 C ATOM 1189 O ILE A 74 2.599 0.432 8.620 1.00 0.00 O ATOM 1190 CB ILE A 74 1.339 -2.733 8.388 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.409 -4.039 7.573 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.247 -1.817 7.816 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.683 -3.848 6.079 1.00 0.00 C ATOM 0 H ILE A 74 3.412 -3.721 9.386 1.00 0.00 H new ATOM 0 HA ILE A 74 2.976 -1.750 7.446 1.00 0.00 H new ATOM 0 HB ILE A 74 1.094 -3.023 9.410 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.190 -4.672 7.994 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.467 -4.575 7.690 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.695 -2.363 7.762 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.126 -0.948 8.462 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.534 -1.489 6.817 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.715 -4.820 5.588 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.890 -3.244 5.638 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.640 -3.343 5.946 1.00 0.00 H new ATOM 1205 N THR A 75 2.379 -0.696 10.546 1.00 0.00 N ATOM 1206 CA THR A 75 2.252 0.476 11.408 1.00 0.00 C ATOM 1207 C THR A 75 3.419 1.438 11.176 1.00 0.00 C ATOM 1208 O THR A 75 3.224 2.638 10.981 1.00 0.00 O ATOM 1209 CB THR A 75 2.190 0.028 12.876 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.119 -0.877 13.046 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.996 1.210 13.828 1.00 0.00 C ATOM 0 H THR A 75 2.332 -1.578 11.057 1.00 0.00 H new ATOM 0 HA THR A 75 1.331 1.006 11.165 1.00 0.00 H new ATOM 0 HB THR A 75 3.141 -0.448 13.116 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.404 -1.775 12.777 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.958 0.847 14.855 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.829 1.905 13.719 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.063 1.721 13.589 1.00 0.00 H new ATOM 1219 N PHE A 76 4.641 0.905 11.183 1.00 0.00 N ATOM 1220 CA PHE A 76 5.834 1.691 10.956 1.00 0.00 C ATOM 1221 C PHE A 76 5.807 2.308 9.565 1.00 0.00 C ATOM 1222 O PHE A 76 6.118 3.482 9.428 1.00 0.00 O ATOM 1223 CB PHE A 76 7.095 0.855 11.155 1.00 0.00 C ATOM 1224 CG PHE A 76 8.351 1.675 10.936 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.872 1.821 9.636 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.873 2.455 11.986 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.930 2.707 9.396 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.898 3.384 11.731 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.413 3.523 10.432 1.00 0.00 C ATOM 0 H PHE A 76 4.822 -0.085 11.347 1.00 0.00 H new ATOM 0 HA PHE A 76 5.853 2.496 11.691 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.102 0.441 12.163 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.086 0.012 10.464 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.454 1.248 8.821 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.486 2.340 12.988 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.375 2.763 8.413 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.289 3.991 12.535 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.180 4.256 10.230 1.00 0.00 H new ATOM 1239 N LEU A 77 5.431 1.560 8.523 1.00 0.00 N ATOM 1240 CA LEU A 77 5.248 2.154 7.203 1.00 0.00 C ATOM 1241 C LEU A 77 4.220 3.288 7.271 1.00 0.00 C ATOM 1242 O LEU A 77 4.383 4.308 6.607 1.00 0.00 O ATOM 1243 CB LEU A 77 4.887 1.090 6.157 1.00 0.00 C ATOM 1244 CG LEU A 77 6.079 0.184 5.803 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.592 -0.991 4.956 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.153 0.925 4.997 1.00 0.00 C ATOM 0 H LEU A 77 5.251 0.557 8.569 1.00 0.00 H new ATOM 0 HA LEU A 77 6.193 2.590 6.879 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.068 0.477 6.534 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.527 1.581 5.253 1.00 0.00 H new ATOM 0 HG LEU A 77 6.514 -0.152 6.744 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.436 -1.633 4.705 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.855 -1.564 5.518 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.137 -0.615 4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.973 0.244 4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.721 1.293 4.067 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.529 1.766 5.579 1.00 0.00 H new ATOM 1258 N GLY A 78 3.194 3.151 8.111 1.00 0.00 N ATOM 1259 CA GLY A 78 2.293 4.249 8.427 1.00 0.00 C ATOM 1260 C GLY A 78 3.052 5.445 9.001 1.00 0.00 C ATOM 1261 O GLY A 78 2.891 6.569 8.531 1.00 0.00 O ATOM 0 H GLY A 78 2.968 2.278 8.588 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.758 4.553 7.527 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.545 3.913 9.144 1.00 0.00 H new ATOM 1265 N ALA A 79 3.892 5.226 10.013 1.00 0.00 N ATOM 1266 CA ALA A 79 4.721 6.291 10.570 1.00 0.00 C ATOM 1267 C ALA A 79 5.598 6.935 9.488 1.00 0.00 C ATOM 1268 O ALA A 79 5.640 8.154 9.371 1.00 0.00 O ATOM 1269 CB ALA A 79 5.553 5.770 11.745 1.00 0.00 C ATOM 0 H ALA A 79 4.015 4.319 10.463 1.00 0.00 H new ATOM 0 HA ALA A 79 4.064 7.072 10.953 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.164 6.579 12.146 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.888 5.397 12.524 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.200 4.962 11.403 1.00 0.00 H new ATOM 1275 N LEU A 80 6.270 6.118 8.676 1.00 0.00 N ATOM 1276 CA LEU A 80 7.095 6.536 7.553 1.00 0.00 C ATOM 1277 C LEU A 80 6.276 7.437 6.624 1.00 0.00 C ATOM 1278 O LEU A 80 6.702 8.535 6.272 1.00 0.00 O ATOM 1279 CB LEU A 80 7.611 5.281 6.825 1.00 0.00 C ATOM 1280 CG LEU A 80 8.835 5.533 5.934 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.127 5.639 6.753 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.008 4.361 4.964 1.00 0.00 C ATOM 0 H LEU A 80 6.250 5.105 8.792 1.00 0.00 H new ATOM 0 HA LEU A 80 7.954 7.112 7.897 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.864 4.523 7.566 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.807 4.873 6.213 1.00 0.00 H new ATOM 0 HG LEU A 80 8.662 6.472 5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.969 5.817 6.084 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.043 6.465 7.459 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.289 4.710 7.299 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.877 4.538 4.330 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.152 3.440 5.528 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.118 4.269 4.342 1.00 0.00 H new ATOM 1294 N ALA A 81 5.075 6.987 6.258 1.00 0.00 N ATOM 1295 CA ALA A 81 4.137 7.742 5.443 1.00 0.00 C ATOM 1296 C ALA A 81 3.785 9.077 6.101 1.00 0.00 C ATOM 1297 O ALA A 81 3.756 10.109 5.436 1.00 0.00 O ATOM 1298 CB ALA A 81 2.890 6.898 5.178 1.00 0.00 C ATOM 0 H ALA A 81 4.725 6.068 6.528 1.00 0.00 H new ATOM 0 HA ALA A 81 4.606 7.974 4.487 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.189 7.467 4.567 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.173 5.986 4.652 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.418 6.639 6.126 1.00 0.00 H new ATOM 1304 N MET A 82 3.520 9.071 7.408 1.00 0.00 N ATOM 1305 CA MET A 82 3.179 10.279 8.142 1.00 0.00 C ATOM 1306 C MET A 82 4.354 11.262 8.160 1.00 0.00 C ATOM 1307 O MET A 82 4.160 12.467 7.994 1.00 0.00 O ATOM 1308 CB MET A 82 2.694 9.897 9.548 1.00 0.00 C ATOM 1309 CG MET A 82 1.934 11.043 10.221 1.00 0.00 C ATOM 1310 SD MET A 82 1.051 10.553 11.723 1.00 0.00 S ATOM 1311 CE MET A 82 0.279 12.127 12.158 1.00 0.00 C ATOM 0 H MET A 82 3.537 8.228 7.982 1.00 0.00 H new ATOM 0 HA MET A 82 2.364 10.800 7.640 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.048 9.021 9.484 1.00 0.00 H new ATOM 0 HB3 MET A 82 3.549 9.618 10.164 1.00 0.00 H new ATOM 0 HG2 MET A 82 2.638 11.838 10.468 1.00 0.00 H new ATOM 0 HG3 MET A 82 1.220 11.459 9.511 1.00 0.00 H new ATOM 0 HE1 MET A 82 -0.309 12.005 13.068 1.00 0.00 H new ATOM 0 HE2 MET A 82 1.052 12.878 12.323 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.373 12.449 11.346 1.00 0.00 H new ATOM 1321 N ILE A 83 5.569 10.738 8.350 1.00 0.00 N ATOM 1322 CA ILE A 83 6.812 11.496 8.281 1.00 0.00 C ATOM 1323 C ILE A 83 6.965 12.077 6.874 1.00 0.00 C ATOM 1324 O ILE A 83 7.314 13.249 6.729 1.00 0.00 O ATOM 1325 CB ILE A 83 8.002 10.617 8.716 1.00 0.00 C ATOM 1326 CG1 ILE A 83 7.908 10.338 10.229 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.345 11.291 8.392 1.00 0.00 C ATOM 1328 CD1 ILE A 83 8.776 9.154 10.670 1.00 0.00 C ATOM 0 H ILE A 83 5.714 9.751 8.561 1.00 0.00 H new ATOM 0 HA ILE A 83 6.790 12.334 8.977 1.00 0.00 H new ATOM 0 HB ILE A 83 7.956 9.679 8.162 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.212 11.229 10.778 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.869 10.139 10.493 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.163 10.645 8.711 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.416 11.462 7.318 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.410 12.244 8.917 1.00 0.00 H new ATOM 0 HD11 ILE A 83 8.669 9.005 11.744 1.00 0.00 H new ATOM 0 HD12 ILE A 83 8.457 8.253 10.145 1.00 0.00 H new ATOM 0 HD13 ILE A 83 9.820 9.360 10.434 1.00 0.00 H new ATOM 1340 N TYR A 84 6.656 11.297 5.833 1.00 0.00 N ATOM 1341 CA TYR A 84 6.546 11.792 4.464 1.00 0.00 C ATOM 1342 C TYR A 84 5.272 12.637 4.320 1.00 0.00 C ATOM 1343 O TYR A 84 4.430 12.362 3.470 1.00 0.00 O ATOM 1344 CB TYR A 84 6.520 10.622 3.466 1.00 0.00 C ATOM 1345 CG TYR A 84 7.663 9.624 3.488 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.933 9.961 3.996 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.467 8.367 2.884 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.998 9.049 3.895 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.535 7.462 2.769 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.802 7.806 3.269 1.00 0.00 C ATOM 1351 OH TYR A 84 10.833 6.919 3.166 1.00 0.00 O ATOM 0 H TYR A 84 6.474 10.297 5.921 1.00 0.00 H new ATOM 0 HA TYR A 84 7.415 12.411 4.244 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.595 10.069 3.628 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.468 11.044 2.462 1.00 0.00 H new ATOM 0 HD1 TYR A 84 9.089 10.922 4.464 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.491 8.098 2.508 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.967 9.304 4.298 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.382 6.503 2.297 1.00 0.00 H new ATOM 0 HH TYR A 84 10.524 6.110 2.707 1.00 0.00 H new ATOM 1361 N ASN A 85 5.129 13.691 5.122 1.00 0.00 N ATOM 1362 CA ASN A 85 3.898 14.463 5.222 1.00 0.00 C ATOM 1363 C ASN A 85 3.455 15.010 3.862 1.00 0.00 C ATOM 1364 O ASN A 85 2.264 15.049 3.549 1.00 0.00 O ATOM 1365 CB ASN A 85 4.087 15.584 6.247 1.00 0.00 C ATOM 1366 CG ASN A 85 2.737 16.135 6.676 1.00 0.00 C ATOM 1367 OD1 ASN A 85 2.349 17.228 6.278 1.00 0.00 O ATOM 1368 ND2 ASN A 85 2.019 15.370 7.490 1.00 0.00 N ATOM 0 H ASN A 85 5.875 14.034 5.726 1.00 0.00 H new ATOM 0 HA ASN A 85 3.098 13.804 5.560 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.626 15.206 7.115 1.00 0.00 H new ATOM 0 HB3 ASN A 85 4.694 16.381 5.817 1.00 0.00 H new ATOM 0 HD21 ASN A 85 1.103 15.685 7.810 1.00 0.00 H new ATOM 0 HD22 ASN A 85 2.383 14.467 7.795 