USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=31 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 27 HIS : no HE2:sc= 0.976 K(o=2.9,f=-2.2) USER MOD Set 1.2: B 85 ASN : amide:sc= 1.97 K(o=2.9,f=-0.56) USER MOD Set 2.1: A 75 THR OG1 : rot 81:sc= 1.79 USER MOD Set 2.2: B 71 GLN : amide:sc= 1.75 K(o=3.3,f=0.34) USER MOD Set 2.3: B 75 THR OG1 : rot -70:sc= -0.279 USER MOD Set 3.1: B 19 TYR OH : rot 120:sc= 0.946 USER MOD Set 3.2: B 40 LYS NZ :NH3+ 171:sc= 0.33 (180deg=-0.0758) USER MOD Set 4.1: B 17 HIS : no HE2:sc= 1.89 K(o=3,f=-9.2!) USER MOD Set 4.2: B 27 HIS : no HE2:sc= 1.07 K(o=3,f=-7.9!) USER MOD Set 5.1: A 69 ASN : amide:sc= 0.25 K(o=0.25,f=-3.1!) USER MOD Set 5.2: B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 19 TYR OH : rot 180:sc= 0.924 USER MOD Set 6.2: A 40 LYS NZ :NH3+ 179:sc= 1.37 (180deg=0.263) USER MOD Set 7.1: A 31 LYS NZ :NH3+ 143:sc= 0.394 (180deg=-0.0304) USER MOD Set 7.2: A 66 GLN : amide:sc= 1.59 K(o=2,f=-2.9) USER MOD Single : A 3 SER OG : rot 4:sc= 0.737 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 17 HIS : no HE2:sc= -0.25 K(o=-0.25,f=-0.92) USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0257) USER MOD Single : A 20 SER OG : rot 78:sc= 1.06 USER MOD Single : A 28 THR OG1 : rot 27:sc= 1.08 USER MOD Single : A 30 SER OG : rot 180:sc= 0.00208 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -153:sc= 0.251 (180deg=-1.45!) USER MOD Single : A 39 GLN : amide:sc= 0.625 K(o=0.63,f=-1.8) USER MOD Single : A 55 LYS NZ :NH3+ 158:sc= 0.453 (180deg=0.224) USER MOD Single : A 57 MET CE :methyl -166:sc=-0.00917 (180deg=-0.217) USER MOD Single : A 63 ASN : amide:sc= 0.643 K(o=0.64,f=-6.4!) USER MOD Single : A 64 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0941) USER MOD Single : A 71 GLN : amide:sc=-0.00153 X(o=-0.0015,f=0) USER MOD Single : A 73 TYR OH : rot 152:sc= 0.0245 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 : A 85 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : B 3 SER OG : rot 20:sc= 0.597 USER MOD Single : B 7 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 SER OG : rot -84:sc= 1.07 USER MOD Single : B 28 THR OG1 : rot 154:sc= 0.874 USER MOD Single : B 30 SER OG : rot 180:sc= 0.156 USER MOD Single : B 31 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0828) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -154:sc= 1.21 (180deg=0.604) USER MOD Single : B 39 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.036) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 169:sc= 0 (180deg=-0.107) USER MOD Single : B 69 ASN : amide:sc= -0.238 K(o=-0.24,f=-2.7!) USER MOD Single : B 73 TYR OH : rot 146:sc= 0.43 USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.876 -3.173 -5.855 1.00 0.00 N ATOM 31 CA SER A 3 -8.655 -3.590 -6.519 1.00 0.00 C ATOM 32 C SER A 3 -7.464 -2.661 -6.257 1.00 0.00 C ATOM 33 O SER A 3 -6.423 -3.168 -5.846 1.00 0.00 O ATOM 34 CB SER A 3 -8.932 -3.830 -8.010 1.00 0.00 C ATOM 35 OG SER A 3 -10.324 -4.039 -8.204 1.00 0.00 O ATOM 0 HA SER A 3 -8.340 -4.536 -6.079 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.596 -2.974 -8.596 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.371 -4.696 -8.361 1.00 0.00 H new ATOM 0 HG SER A 3 -10.794 -3.927 -7.351 1.00 0.00 H new ATOM 41 N PRO A 4 -7.587 -1.333 -6.450 1.00 0.00 N ATOM 42 CA PRO A 4 -6.520 -0.381 -6.172 1.00 0.00 C ATOM 43 C PRO A 4 -5.944 -0.537 -4.761 1.00 0.00 C ATOM 44 O PRO A 4 -4.728 -0.597 -4.584 1.00 0.00 O ATOM 45 CB PRO A 4 -7.129 1.009 -6.388 1.00 0.00 C ATOM 46 CG PRO A 4 -8.247 0.741 -7.391 1.00 0.00 C ATOM 47 CD PRO A 4 -8.762 -0.618 -6.927 1.00 0.00 C ATOM 0 HA PRO A 4 -5.672 -0.551 -6.835 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.513 1.430 -5.459 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -6.396 1.715 -6.779 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -9.022 1.507 -7.354 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.878 0.710 -8.416 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.503 -0.508 -6.136 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -9.245 -1.155 -7.743 1.00 0.00 H new ATOM 55 N LEU A 5 -6.804 -0.612 -3.743 1.00 0.00 N ATOM 56 CA LEU A 5 -6.314 -0.774 -2.385 1.00 0.00 C ATOM 57 C LEU A 5 -5.749 -2.180 -2.215 1.00 0.00 C ATOM 58 O LEU A 