1.00 0.00 H new ATOM 1375 N GLU A 86 4.434 15.376 3.028 1.00 0.00 N ATOM 1376 CA GLU A 86 4.234 15.747 1.635 1.00 0.00 C ATOM 1377 C GLU A 86 3.340 14.732 0.908 1.00 0.00 C ATOM 1378 O GLU A 86 2.448 15.122 0.164 1.00 0.00 O ATOM 1379 CB GLU A 86 5.604 15.881 0.955 1.00 0.00 C ATOM 1380 CG GLU A 86 5.487 16.433 -0.472 1.00 0.00 C ATOM 1381 CD GLU A 86 6.862 16.596 -1.111 1.00 0.00 C ATOM 1382 OE1 GLU A 86 7.410 15.560 -1.545 1.00 0.00 O ATOM 1383 OE2 GLU A 86 7.346 17.748 -1.138 1.00 0.00 O ATOM 0 H GLU A 86 5.411 15.422 3.317 1.00 0.00 H new ATOM 0 HA GLU A 86 3.716 16.705 1.588 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.240 16.539 1.547 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.092 14.907 0.928 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.879 15.760 -1.077 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.975 17.395 -0.452 1.00 0.00 H new ATOM 1390 N ALA A 87 3.568 13.433 1.121 1.00 0.00 N ATOM 1391 CA ALA A 87 2.763 12.380 0.520 1.00 0.00 C ATOM 1392 C ALA A 87 1.308 12.481 0.975 1.00 0.00 C ATOM 1393 O ALA A 87 0.406 12.277 0.166 1.00 0.00 O ATOM 1394 CB ALA A 87 3.344 11.001 0.851 1.00 0.00 C ATOM 0 H ALA A 87 4.319 13.087 1.718 1.00 0.00 H new ATOM 0 HA ALA A 87 2.786 12.509 -0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.728 10.227 0.393 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.361 10.932 0.464 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.357 10.862 1.932 1.00 0.00 H new ATOM 1400 N LEU A 88 1.068 12.804 2.251 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.289 13.007 2.743 1.00 0.00 C ATOM 1402 C LEU A 88 -0.925 14.182 2.002 1.00 0.00 C ATOM 1403 O LEU A 88 -2.018 14.059 1.458 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.335 13.225 4.264 1.00 0.00 C ATOM 1405 CG LEU A 88 0.347 12.146 5.123 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -0.084 12.344 6.581 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -0.006 10.719 4.700 1.00 0.00 C ATOM 0 H LEU A 88 1.796 12.929 2.955 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.859 12.099 2.547 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.129 14.186 4.487 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.379 13.297 4.569 1.00 0.00 H new ATOM 0 HG LEU A 88 1.423 12.261 4.992 1.00 0.00 H new ATOM 0 HD11 LEU A 88 0.390 11.587 7.206 1.00 0.00 H new ATOM 0 HD12 LEU A 88 0.219 13.335 6.918 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.167 12.250 6.656 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.509 10.010 5.348 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.083 10.571 4.783 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.304 10.559 3.667 1.00 0.00 H new ATOM 1479 N SER B 3 9.958 2.955 -5.701 1.00 0.00 N ATOM 1480 CA SER B 3 8.753 3.228 -6.470 1.00 0.00 C ATOM 1481 C SER B 3 7.606 2.223 -6.248 1.00 0.00 C ATOM 1482 O SER B 3 6.542 2.661 -5.817 1.00 0.00 O ATOM 1483 CB SER B 3 9.136 3.418 -7.944 1.00 0.00 C ATOM 1484 OG SER B 3 10.425 4.011 -8.004 1.00 0.00 O ATOM 0 HA SER B 3 8.321 4.156 -6.097 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.136 2.459 -8.462 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.405 4.051 -8.446 1.00 0.00 H new ATOM 0 HG SER B 3 10.878 3.896 -7.143 1.00 0.00 H new ATOM 1490 N PRO B 4 7.783 0.909 -6.496 1.00 0.00 N ATOM 1491 CA PRO B 4 6.792 -0.119 -6.194 1.00 0.00 C ATOM 1492 C PRO B 4 6.171 -0.003 -4.798 1.00 0.00 C ATOM 1493 O PRO B 4 4.955 -0.134 -4.663 1.00 0.00 O ATOM 1494 CB PRO B 4 7.489 -1.472 -6.396 1.00 0.00 C ATOM 1495 CG PRO B 4 8.975 -1.122 -6.460 1.00 0.00 C ATOM 1496 CD PRO B 4 8.942 0.266 -7.088 1.00 0.00 C ATOM 0 HA PRO B 4 5.940 -0.001 -6.864 1.00 0.00 H new ATOM 0 HB2 PRO B 4 7.276 -2.156 -5.575 1.00 0.00 H new ATOM 0 HB3 PRO B 4 7.155 -1.959 -7.312 1.00 0.00 H new ATOM 0 HG2 PRO B 4 9.436 -1.113 -5.472 1.00 0.00 H new ATOM 0 HG3 PRO B 4 9.536 -1.832 -7.067 1.00 0.00 H new ATOM 0 HD2 PRO B 4 9.856 0.820 -6.873 1.00 0.00 H new ATOM 0 HD3 PRO B 4 8.852 0.208 -8.173 1.00 0.00 H new ATOM 1504 N LEU B 5 6.968 0.237 -3.753 1.00 0.00 N ATOM 1505 CA LEU B 5 6.392 0.402 -2.426 1.00 0.00 C ATOM 1506 C LEU B 5 5.733 1.776 -2.322 1.00 0.00 C ATOM 1507 O LEU B 5 4.609 1.885 -1.835 1.00 0.00 O ATOM 1508 CB LEU B 5 7.436 0.187 -1.324 1.00 0.00 C ATOM 1509 CG LEU B 5 6.805 0.303 0.077 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.699 -0.727 0.319 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.862 0.095 1.157 1.00 0.00 C ATOM 0 H LEU B 5 7.984 0.319 -3.800 1.00 0.00 H new ATOM 0 HA LEU B 5 5.629 -0.362 -2.279 1.00 0.00 H new ATOM 0 HB2 LEU B 5 7.892 -0.796 -1.439 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.234 0.922 -1.428 1.00 0.00 H new ATOM 0 HG LEU B 5 6.375 1.304 0.126 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.293 -0.596 1.322 1.00 0.00 H new ATOM 0 HD12 LEU B 5 4.905 -0.588 -0.415 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.110 -1.732 0.223 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.399 0.180 2.140 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.303 -0.896 1.048 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.640 0.852 1.055 1.00 0.00 H new ATOM 1523 N ASP B 6 6.432 2.820 -2.782 1.00 0.00 N ATOM 1524 CA ASP B 6 5.961 4.199 -2.707 1.00 0.00 C ATOM 1525 C ASP B 6 4.549 4.318 -3.270 1.00 0.00 C ATOM 1526 O ASP B 6 3.688 4.913 -2.631 1.00 0.00 O ATOM 1527 CB ASP B 6 6.894 5.163 -3.450 1.00 0.00 C ATOM 1528 CG ASP B 6 8.312 5.207 -2.893 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.471 4.947 -1.680 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.217 5.513 -3.698 1.00 0.00 O ATOM 0 H ASP B 6 7.348 2.726 -3.220 1.00 0.00 H new ATOM 0 HA ASP B 6 5.955 4.477 -1.653 1.00 0.00 H new ATOM 0 HB2 ASP B 6 6.936 4.874 -4.500 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.468 6.166 -3.412 1.00 0.00 H new ATOM 1535 N GLN B 7 4.298 3.752 -4.453 1.00 0.00 N ATOM 1536 CA GLN B 7 2.966 3.780 -5.040 1.00 0.00 C ATOM 1537 C GLN B 7 1.949 3.065 -4.146 1.00 0.00 C ATOM 1538 O GLN B 7 0.827 3.537 -3.992 1.00 0.00 O ATOM 1539 CB GLN B 7 2.974 3.243 -6.479 1.00 0.00 C ATOM 1540 CG GLN B 7 3.397 1.775 -6.610 1.00 0.00 C ATOM 1541 CD GLN B 7 3.494 1.364 -8.073 1.00 0.00 C ATOM 1542 OE1 GLN B 7 4.583 1.253 -8.627 1.00 0.00 O ATOM 1543 NE2 GLN B 7 2.354 1.143 -8.723 1.00 0.00 N ATOM 0 H GLN B 7 4.999 3.272 -5.017 1.00 0.00 H new ATOM 0 HA GLN B 7 2.647 4.821 -5.102 1.00 0.00 H new ATOM 0 HB2 GLN B 7 1.976 3.359 -6.902 1.00 0.00 H new ATOM 0 HB3 GLN B 7 3.647 3.856 -7.078 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.360 1.625 -6.122 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.677 1.138 -6.096 1.00 0.00 H new ATOM 0 HE21 GLN B 7 1.463 1.243 -8.237 1.00 0.00 H new ATOM 0 HE22 GLN B 7 2.372 0.874 -9.707 1.00 0.00 H new ATOM 1552 N ALA B 8 2.327 1.935 -3.542 1.00 0.00 N ATOM 1553 CA ALA B 8 1.421 1.186 -2.686 1.00 0.00 C ATOM 1554 C ALA B 8 1.059 1.991 -1.440 1.00 0.00 C ATOM 1555 O ALA B 8 -0.123 2.212 -1.181 1.00 0.00 O ATOM 1556 CB ALA B 8 2.010 -0.173 -2.334 1.00 0.00 C ATOM 0 H ALA B 8 3.256 1.524 -3.634 1.00 0.00 H new ATOM 0 HA ALA B 8 0.496 1.007 -3.235 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.315 -0.716 -1.693 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.182 -0.743 -3.247 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.955 -0.035 -1.809 1.00 0.00 H new ATOM 1562 N ILE B 9 2.051 2.460 -0.674 1.00 0.00 N ATOM 1563 CA ILE B 9 1.748 3.310 0.476 1.00 0.00 C ATOM 1564 C ILE B 9 0.977 4.550 -0.001 1.00 0.00 C ATOM 1565 O ILE B 9 -0.041 4.916 0.582 1.00 0.00 O ATOM 1566 CB ILE B 9 2.992 3.611 1.343 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.096 4.392 0.617 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.531 2.297 1.927 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.266 4.768 1.535 1.00 0.00 C ATOM 0 H ILE B 9 3.042 2.271 -0.825 1.00 0.00 H new ATOM 0 HA ILE B 9 1.095 2.772 1.163 1.00 0.00 H new ATOM 0 HB ILE B 9 2.667 4.275 2.144 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.471 3.794 -0.214 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.670 5.300 0.189 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.409 2.504 2.539 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.762 1.829 2.542 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.806 1.624 1.115 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.014 5.318 0.964 1.00 0.00 H new ATOM 0 HD12 ILE B 9 4.902 5.391 2.352 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.715 3.862 1.942 1.00 0.00 H new ATOM 1581 N GLY B 10 1.412 5.131 -1.122 1.00 0.00 N ATOM 1582 CA GLY B 10 0.736 6.191 -1.854 1.00 0.00 C ATOM 1583 C GLY B 10 -0.752 5.907 -2.041 1.00 0.00 C ATOM 1584 O GLY B 10 -1.574 6.800 -1.859 1.00 0.00 O ATOM 0 H GLY B 10 2.291 4.857 -1.561 1.00 0.00 H new ATOM 0 HA2 GLY B 10 0.860 7.134 -1.321 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.206 6.313 -2.830 1.00 0.00 H new ATOM 1588 N LEU B 11 -1.109 4.674 -2.399 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.488 4.256 -2.596 1.00 0.00 C ATOM 1590 C LEU B 11 -3.288 4.473 -1.305 1.00 0.00 C ATOM 1591 O LEU B 11 -4.240 5.251 -1.288 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.501 2.788 -3.062 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.735 2.343 -3.856 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -5.035 2.606 -3.109 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.751 2.949 -5.262 1.00 0.00 C ATOM 0 H LEU B 11 -0.433 3.928 -2.562 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.967 4.857 -3.369 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.617 2.615 -3.676 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.409 2.149 -2.184 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.660 1.262 -3.970 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.877 2.272 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -5.029 2.061 -2.165 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -5.131 3.673 -2.911 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.640 2.611 -5.794 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.763 4.037 -5.189 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.861 2.632 -5.805 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.889 3.803 -0.217 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.523 3.931 1.094 1.00 0.00 C ATOM 1609 C LEU B 12 -3.611 5.403 1.494 1.00 0.00 C ATOM 1610 O LEU B 12 -4.650 5.863 1.977 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.709 3.176 2.163 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.898 1.651 2.180 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.334 0.953 0.939 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.204 1.065 3.415 1.00 0.00 C ATOM 0 H LEU B 12 -2.106 3.149 -0.226 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.524 3.504 1.029 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.652 3.392 2.010 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.976 3.569 3.144 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.974 1.475 2.198 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.502 -0.121 1.018 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.834 1.334 0.048 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.264 1.149 0.866 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.337 -0.017 3.428 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.140 1.299 3.380 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.641 1.495 4.316 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.503 6.122 1.314 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.389 7.526 1.659 1.00 0.00 C ATOM 1628 C ILE B 13 -3.439 8.332 0.902 1.00 0.00 C ATOM 1629 O ILE B 13 -4.219 9.039 1.526 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.952 8.008 1.393 1.00 0.00 C ATOM 1631 CG1 ILE B 13 0.001 7.406 2.439 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.852 9.534 1.417 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.465 7.469 1.991 1.00 0.00 C ATOM 0 H ILE B 13 -1.648 5.732 0.917 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.584 7.674 2.721 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.667 7.672 0.396 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.112 7.941 3.382 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.276 6.368 2.626 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.178 9.834 1.225 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.501 9.953 0.648 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.161 9.904 2.395 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.100 7.032 2.762 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.586 6.911 1.062 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.752 8.508 1.830 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.481 8.216 -0.424 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.440 8.918 -1.259 1.00 0.00 C ATOM 1647 C GLY B 14 -5.866 8.572 -0.842 1.00 0.00 C ATOM 1648 O GLY B 14 -6.675 9.468 -0.593 1.00 0.00 O ATOM 0 H GLY B 14 -2.840 7.623 -0.951 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -4.282 9.994 -1.179 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -4.285 8.650 -2.304 1.00 0.00 H new ATOM 1652 N ILE B 15 -6.169 7.271 -0.760 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.470 6.776 -0.330 1.00 0.00 C ATOM 1654 C ILE B 15 -7.906 7.489 0.953 1.00 0.00 C ATOM 1655 O ILE B 15 -9.019 8.003 1.028 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.446 5.233 -0.242 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.775 4.673 -1.640 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.408 4.682 0.813 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.815 3.144 -1.703 1.00 0.00 C ATOM 0 H ILE B 15 -5.508 6.530 -0.994 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.237 7.013 -1.067 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.453 4.915 0.076 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.740 5.065 -1.960 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.032 5.037 -2.350 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.347 3.594 0.828 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.137 5.075 1.793 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.427 4.985 0.570 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -8.053 2.828 -2.719 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.843 2.742 -1.416 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.578 2.772 -1.019 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.019 7.556 1.945 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.323 8.243 3.187 1.00 0.00 C ATOM 1673 C PHE B 16 -7.473 9.750 2.979 1.00 0.00 C ATOM 1674 O PHE B 16 -8.542 10.320 3.194 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.221 7.934 4.207 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.455 8.511 5.587 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.049 9.825 5.888 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -7.084 7.733 6.576 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.282 10.357 7.165 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -7.234 8.237 7.877 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.829 9.548 8.173 1.00 0.00 C ATOM 0 H PHE B 16 -6.088 7.142 1.907 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.281 7.884 3.564 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.118 6.852 4.293 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.274 8.315 3.825 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.558 10.424 5.135 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -7.452 6.747 6.334 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.040 11.389 7.372 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.661 7.616 8.651 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.938 9.934 9.176 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.379 10.393 2.576 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.248 11.836 2.593 1.00 0.00 C ATOM 1693 C HIS B 17 -7.270 12.549 1.717 1.00 0.00 C ATOM 1694 O HIS B 17 -7.687 13.657 2.050 1.00 0.00 O ATOM 1695 CB HIS B 17 -4.803 12.277 2.342 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.442 13.474 3.189 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -4.397 14.784 2.777 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.122 13.448 4.520 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -4.028 15.525 3.835 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.849 14.758 4.925 1.00 0.00 N ATOM 0 H HIS B 17 -5.550 9.913 2.225 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.493 12.159 3.605 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.125 11.453 2.564 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -4.673 12.522 1.288 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -4.605 15.130 1.840 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -4.087 12.569 5.147 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -3.893 16.596 3.813 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.705 11.926 0.618 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.791 12.497 -0.168 1.00 0.00 C ATOM 1710 C LYS B 18 -10.074 12.534 0.668 1.00 0.00 C ATOM 1711 O LYS B 18 -10.777 13.544 0.697 1.00 0.00 O ATOM 1712 CB LYS B 18 -8.997 11.706 -1.464 1.00 0.00 C ATOM 1713 CG LYS B 18 -7.816 11.899 -2.431 1.00 0.00 C ATOM 1714 CD LYS B 18 -8.042 11.249 -3.806 1.00 0.00 C ATOM 1715 CE LYS B 18 -7.634 9.770 -3.885 1.00 0.00 C ATOM 1716 NZ LYS B 18 -8.397 8.923 -2.955 1.00 0.00 N ATOM 0 H LYS B 18 -7.330 11.047 0.262 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.529 13.518 -0.445 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.110 10.647 -1.232 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.920 12.027 -1.946 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -7.637 12.966 -2.566 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -6.916 11.479 -1.982 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -9.097 11.336 -4.066 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -7.481 11.808 -4.555 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -7.782 9.410 -4.903 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -6.570 9.678 -3.665 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -8.249 7.922 -3.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -8.073 9.097 -1.982 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -9.409 9.150 -3.029 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.388 11.431 1.348 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.622 11.305 2.103 1.00 0.00 C ATOM 1732 C TYR B 19 -11.611 12.171 3.359 1.00 0.00 C ATOM 1733 O TYR B 19 -12.597 12.852 3.627 1.00 0.00 O ATOM 1734 CB TYR B 19 -11.927 9.832 2.390 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.896 9.231 1.395 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -14.241 9.634 1.439 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -12.462 8.362 0.378 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -15.159 9.144 0.501 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -13.386 7.859 -0.557 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.740 8.235 -0.478 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.661 7.702 -1.324 1.00 0.00 O ATOM 0 H TYR B 19 -9.791 10.605 1.387 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.440 11.687 1.493 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -10.997 9.263 2.374 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.340 9.740 3.394 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.569 10.326 2.201 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -11.421 8.081 0.315 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -16.189 9.467 0.533 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -13.056 7.185 -1.334 1.00 0.00 H new ATOM 0 HH TYR B 19 -16.391 8.342 -1.459 1.00 0.00 H new ATOM 1751 N SER B 20 -10.519 12.194 4.126 1.00 0.00 N ATOM 1752 CA SER B 20 -10.421 13.154 5.219 1.00 0.00 C ATOM 1753 C SER B 20 -10.462 14.575 4.653 1.00 0.00 C ATOM 1754 O SER B 20 -11.222 15.409 5.134 1.00 0.00 O ATOM 1755 CB SER B 20 -9.148 12.912 6.019 1.00 0.00 C ATOM 1756 OG SER B 20 -8.080 12.771 5.120 1.00 0.00 O ATOM 0 H SER B 20 -9.714 11.578 4.014 1.00 0.00 H new ATOM 0 HA SER B 20 -11.266 13.027 5.896 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.964 13.743 6.699 1.00 0.00 H new ATOM 0 HB3 SER B 20 -9.249 12.016 6.631 1.00 0.00 H new ATOM 0 HG SER B 20 -7.463 12.085 5.450 1.00 0.00 H new ATOM 1762 N GLY B 21 -9.679 14.841 3.602 1.00 0.00 N ATOM 1763 CA GLY B 21 -9.700 16.094 2.860 1.00 0.00 C ATOM 1764 C GLY B 21 -11.126 16.569 2.576 1.00 0.00 C ATOM 1765 O GLY B 21 -11.449 17.730 2.822 1.00 0.00 O ATOM 0 H GLY B 21 -9.000 14.172 3.240 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.169 16.859 3.426 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.166 15.966 1.918 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.426 14.843 8.590 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.827 13.592 9.046 1.00 0.00 C ATOM 1849 C HIS B 27 -5.741 12.743 9.937 1.00 0.00 C ATOM 1850 O HIS B 27 -5.275 11.783 10.557 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.471 13.882 9.702 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.493 14.630 8.824 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.574 14.823 7.459 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.340 15.233 9.252 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.496 15.528 7.085 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -0.711 15.801 8.141 1.00 0.00 N ATOM 0 HA HIS B 27 -4.672 12.969 8.165 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.638 14.460 10.611 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.019 12.937 10.004 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -3.318 14.490 6.846 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -0.980 15.264 10.270 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.287 15.835 6.071 1.00 0.00 H new ATOM 1864 N THR B 28 -7.040 13.047 9.963 1.00 0.00 N ATOM 1865 CA THR B 28 -8.057 12.264 10.653 1.00 0.00 C ATOM 1866 C THR B 28 -9.314 12.145 9.793 1.00 0.00 C ATOM 1867 O THR B 28 -9.598 13.021 8.982 1.00 0.00 O ATOM 1868 CB THR B 28 -8.314 12.802 12.068 1.00 0.00 C ATOM 1869 OG1 THR B 28 -9.175 11.923 12.760 1.00 0.00 O ATOM 1870 CG2 THR B 28 -8.932 14.200 12.084 1.00 0.00 C ATOM 0 H THR B 28 -7.420 13.867 9.491 1.00 0.00 H new ATOM 0 HA THR B 28 -7.690 11.248 10.797 1.00 0.00 H new ATOM 0 HB THR B 28 -7.340 12.869 12.552 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.839 11.006 12.681 1.00 0.00 H new ATOM 0 HG21 THR B 28 -9.086 14.518 13.115 1.00 0.00 H new ATOM 0 HG22 THR B 28 -8.262 14.900 11.585 1.00 0.00 H new ATOM 0 HG23 THR B 28 -9.889 14.181 11.563 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.024 11.021 9.915 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.113 10.646 9.028 1.00 0.00 C ATOM 1880 C LEU B 29 -12.286 10.176 9.891 1.00 0.00 C ATOM 1881 O LEU B 29 -12.135 9.274 10.715 1.00 0.00 O ATOM 1882 CB LEU B 29 -10.568 9.576 8.067 1.00 0.00 C ATOM 1883 CG LEU B 29 -11.189 9.580 6.663 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.191 8.957 5.683 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -12.481 8.772 6.620 1.00 0.00 C ATOM 0 H LEU B 29 -9.849 10.336 10.650 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.486 11.470 8.420 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -9.491 9.712 7.971 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -10.727 8.595 8.514 1.00 0.00 H new ATOM 0 HG LEU B 29 -11.418 10.611 6.393 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -10.619 8.953 4.681 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.270 9.540 5.682 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -9.972 7.934 5.988 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -12.892 8.797 5.611 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -12.274 7.740 6.902 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -13.202 9.201 7.316 1.00 0.00 H new ATOM 1897 N SER B 30 -13.441 10.831 9.764 1.00 0.00 N ATOM 1898 CA SER B 30 -14.579 10.604 10.642 1.00 0.00 C ATOM 1899 C SER B 30 -15.350 9.333 10.260 1.00 0.00 C ATOM 1900 O SER B 30 -15.105 8.720 9.222 1.00 0.00 O ATOM 1901 CB SER B 30 -15.474 11.850 10.615 1.00 0.00 C ATOM 1902 OG SER B 30 -15.771 12.210 9.280 1.00 0.00 O ATOM 0 H SER B 30 -13.609 11.535 9.046 1.00 0.00 H new ATOM 0 HA SER B 30 -14.224 10.440 11.659 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.397 11.655 11.161 1.00 0.00 H new ATOM 0 HB3 SER B 30 -14.974 12.677 11.119 1.00 0.00 H new ATOM 0 HG SER B 30 -16.344 13.005 9.275 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.295 8.935 11.118 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.974 7.649 11.062 1.00 0.00 C ATOM 1910 C LYS B 31 -17.674 7.422 9.720 1.00 0.00 C ATOM 1911 O LYS B 31 -17.364 6.486 8.983 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.981 7.558 12.221 1.00 0.00 C ATOM 1913 CG LYS B 31 -17.374 7.802 13.610 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.419 7.428 14.672 1.00 0.00 C ATOM 1915 CE LYS B 31 -18.044 7.933 16.068 1.00 0.00 C ATOM 1916 NZ LYS B 31 -16.748 7.403 16.517 1.00 0.00 N ATOM 0 H LYS B 31 -16.613 9.520 11.891 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.224 6.864 11.160 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.776 8.284 12.053 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -18.443 6.571 12.208 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -16.472 7.204 13.739 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.082 8.847 13.717 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -19.386 7.842 14.387 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -18.532 6.344 14.700 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.007 9.022 16.061 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -18.819 7.644 16.778 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -16.493 7.835 17.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -16.815 6.371 16.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -16.018 7.627 15.811 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.650 8.271 9.399 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.438 8.082 8.187 1.00 0.00 C ATOM 1932 C LYS B 32 -18.589 8.368 6.946 1.00 0.00 C ATOM 1933 O LYS B 32 -18.787 7.754 5.900 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.750 8.878 8.267 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.642 8.678 7.030 1.00 0.00 C ATOM 1936 CD LYS B 32 -21.388 9.724 5.932 1.00 0.00 C ATOM 1937 CE LYS B 32 -21.933 9.221 4.591 1.00 0.00 C ATOM 1938 NZ LYS B 32 -21.680 10.189 3.510 1.00 0.00 N ATOM 0 H LYS B 32 -18.910 9.086 9.955 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.740 7.039 8.096 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.299 8.576 9.159 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.521 9.938 8.377 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -21.470 7.682 6.622 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -22.688 8.723 7.332 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -21.867 10.666 6.198 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -20.320 9.923 5.848 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -21.468 8.267 4.343 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -23.005 9.041 4.677 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -21.455 9.678 2.632 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -22.527 10.774 3.363 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -20.879 10.799 3.771 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.614 9.275 7.048 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.688 9.497 5.951 1.00 0.00 C ATOM 1954 C GLU B 33 -15.914 8.203 5.664 1.00 0.00 C ATOM 1955 O GLU B 33 -15.763 7.798 4.512 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.773 10.684 6.281 1.00 0.00 C ATOM 1957 CG GLU B 33 -15.019 11.176 5.040 1.00 0.00 C ATOM 1958 CD GLU B 33 -15.926 11.970 4.100 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.575 11.326 3.247 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -15.975 13.209 4.262 1.00 0.00 O ATOM 0 H GLU B 33 -17.452 9.857 7.870 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.227 9.756 5.040 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.368 11.499 6.693 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.058 10.391 7.050 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.180 11.800 5.348 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -14.602 10.322 4.506 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.462 7.520 6.719 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.840 6.213 6.593 1.00 0.00 C ATOM 1969 C LEU B 34 -15.822 5.235 5.943 1.00 0.00 C ATOM 1970 O LEU B 34 -15.462 4.544 4.989 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.296 5.765 7.963 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.662 4.368 8.019 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.731 3.270 8.085 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.683 4.138 6.861 1.00 0.00 C ATOM 0 H LEU B 34 -15.520 7.862 7.678 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.977 6.249 5.929 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.552 6.492 8.290 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -15.113 5.799 8.683 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.082 4.314 8.940 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.248 2.294 8.124 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.340 3.409 8.978 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.365 3.326 7.200 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.257 3.138 6.938 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.212 4.235 5.913 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.884 4.878 6.908 1.00 0.00 H new ATOM 1986 N LYS B 35 -17.071 5.173 6.419 1.00 0.00 N ATOM 1987 CA LYS B 35 -18.071 4.333 5.764 1.00 0.00 C ATOM 1988 C LYS B 35 -18.113 4.616 4.260 1.00 0.00 C ATOM 1989 O LYS B 35 -18.102 3.680 3.469 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.474 4.535 6.354 1.00 0.00 C ATOM 1991 CG LYS B 35 -19.617 4.094 7.814 1.00 0.00 C ATOM 1992 CD LYS B 35 -19.577 2.571 7.988 1.00 0.00 C ATOM 1993 CE LYS B 35 -20.634 1.813 7.171 1.00 0.00 C ATOM 1994 NZ LYS B 35 -21.975 2.414 7.280 1.00 0.00 N ATOM 0 H LYS B 35 -17.405 5.683 7.237 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.773 3.299 5.938 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.738 5.590 6.278 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -20.192 3.982 5.748 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -18.817 4.542 8.403 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -20.558 4.475 8.212 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -18.588 2.211 7.704 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -19.712 2.334 9.043 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -20.333 1.794 6.124 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -20.676 0.778 7.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -22.695 1.702 7.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -22.127 2.751 8.252 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -22.051 3.215 6.621 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.135 5.891 3.863 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.133 6.277 2.459 1.00 0.00 C ATOM 2010 C GLU B 36 -16.888 5.731 1.743 1.00 0.00 C ATOM 2011 O GLU B 36 -16.994 5.138 0.669 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.252 7.807 2.342 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.719 8.249 0.947 1.00 0.00 C ATOM 2014 CD GLU B 36 -20.154 7.826 0.651 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -21.060 8.418 1.278 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.320 6.924 -0.197 1.00 0.00 O ATOM 0 H GLU B 36 -18.155 6.680 4.509 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.996 5.836 1.961 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.954 8.173 3.091 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.286 8.262 2.561 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.639 9.333 0.867 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -18.056 7.824 0.194 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.706 5.910 2.347 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.447 5.385 1.821 1.00 0.00 C ATOM 2025 C LEU B 37 -14.592 3.900 1.504 1.00 0.00 C ATOM 2026 O LEU B 37 -14.339 3.470 0.377 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.303 5.693 2.806 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.892 5.230 2.391 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.871 6.000 3.237 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.647 3.731 2.631 1.00 0.00 C ATOM 0 H LEU B 37 -15.600 6.427 3.220 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.193 5.877 0.882 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.274 6.770 2.969 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.545 5.233 3.764 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.794 5.419 1.322 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.863 5.690 2.962 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.983 7.069 3.058 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.040 5.789 4.293 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.636 3.473 2.317 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.766 3.508 3.691 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.365 3.148 2.055 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.021 3.119 2.495 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.223 1.689 2.321 1.00 0.00 C ATOM 2044 C ILE B 38 -16.249 1.444 1.216 1.00 0.00 C ATOM 2045 O ILE B 38 -15.982 0.700 0.283 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.652 1.056 3.651 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.499 1.181 4.659 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -16.033 -0.422 3.486 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.908 0.651 6.025 1.00 0.00 C ATOM 0 H ILE B 38 -15.236 3.460 3.432 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.288 1.217 2.018 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.535 1.585 4.010 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.632 0.629 4.296 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.199 2.225 4.745 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -16.330 -0.831 4.452 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.863 -0.508 2.785 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -15.177 -0.978 3.105 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -14.074 0.751 6.719 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.760 1.221 6.396 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -15.184 -0.400 5.940 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.426 2.054 1.317 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.524 1.830 0.390 1.00 0.00 C ATOM 2063 C GLN B 39 -18.114 2.123 -1.055 1.00 0.00 C ATOM 2064 O GLN B 39 -18.649 1.493 -1.967 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.740 2.645 0.843 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.336 2.004 2.108 1.00 0.00 C ATOM 2067 CD GLN B 39 -21.267 2.930 2.882 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -21.438 4.099 2.552 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -21.891 2.410 3.934 1.00 0.00 N ATOM 0 H GLN B 39 -17.644 2.725 2.054 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.800 0.776 0.403 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.447 3.675 1.046 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.487 2.677 0.050 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -20.884 1.105 1.826 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -19.523 1.690 2.763 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -21.734 1.435 4.190 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -22.527 2.986 4.485 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.158 3.033 -1.274 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.573 3.228 -2.592 1.00 0.00 C ATOM 2080 C LYS B 40 -15.533 2.160 -2.925 1.00 0.00 C ATOM 2081 O LYS B 40 -15.647 1.486 -3.947 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.024 4.655 -2.723 1.00 0.00 C ATOM 2083 CG LYS B 40 -15.569 4.946 -4.164 1.00 0.00 C ATOM 2084 CD LYS B 40 -15.103 6.394 -4.366 1.00 0.00 C ATOM 2085 CE LYS B 40 -16.280 7.380 -4.410 1.00 0.00 C ATOM 2086 NZ LYS B 40 -15.808 8.775 -4.426 1.00 0.00 N ATOM 0 H LYS B 40 -16.777 3.643 -0.551 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.360 3.108 -3.337 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.792 5.371 -2.430 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.185 4.789 -2.040 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -14.756 4.269 -4.426 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -16.391 4.736 -4.848 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -14.427 6.673 -3.557 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -14.536 6.466 -5.294 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -16.885 7.188 -5.296 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -16.923 7.221 -3.544 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -16.625 9.418 -4.456 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -15.251 8.963 -3.568 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -15.214 8.931 -5.265 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.490 2.034 -2.105 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.398 1.120 -2.398 1.00 0.00 C ATOM 2102 C GLU B 41 -13.908 -0.320 -2.273 1.00 0.00 C ATOM 2103 O GLU B 41 -14.091 -1.047 -3.246 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.233 1.435 -1.440 1.00 0.00 C ATOM 2105 CG GLU B 41 -10.966 0.605 -1.700 1.00 0.00 C ATOM 2106 CD GLU B 41 -10.257 0.937 -3.013 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.481 2.052 -3.532 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -9.460 0.080 -3.451 1.00 0.00 O ATOM 0 H GLU B 41 -14.383 2.555 -1.235 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.029 1.240 -3.417 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -11.985 2.493 -1.522 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -12.563 1.264 -0.415 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -10.270 0.758 -0.875 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.232 -0.452 -1.701 1.00 0.00 H new ATOM 2115 N LEU B 42 -14.193 -0.724 -1.044 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.617 -2.070 -0.699 1.00 0.00 C ATOM 2117 C LEU B 42 -16.137 -2.118 -0.836 1.00 0.00 C ATOM 2118 O LEU B 42 -16.868 -2.295 0.139 1.00 0.00 O ATOM 2119 CB LEU B 42 -14.145 -2.419 0.720 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.634 -2.239 0.955 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.296 -2.596 2.408 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -11.797 -3.113 0.015 1.00 0.00 C ATOM 0 H LEU B 42 -14.133 -0.104 -0.236 1.00 0.00 H new ATOM 0 HA LEU B 42 -14.176 -2.813 -1.363 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.687 -1.797 1.432 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -14.412 -3.454 0.933 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.391 -1.197 0.750 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.226 -2.469 2.575 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -12.849 -1.941 3.082 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.572 -3.632 2.602 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.738 -2.953 0.217 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -12.043 -4.162 0.178 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -12.014 -2.846 -1.019 1.00 0.00 H new ATOM 2243 N ASP B 50 -23.086 -4.258 5.214 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.813 -2.969 5.828 1.00 0.00 C ATOM 2245 C ASP B 50 -22.902 -3.052 7.357 1.00 0.00 C ATOM 2246 O ASP B 50 -22.213 -2.306 8.045 1.00 0.00 O ATOM 2247 CB ASP B 50 -23.712 -1.869 5.259 1.00 0.00 C ATOM 2248 CG ASP B 50 -23.174 -0.494 5.642 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -22.145 -0.104 5.043 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -23.789 0.149 6.519 1.00 0.00 O ATOM 0 HA ASP B 50 -21.788 -2.696 5.579 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -23.764 -1.957 4.174 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -24.727 -1.988 5.637 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.696 -3.986 7.897 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.687 -4.303 9.323 1.00 0.00 C ATOM 2257 C ALA B 51 -22.272 -4.655 9.806 1.00 0.00 C ATOM 2258 O ALA B 51 -21.801 -4.141 10.819 1.00 0.00 O ATOM 2259 CB ALA B 51 -24.656 -5.458 9.591 1.00 0.00 C ATOM 0 H ALA B 51 -24.360 -4.540 7.355 1.00 0.00 H new ATOM 0 HA ALA B 51 -24.011 -3.424 9.881 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -24.652 -5.697 10.654 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.662 -5.167 9.289 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -24.345 -6.333 9.021 1.00 0.00 H new ATOM 2265 N GLU B 52 -21.571 -5.523 9.070 1.00 0.00 N ATOM 2266 CA GLU B 52 -20.185 -5.850 9.369 1.00 0.00 C ATOM 2267 C GLU B 52 -19.337 -4.588 9.217 1.00 0.00 C ATOM 2268 O GLU B 52 -18.486 -4.295 10.057 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.677 -6.969 8.448 1.00 0.00 C ATOM 2270 CG GLU B 52 -20.565 -8.220 8.503 1.00 0.00 C ATOM 2271 CD GLU B 52 -20.001 -9.327 7.619 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -20.276 -9.279 6.399 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -19.295 -10.195 8.174 1.00 0.00 O ATOM 0 H GLU B 52 -21.950 -6.012 8.259 1.00 0.00 H new ATOM 0 HA GLU B 52 -20.109 -6.215 10.393 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.635 -6.601 7.423 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.659 -7.236 8.733 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -20.640 -8.573 9.532 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -21.575 -7.969 8.178 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.586 -3.825 8.148 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.862 -2.583 7.929 1.00 0.00 C ATOM 2282 C ILE B 53 -18.995 -1.637 9.125 1.00 0.00 C ATOM 2283 O ILE B 53 -17.988 -1.065 9.518 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.222 -1.902 6.600 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -19.052 -2.827 5.381 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.358 -0.649 6.414 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.667 -3.466 5.275 1.00 0.00 C ATOM 0 H ILE B 53 -20.277 -4.048 7.432 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.809 -2.850 7.843 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.278 -1.638 6.656 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.802 -3.616 5.429 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.248 -2.255 4.474 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.615 -0.167 5.471 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.539 0.043 7.236 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.305 -0.931 6.403 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.627 -4.103 4.391 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -16.911 -2.685 5.194 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.474 -4.067 6.164 1.00 0.00 H new ATOM 2299 N VAL B 54 -20.177 -1.448 9.723 1.00 0.00 N ATOM 2300 CA VAL B 54 -20.274 -0.565 10.889 1.00 0.00 C ATOM 2301 C VAL B 54 -19.500 -1.109 12.097 1.00 0.00 C ATOM 2302 O VAL B 54 -18.933 -0.324 12.857 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.705 -0.120 11.244 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -22.214 0.917 10.235 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.701 -1.266 11.385 1.00 0.00 C ATOM 0 H VAL B 54 -21.054 -1.880 9.430 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.779 0.357 10.582 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.636 0.333 12.233 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -23.227 1.219 10.503 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.560 1.789 10.248 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -22.218 0.481 9.236 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.683 -0.866 11.636 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.761 -1.813 10.444 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -22.371 -1.939 12.176 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.417 -2.430 12.281 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.533 -2.975 13.311 1.00 0.00 C ATOM 2317 C LYS B 55 -17.077 -2.598 12.999 1.00 0.00 C ATOM 2318 O LYS B 55 -16.359 -2.067 13.847 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.734 -4.493 13.442 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.789 -5.159 14.456 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.890 -4.535 15.856 1.00 0.00 C ATOM 2322 CE LYS B 55 -17.153 -5.378 16.903 1.00 0.00 C ATOM 2323 NZ LYS B 55 -15.712 -5.483 16.613 1.00 0.00 N ATOM 0 H LYS B 55 -19.937 -3.125 11.745 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.783 -2.540 14.279 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.765 -4.689 13.737 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.588 -4.955 12.466 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -18.020 -6.222 14.519 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.762 -5.077 14.099 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -17.471 -3.529 15.838 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -18.939 -4.439 16.138 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -17.293 -4.935 17.889 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -17.590 -6.376 16.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -15.249 -6.047 17.354 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -15.576 -5.945 15.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -15.293 -4.532 16.589 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.642 -2.851 11.766 1.00 0.00 N ATOM 2338 CA LEU B 56 -15.297 -2.510 11.318 1.00 0.00 C ATOM 2339 C LEU B 56 -15.030 -0.997 11.438 1.00 0.00 C ATOM 2340 O LEU B 56 -13.948 -0.594 11.860 1.00 0.00 O ATOM 2341 CB LEU B 56 -15.092 -3.109 9.919 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.830 -2.619 9.192 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.212 -3.734 8.342 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.217 -1.497 8.233 1.00 0.00 C ATOM 0 H LEU B 56 -17.214 -3.299 11.050 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.539 -2.951 11.966 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.047 -4.195 10.006 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.963 -2.874 9.306 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.116 -2.288 9.947 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.321 -3.357 7.840 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.940 -4.572 8.983 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -13.935 -4.067 7.597 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.328 -1.142 7.711 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.938 -1.872 7.507 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.661 -0.675 8.795 1.00 0.00 H new ATOM 2356 N MET B 57 -16.016 -0.156 11.116 1.00 0.00 N ATOM 2357 CA MET B 57 -15.977 1.290 11.298 1.00 0.00 C ATOM 2358 C MET B 57 -15.736 1.591 12.770 1.00 0.00 C ATOM 2359 O MET B 57 -14.814 2.336 13.089 1.00 0.00 O ATOM 2360 CB MET B 57 -17.303 1.909 10.837 1.00 0.00 C ATOM 2361 CG MET B 57 -17.452 3.422 11.082 1.00 0.00 C ATOM 2362 SD MET B 57 -19.155 3.987 11.346 1.00 0.00 S ATOM 2363 CE MET B 57 -19.481 3.338 13.002 1.00 0.00 C ATOM 0 H MET B 57 -16.893 -0.479 10.707 1.00 0.00 H new ATOM 0 HA MET B 57 -15.172 1.719 10.702 1.00 0.00 H new ATOM 0 HB2 MET B 57 -17.421 1.719 9.770 1.00 0.00 H new ATOM 0 HB3 MET B 57 -18.119 1.395 11.345 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.855 3.695 11.952 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.035 3.957 10.228 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.399 3.778 13.391 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.590 2.255 12.953 1.00 0.00 H new ATOM 0 HE3 MET B 57 -18.650 3.590 13.661 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.563 1.025 13.655 1.00 0.00 N ATOM 2374 CA ASP B 58 -16.396 1.195 15.089 1.00 0.00 C ATOM 2375 C ASP B 58 -14.958 0.873 15.475 1.00 0.00 C ATOM 2376 O ASP B 58 -14.308 1.688 16.116 1.00 0.00 O ATOM 2377 CB ASP B 58 -17.400 0.350 15.879 1.00 0.00 C ATOM 2378 CG ASP B 58 -17.181 0.516 17.380 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.759 1.474 17.935 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.435 -0.316 17.942 1.00 0.00 O ATOM 0 H ASP B 58 -17.358 0.442 13.394 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.601 2.234 15.346 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.416 0.647 15.620 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.295 -0.700 15.605 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.442 -0.281 15.047 1.00 0.00 N ATOM 2386 CA ASP B 59 -13.058 -0.654 15.326 1.00 0.00 C ATOM 2387 C ASP B 59 -12.086 0.426 14.832 1.00 0.00 C ATOM 2388 O ASP B 59 -11.247 0.905 15.593 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.722 -2.025 14.720 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.638 -3.147 15.204 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.999 -3.126 16.401 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -13.949 -4.027 14.371 1.00 0.00 O ATOM 0 H ASP B 59 -14.963 -0.971 14.506 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.944 -0.733 16.407 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.785 -1.958 13.634 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.690 -2.278 14.964 1.00 0.00 H new ATOM 2397 N LEU B 60 -12.204 0.826 13.561 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.369 1.859 12.959 1.00 0.00 C ATOM 2399 C LEU B 60 -11.393 3.149 13.776 1.00 0.00 C ATOM 2400 O LEU B 60 -10.344 3.630 14.198 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.803 2.117 11.504 1.00 0.00 C ATOM 2402 CG LEU B 60 -11.071 1.192 10.522 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.878 0.974 9.245 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.733 1.811 10.106 1.00 0.00 C ATOM 0 H LEU B 60 -12.892 0.434 12.918 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.340 1.500 12.955 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.879 1.967 11.413 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.603 3.156 11.243 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.926 0.242 11.037 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.327 0.314 8.575 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.837 0.520 9.494 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.047 1.932 8.753 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.225 1.144 9.410 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.911 2.772 9.624 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -9.110 1.958 10.988 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.572 3.732 13.999 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.659 4.982 14.738 1.00 0.00 C ATOM 2418 C ASP B 61 -12.181 4.798 16.179 1.00 0.00 C ATOM 2419 O ASP B 61 -11.456 5.645 16.693 1.00 0.00 O ATOM 2420 CB ASP B 61 -14.036 5.643 14.598 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.209 4.878 15.200 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.210 4.695 16.435 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.136 4.566 14.420 1.00 0.00 O ATOM 0 H ASP B 61 -13.467 3.360 13.681 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.972 5.700 14.289 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.993 6.628 15.063 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.236 5.800 13.538 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.510 3.666 16.804 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.082 3.328 18.156 1.00 0.00 C ATOM 2430 C ARG B 62 -10.557 3.304 18.231 1.00 0.00 C ATOM 2431 O ARG B 62 -9.988 3.764 19.221 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.711 1.993 18.572 1.00 0.00 C ATOM 2433 CG ARG B 62 -12.352 1.550 19.994 1.00 0.00 C ATOM 2434 CD ARG B 62 -13.100 0.246 20.295 1.00 0.00 C ATOM 2435 NE ARG B 62 -12.762 -0.273 21.625 1.00 0.00 N ATOM 2436 CZ ARG B 62 -13.258 -1.410 22.134 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -14.130 -2.139 21.428 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -12.875 -1.813 23.349 1.00 0.00 N ATOM 0 H ARG B 62 -13.092 2.947 16.374 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.424 4.087 18.860 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -13.795 2.073 18.490 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -12.395 1.220 17.871 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -11.276 1.400 20.085 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -12.628 2.321 20.713 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -14.174 0.419 20.233 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -12.853 -0.499 19.539 1.00 0.00 H new ATOM 0 HE ARG B 62 -12.110 0.264 22.197 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -14.419 -1.830 20.500 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -14.506 -3.003 21.818 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -12.209 -1.257 23.884 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -13.249 -2.677 23.741 1.00 0.00 H new ATOM 2517 N GLU B 67 -12.392 9.547 15.624 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.094 9.788 14.217 1.00 0.00 C ATOM 2519 C GLU B 67 -10.788 9.060 13.918 1.00 0.00 C ATOM 2520 O GLU B 67 -9.808 9.243 14.644 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.944 11.291 13.961 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.204 12.082 14.330 1.00 0.00 C ATOM 2523 CD GLU B 67 -13.064 13.539 13.905 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -13.364 13.813 12.723 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -12.651 14.347 14.764 1.00 0.00 O ATOM 0 HA GLU B 67 -12.896 9.426 13.574 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.100 11.671 14.536 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.712 11.455 12.909 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -14.074 11.638 13.846 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.374 12.026 15.405 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.747 8.236 12.871 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.591 7.376 12.685 1.00 0.00 C ATOM 2534 C VAL B 68 -8.462 8.244 12.135 1.00 0.00 C ATOM 2535 O VAL B 68 -8.597 8.887 11.095 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.900 6.119 11.852 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -10.334 6.374 10.404 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -8.671 5.201 11.868 1.00 0.00 C ATOM 0 H VAL B 68 -11.477 8.150 12.163 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.274 6.952 13.638 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.766 5.656 12.325 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -10.526 5.422 9.909 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -11.242 6.977 10.397 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.542 6.905 9.875 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -8.878 4.306 11.281 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -7.818 5.727 11.440 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -8.443 4.916 12.895 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.377 8.333 12.902 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.218 9.134 12.554 1.00 0.00 C ATOM 2550 C ASN B 69 -5.318 8.319 11.633 1.00 0.00 C ATOM 2551 O ASN B 69 -5.297 7.094 11.717 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.507 9.616 13.821 1.00 0.00 C ATOM 2553 CG ASN B 69 -6.171 10.856 14.412 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -5.545 11.905 14.507 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -7.440 10.777 14.815 1.00 0.00 N ATOM 0 H ASN B 69 -7.283 7.843 13.792 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.517 10.033 12.015 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.506 8.817 14.562 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -4.465 9.838 13.590 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -7.902 11.597 15.209 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -7.948 9.897 14.730 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.611 8.997 10.728 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.882 8.374 9.629 1.00 0.00 C ATOM 2564 C PHE B 70 -3.077 7.128 10.035 1.00 0.00 C ATOM 2565 O PHE B 70 -3.317 6.032 9.526 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.013 9.433 8.943 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.140 8.854 7.856 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.739 8.251 6.735 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.763 8.692 8.086 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.965 7.482 5.852 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.009 7.921 7.205 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.593 7.304 6.096 1.00 0.00 C ATOM 0 H PHE B 70 -4.529 10.014 10.741 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.617 7.991 8.921 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.655 10.203 8.516 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.384 9.920 9.688 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.796 8.380 6.554 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.299 9.161 8.941 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.424 7.028 4.986 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.068 7.801 7.379 1.00 0.00 H new ATOM 0 HZ PHE B 70 -0.001 6.693 5.431 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.118 7.272 10.953 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.259 6.155 11.330 1.00 0.00 C ATOM 2584 C GLN B 71 -2.088 4.991 11.889 1.00 0.00 C ATOM 2585 O GLN B 71 -1.809 3.826 11.616 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.186 6.635 12.315 1.00 0.00 C ATOM 2587 CG GLN B 71 0.936 5.597 12.465 1.00 0.00 C ATOM 2588 CD GLN B 71 2.027 6.054 13.430 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.383 5.334 14.356 1.00 0.00 O ATOM 2590 NE2 GLN B 71 2.570 7.252 13.230 1.00 0.00 N ATOM 0 H GLN B 71 -1.920 8.144 11.443 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.750 5.776 10.444 1.00 0.00 H new ATOM 0 HB2 GLN B 71 0.233 7.580 11.968 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -0.641 6.826 13.287 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.513 4.657 12.819 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.378 5.400 11.488 1.00 0.00 H new ATOM 0 HE21 GLN B 71 2.255 7.831 12.452 1.00 0.00 H new ATOM 0 HE22 GLN B 71 3.301 7.591 13.855 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.126 5.303 12.664 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.037 4.335 13.244 1.00 0.00 C ATOM 2601 C GLU B 72 -4.847 3.631 12.145 1.00 0.00 C ATOM 2602 O GLU B 72 -5.034 2.417 12.195 1.00 0.00 O ATOM 2603 CB GLU B 72 -4.922 5.021 14.297 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.104 5.537 15.499 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.582 6.972 15.373 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.382 7.438 14.228 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -3.394 7.595 16.439 1.00 0.00 O ATOM 0 H GLU B 72 -3.357 6.266 12.909 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.472 3.556 13.756 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.452 5.854 13.836 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.677 4.318 14.649 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.724 5.471 16.393 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.254 4.872 15.651 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.285 4.369 11.124 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.875 3.785 9.925 1.00 0.00 C ATOM 2616 C TYR B 73 -4.907 2.771 9.303 1.00 0.00 C ATOM 2617 O TYR B 73 -5.298 1.634 9.041 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.312 4.894 8.953 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.252 4.544 7.479 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.360 3.949 6.849 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.135 4.931 6.713 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.370 3.790 5.452 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.122 4.714 5.326 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.251 4.166 4.692 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.296 4.083 3.334 1.00 0.00 O ATOM 0 H TYR B 73 -5.239 5.388 11.108 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.778 3.232 10.184 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.335 5.182 9.197 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.685 5.769 9.125 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.202 3.615 7.437 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.287 5.396 7.194 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.240 3.378 4.963 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.246 4.968 4.747 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.687 4.746 2.945 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.642 3.155 9.096 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.643 2.226 8.569 1.00 0.00 C ATOM 2637 C ILE B 74 -2.531 0.997 9.488 1.00 0.00 C ATOM 2638 O ILE B 74 -2.574 -0.138 9.015 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.280 2.915 8.349 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.331 4.129 7.398 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.255 1.885 7.851 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.435 3.783 5.907 1.00 0.00 C ATOM 0 H ILE B 74 -3.291 4.094 9.284 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.972 1.885 7.587 1.00 0.00 H new ATOM 0 HB ILE B 74 -0.978 3.316 9.317 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.184 4.750 7.672 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.436 4.731 7.554 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.707 2.374 7.696 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.145 1.094 8.592 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.599 1.455 6.910 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.465 4.702 5.321 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.569 3.191 5.610 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.345 3.210 5.729 1.00 0.00 H new ATOM 2654 N THR B 75 -2.417 1.213 10.803 1.00 0.00 N ATOM 2655 CA THR B 75 -2.349 0.146 11.805 1.00 0.00 C ATOM 2656 C THR B 75 -3.515 -0.832 11.625 1.00 0.00 C ATOM 2657 O THR B 75 -3.325 -2.054 11.615 1.00 0.00 O ATOM 2658 CB THR B 75 -2.358 0.741 13.224 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.354 1.725 13.362 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.127 -0.327 14.297 1.00 0.00 C ATOM 0 H THR B 75 -2.369 2.149 11.206 1.00 0.00 H new ATOM 0 HA THR B 75 -1.416 -0.401 11.666 1.00 0.00 H new ATOM 0 HB THR B 75 -3.345 1.182 13.365 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.610 2.526 12.859 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.141 0.138 15.283 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.915 -1.078 14.239 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.160 -0.803 14.135 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.727 -0.290 11.484 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.921 -1.086 11.275 1.00 0.00 C ATOM 2670 C PHE B 76 -5.840 -1.837 9.949 1.00 0.00 C ATOM 2671 O PHE B 76 -6.149 -3.020 9.906 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.182 -0.228 11.340 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.439 -1.069 11.221 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.931 -1.421 9.948 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.986 -1.674 12.368 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.993 -2.330 9.827 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.015 -2.625 12.241 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.517 -2.955 10.970 1.00 0.00 C ATOM 0 H PHE B 76 -4.900 0.715 11.513 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.981 -1.817 12.081 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.200 0.322 12.281 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.161 0.511 10.539 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.489 -0.989 9.062 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.615 -1.408 13.347 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.408 -2.549 8.854 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.420 -3.102 13.121 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.304 -3.688 10.873 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.423 -1.192 8.857 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.212 -1.922 7.610 1.00 0.00 C ATOM 2690 C LEU B 77 -4.199 -3.055 7.816 1.00 0.00 C ATOM 2691 O LEU B 77 -4.364 -4.132 7.249 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.839 -0.982 6.457 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.048 -0.175 5.948 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.576 0.866 4.931 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.092 -1.060 5.248 1.00 0.00 C ATOM 0 H LEU B 77 -5.230 -0.192 8.811 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.154 -2.386 7.317 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.060 -0.295 6.788 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.422 -1.565 5.636 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.506 0.289 6.821 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.432 1.437 4.571 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.863 1.541 5.405 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.096 0.363 4.091 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.923 -0.442 4.908 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.634 -1.555 4.392 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.460 -1.811 5.947 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.195 -2.854 8.671 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.322 -3.928 9.120 1.00 0.00 C ATOM 2709 C GLY B 78 -3.127 -5.061 9.765 1.00 0.00 C ATOM 2710 O GLY B 78 -2.956 -6.227 9.404 1.00 0.00 O ATOM 0 H GLY B 78 -2.968 -1.942 9.068 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.754 -4.317 8.275 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.599 -3.538 9.837 1.00 0.00 H new ATOM 2714 N ALA B 79 -4.024 -4.724 10.698 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.937 -5.693 11.300 1.00 0.00 C ATOM 2716 C ALA B 79 -5.706 -6.457 10.216 1.00 0.00 C ATOM 2717 O ALA B 79 -5.731 -7.685 10.205 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.899 -5.029 12.294 1.00 0.00 C ATOM 0 H ALA B 79 -4.135 -3.775 11.054 1.00 0.00 H new ATOM 0 HA ALA B 79 -4.335 -6.407 11.863 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.561 -5.784 12.719 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -5.328 -4.556 13.093 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.493 -4.275 11.777 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.313 -5.724 9.282 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.073 -6.280 8.174 1.00 0.00 C ATOM 2726 C LEU B 80 -6.203 -7.245 7.364 1.00 0.00 C ATOM 2727 O LEU B 80 -6.624 -8.348 7.027 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.620 -5.136 7.303 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.923 -5.499 6.575 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.110 -5.630 7.540 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.253 -4.394 5.566 1.00 0.00 C ATOM 0 H LEU B 80 -6.286 -4.704 9.279 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.919 -6.850 8.557 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.793 -4.262 7.930 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.866 -4.856 6.567 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.768 -6.461 6.086 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -11.008 -5.887 6.979 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.901 -6.412 8.270 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.264 -4.683 8.058 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.177 -4.642 5.044 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.376 -3.447 6.091 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.441 -4.306 4.845 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.969 -6.835 7.074 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.015 -7.639 6.336 1.00 0.00 C ATOM 2745 C ALA B 81 -3.713 -8.948 7.072 1.00 0.00 C ATOM 2746 O ALA B 81 -3.736 -10.005 6.450 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.757 -6.822 6.047 1.00 0.00 C ATOM 0 H ALA B 81 -4.606 -5.923 7.351 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.449 -7.921 5.377 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.045 -7.434 5.492 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.020 -5.945 5.455 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.306 -6.503 6.987 1.00 0.00 H new ATOM 2753 N MET B 82 -3.448 -8.912 8.384 1.00 0.00 N ATOM 2754 CA MET B 82 -3.232 -10.159 9.122 1.00 0.00 C ATOM 2755 C MET B 82 -4.510 -10.995 9.246 1.00 0.00 C ATOM 2756 O MET B 82 -4.436 -12.222 9.220 1.00 0.00 O ATOM 2757 CB MET B 82 -2.491 -9.957 10.450 1.00 0.00 C ATOM 2758 CG MET B 82 -3.247 -9.094 11.458 1.00 0.00 C ATOM 2759 SD MET B 82 -2.396 -8.759 13.023 1.00 0.00 S ATOM 2760 CE MET B 82 -2.297 -10.420 13.726 1.00 0.00 C ATOM 0 H MET B 82 -3.380 -8.060 8.941 1.00 0.00 H new ATOM 0 HA MET B 82 -2.551 -10.757 8.517 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.295 -10.932 10.897 1.00 0.00 H new ATOM 0 HB3 MET B 82 -1.523 -9.498 10.248 1.00 0.00 H new ATOM 0 HG2 MET B 82 -3.481 -8.141 10.985 1.00 0.00 H new ATOM 0 HG3 MET B 82 -4.196 -9.581 11.682 1.00 0.00 H new ATOM 0 HE1 MET B 82 -1.927 -10.360 14.750 1.00 0.00 H new ATOM 0 HE2 MET B 82 -3.287 -10.876 13.724 1.00 0.00 H new ATOM 0 HE3 MET B 82 -1.616 -11.028 13.129 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.685 -10.362 9.346 1.00 0.00 N ATOM 2771 CA ILE B 83 -6.949 -11.085 9.233 1.00 0.00 C ATOM 2772 C ILE B 83 -6.958 -11.822 7.888 1.00 0.00 C ATOM 2773 O ILE B 83 -7.240 -13.023 7.845 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.152 -10.146 9.457 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -8.212 -9.755 10.947 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.468 -10.818 9.033 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -9.132 -8.561 11.223 1.00 0.00 C ATOM 0 H ILE B 83 -5.783 -9.359 9.504 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.045 -11.834 10.019 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.023 -9.255 8.843 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.556 -10.612 11.527 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -7.206 -9.518 11.294 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.298 -10.132 9.203 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.421 -11.076 7.975 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.620 -11.724 9.620 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -9.129 -8.338 12.290 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.776 -7.692 10.670 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -10.147 -8.802 10.906 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.537 -11.157 6.806 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.273 -11.789 5.515 1.00 0.00 C ATOM 2791 C TYR B 84 -4.970 -12.611 5.549 1.00 0.00 C ATOM 2792 O TYR B 84 -4.137 -12.528 4.649 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.241 -10.737 4.391 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.414 -9.775 4.297 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.717 -10.170 4.661 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.206 -8.496 3.744 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.797 -9.287 4.489 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.289 -7.620 3.560 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.584 -8.016 3.929 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.627 -7.156 3.761 1.00 0.00 O ATOM 0 H TYR B 84 -6.369 -10.151 6.806 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.089 -12.481 5.306 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.331 -10.148 4.507 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.160 -11.263 3.440 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.886 -11.154 5.073 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.210 -8.188 3.460 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.791 -9.586 4.787 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.125 -6.641 3.134 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.302 -6.322 3.362 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.833 -13.476 6.556 1.00 0.00 N ATOM 2811 CA ASN B 85 -3.792 -14.480 6.721 1.00 0.00 C ATOM 2812 C ASN B 85 -3.460 -15.188 5.405 1.00 0.00 C ATOM 2813 O ASN B 85 -2.292 -15.414 5.102 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.225 -15.484 7.802 1.00 0.00 C ATOM 2815 CG ASN B 85 -5.418 -16.338 7.373 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -5.251 -17.493 6.998 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -6.633 -15.789 7.392 1.00 0.00 N ATOM 0 H ASN B 85 -5.497 -13.490 7.330 1.00 0.00 H new ATOM 0 HA ASN B 85 -2.877 -13.980 7.038 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -3.385 -16.136 8.043 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -4.480 -14.943 8.713 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -7.443 -16.332 7.091 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -6.753 -14.826 7.707 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.481 -15.503 4.602 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.311 -16.103 3.287 1.00 0.00 C ATOM 2826 C GLU B 86 -3.373 -15.262 2.412 1.00 0.00 C ATOM 2827 O GLU B 86 -2.482 -15.802 1.764 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.680 -16.268 2.617 1.00 0.00 C ATOM 2829 CG GLU B 86 -6.592 -17.214 3.409 1.00 0.00 C ATOM 2830 CD GLU B 86 -7.942 -17.376 2.718 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -8.030 -18.261 1.841 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -8.854 -16.598 3.073 1.00 0.00 O ATOM 0 H GLU B 86 -5.456 -15.345 4.855 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.853 -17.085 3.407 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.159 -15.293 2.525 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.546 -16.654 1.606 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -6.112 -18.187 3.511 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -6.739 -16.825 4.416 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.566 -13.940 2.399 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.707 -13.022 1.666 1.00 0.00 C ATOM 2841 C ALA B 87 -1.300 -13.031 2.258 1.00 0.00 C ATOM 2842 O ALA B 87 -0.326 -13.021 1.510 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.298 -11.608 1.675 1.00 0.00 C ATOM 0 H ALA B 87 -4.326 -13.481 2.900 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.644 -13.352 0.629 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.642 -10.936 1.122 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.282 -11.622 1.206 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.391 -11.259 2.703 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.186 -13.048 3.592 1.00 0.00 N ATOM 2850 CA LEU B 88 0.123 -13.099 4.232 1.00 0.00 C ATOM 2851 C LEU B 88 0.897 -14.345 3.795 1.00 0.00 C ATOM 2852 O LEU B 88 2.049 -14.245 3.385 1.00 0.00 O ATOM 2853 CB LEU B 88 0.043 -13.042 5.762 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.626 -11.814 6.404 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -0.033 -11.649 7.812 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.433 -10.507 5.632 1.00 0.00 C ATOM 0 H LEU B 88 -1.976 -13.027 4.237 1.00 0.00 H new ATOM 0 HA LEU B 88 0.657 -12.207 3.903 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.491 -13.929 6.102 1.00 0.00 H new ATOM 0 HB3 LEU B 88 1.058 -13.112 6.153 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.700 -11.999 6.410 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.486 -10.785 8.298 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.236 -12.544 8.400 1.00 0.00 H new ATOM 0 HD13 LEU B 88 1.044 -11.501 7.738 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.938 -9.696 6.157 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.631 -10.283 5.556 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.855 -10.609 4.632 1.00 0.00 H new ATOM 2868 N LYS B 89 0.273 -15.519 3.907 1.00 0.00 N ATOM 2869 CA LYS B 89 0.913 -16.777 3.548 1.00 0.00 C ATOM 2870 C LYS B 89 1.170 -16.844 2.039 1.00 0.00 C ATOM 2871 O LYS B 89 2.234 -17.278 1.604 1.00 0.00 O ATOM 2872 CB LYS B 89 0.060 -17.961 4.028 1.00 0.00 C ATOM 2873 CG LYS B 89 -0.107 -18.030 5.558 1.00 0.00 C ATOM 2874 CD LYS B 89 1.188 -18.312 6.340 1.00 0.00 C ATOM 2875 CE LYS B 89 1.715 -19.737 6.144 1.00 0.00 C ATOM 2876 NZ LYS B 89 2.992 -19.925 6.858 1.00 0.00 N ATOM 0 H LYS B 89 -0.683 -15.620 4.247 1.00 0.00 H new ATOM 0 HA LYS B 89 1.881 -16.835 4.046 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -0.926 -17.896 3.567 1.00 0.00 H new ATOM 0 HB3 LYS B 89 0.515 -18.888 3.680 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -0.526 -17.086 5.906 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -0.834 -18.807 5.795 1.00 0.00 H new ATOM 0 HD2 LYS B 89 1.954 -17.602 6.028 1.00 0.00 H new ATOM 0 HD3 LYS B 89 1.008 -18.141 7.401 1.00 0.00 H new ATOM 0 HE2 LYS B 89 0.980 -20.455 6.508 1.00 0.00 H new ATOM 0 HE3 LYS B 89 1.855 -19.935 5.081 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 3.332 -20.897 6.712 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 3.697 -19.254 6.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 2.849 -19.757 7.874 1.00 0.00 H new ATOM 2890 N GLY B 90 0.191 -16.425 1.235 1.00 0.00 N ATOM 2891 CA GLY B 90 0.290 -16.464 -0.215 1.00 0.00 C ATOM 2892 C GLY B 90 0.438 -17.899 -0.722 1.00 0.00 C ATOM 2893 O GLY B 90 -0.248 -18.783 -0.160 1.00 0.00 O ATOM 2894 OXT GLY B 90 1.219 -18.087 -1.681 1.00 0.00 O ATOM 0 H GLY B 90 -0.693 -16.049 1.578 1.00 0.00 H new ATOM 0 HA2 GLY B 90 -0.598 -16.010 -0.655 1.00 0.00 H new ATOM 0 HA3 GLY B 90 1.145 -15.871 -0.540 1.00 0.00 H new