5 -4.668 -2.344 -1.655 1.00 0.00 O ATOM 59 CB LEU A 5 -7.409 -0.475 -1.357 1.00 0.00 C ATOM 60 CG LEU A 5 -6.884 -0.630 0.082 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.697 0.286 0.393 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.984 -0.291 1.080 1.00 0.00 C ATOM 0 H LEU A 5 -7.819 -0.564 -3.835 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.516 -0.053 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.781 0.539 -1.503 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.251 -1.149 -1.513 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.560 -1.667 0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.375 0.128 1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.874 0.057 -0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.996 1.326 0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.602 -0.404 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.309 0.738 0.927 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.829 -0.964 0.933 1.00 0.00 H new ATOM 74 N ASP A 6 -6.480 -3.191 -2.693 1.00 0.00 N ATOM 75 CA ASP A 6 -6.085 -4.587 -2.551 1.00 0.00 C ATOM 76 C ASP A 6 -4.666 -4.796 -3.072 1.00 0.00 C ATOM 77 O ASP A 6 -3.836 -5.377 -2.377 1.00 0.00 O ATOM 78 CB ASP A 6 -7.060 -5.523 -3.280 1.00 0.00 C ATOM 79 CG ASP A 6 -8.498 -5.431 -2.781 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.683 -5.132 -1.582 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.394 -5.673 -3.618 1.00 0.00 O ATOM 0 H ASP A 6 -7.362 -3.060 -3.189 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.113 -4.832 -1.489 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.040 -5.293 -4.345 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.713 -6.550 -3.169 1.00 0.00 H new ATOM 86 N GLN A 7 -4.368 -4.313 -4.283 1.00 0.00 N ATOM 87 CA GLN A 7 -3.027 -4.427 -4.835 1.00 0.00 C ATOM 88 C GLN A 7 -2.015 -3.676 -3.968 1.00 0.00 C ATOM 89 O GLN A 7 -0.917 -4.176 -3.749 1.00 0.00 O ATOM 90 CB GLN A 7 -2.974 -4.014 -6.314 1.00 0.00 C ATOM 91 CG GLN A 7 -3.255 -2.529 -6.574 1.00 0.00 C ATOM 92 CD GLN A 7 -3.297 -2.224 -8.067 1.00 0.00 C ATOM 93 OE1 GLN A 7 -4.356 -1.966 -8.628 1.00 0.00 O ATOM 94 NE2 GLN A 7 -2.143 -2.255 -8.728 1.00 0.00 N ATOM 0 H GLN A 7 -5.038 -3.843 -4.892 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.744 -5.479 -4.815 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.989 -4.258 -6.711 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.698 -4.610 -6.870 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.205 -2.252 -6.118 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.484 -1.923 -6.099 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -1.278 -2.473 -8.234 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -2.123 -2.061 -9.729 1.00 0.00 H new ATOM 103 N ALA A 8 -2.367 -2.492 -3.457 1.00 0.00 N ATOM 104 CA ALA A 8 -1.461 -1.736 -2.606 1.00 0.00 C ATOM 105 C ALA A 8 -1.119 -2.506 -1.328 1.00 0.00 C ATOM 106 O ALA A 8 0.056 -2.745 -1.058 1.00 0.00 O ATOM 107 CB ALA A 8 -2.031 -0.358 -2.299 1.00 0.00 C ATOM 0 H ALA A 8 -3.269 -2.044 -3.620 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.528 -1.594 -3.151 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.337 0.189 -1.661 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.178 0.190 -3.229 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.987 -0.466 -1.786 1.00 0.00 H new ATOM 113 N ILE A 9 -2.124 -2.922 -0.547 1.00 0.00 N ATOM 114 CA ILE A 9 -1.864 -3.718 0.653 1.00 0.00 C ATOM 115 C ILE A 9 -1.103 -4.996 0.255 1.00 0.00 C ATOM 116 O ILE A 9 -0.092 -5.350 0.865 1.00 0.00 O ATOM 117 CB ILE A 9 -3.144 -3.933 1.499 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.225 -4.794 0.833 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.702 -2.569 1.926 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.424 -5.063 1.756 1.00 0.00 C ATOM 0 H ILE A 9 -3.109 -2.723 -0.723 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.211 -3.174 1.335 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.843 -4.513 2.371 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.573 -4.296 -0.072 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.788 -5.744 0.526 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.603 -2.715 2.522 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.956 -2.040 2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.944 -1.981 1.040 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.156 -5.677 1.232 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.085 -5.587 2.650 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.882 -4.116 2.042 1.00 0.00 H new ATOM 132 N GLY A 10 -1.539 -5.624 -0.842 1.00 0.00 N ATOM 133 CA GLY A 10 -0.864 -6.724 -1.511 1.00 0.00 C ATOM 134 C GLY A 10 0.624 -6.458 -1.738 1.00 0.00 C ATOM 135 O GLY A 10 1.437 -7.356 -1.556 1.00 0.00 O ATOM 0 H GLY A 10 -2.411 -5.363 -1.302 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.979 -7.630 -0.916 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.346 -6.909 -2.471 1.00 0.00 H new ATOM 139 N LEU A 11 0.993 -5.241 -2.141 1.00 0.00 N ATOM 140 CA LEU A 11 2.369 -4.861 -2.423 1.00 0.00 C ATOM 141 C LEU A 11 3.210 -4.986 -1.151 1.00 0.00 C ATOM 142 O LEU A 11 4.181 -5.742 -1.117 1.00 0.00 O ATOM 143 CB LEU A 11 2.388 -3.432 -2.995 1.00 0.00 C ATOM 144 CG LEU A 11 3.621 -3.054 -3.827 1.00 0.00 C ATOM 145 CD1 LEU A 11 4.930 -3.265 -3.072 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.604 -3.759 -5.186 1.00 0.00 C ATOM 0 H LEU A 11 0.328 -4.481 -2.282 1.00 0.00 H new ATOM 0 HA LEU A 11 2.806 -5.527 -3.167 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.502 -3.299 -3.615 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.305 -2.729 -2.166 1.00 0.00 H new ATOM 0 HG LEU A 11 3.566 -1.982 -4.016 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.767 -2.981 -3.709 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.934 -2.650 -2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.025 -4.315 -2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.489 -3.473 -5.755 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.602 -4.839 -5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.709 -3.467 -5.736 1.00 0.00 H new ATOM 158 N LEU A 12 2.823 -4.254 -0.101 1.00 0.00 N ATOM 159 CA LEU A 12 3.475 -4.298 1.204 1.00 0.00 C ATOM 160 C LEU A 12 3.611 -5.756 1.655 1.00 0.00 C ATOM 161 O LEU A 12 4.689 -6.194 2.060 1.00 0.00 O ATOM 162 CB LEU A 12 2.655 -3.491 2.230 1.00 0.00 C ATOM 163 CG LEU A 12 2.871 -1.969 2.162 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.304 -1.331 0.893 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.211 -1.292 3.368 1.00 0.00 C ATOM 0 H LEU A 12 2.036 -3.606 -0.139 1.00 0.00 H new ATOM 0 HA LEU A 12 4.468 -3.854 1.131 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.597 -3.702 2.078 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.908 -3.837 3.232 1.00 0.00 H new ATOM 0 HG LEU A 12 3.951 -1.820 2.160 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.491 -0.257 0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.786 -1.769 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.230 -1.511 0.844 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.369 -0.215 3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.142 -1.503 3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.653 -1.676 4.288 1.00 0.00 H new ATOM 177 N ILE A 13 2.517 -6.516 1.562 1.00 0.00 N ATOM 178 CA ILE A 13 2.502 -7.922 1.941 1.00 0.00 C ATOM 179 C ILE A 13 3.538 -8.702 1.131 1.00 0.00 C ATOM 180 O ILE A 13 4.378 -9.392 1.702 1.00 0.00 O ATOM 181 CB ILE A 13 1.073 -8.486 1.785 1.00 0.00 C ATOM 182 CG1 ILE A 13 0.131 -7.831 2.811 1.00 0.00 C ATOM 183 CG2 ILE A 13 1.029 -10.009 1.948 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.343 -7.983 2.422 1.00 0.00 C ATOM 0 H ILE A 13 1.620 -6.170 1.222 1.00 0.00 H new ATOM 0 HA ILE A 13 2.781 -8.028 2.989 1.00 0.00 H new ATOM 0 HB ILE A 13 0.743 -8.251 0.773 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.295 -8.280 3.791 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.374 -6.772 2.901 1.00 0.00 H new ATOM 0 HG21 ILE A 13 0.003 -10.358 1.830 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.660 -10.474 1.191 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.392 -10.279 2.939 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.969 -7.505 3.176 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.515 -7.510 1.455 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.595 -9.042 2.358 1.00 0.00 H new ATOM 196 N GLY A 14 3.494 -8.586 -0.196 1.00 0.00 N ATOM 197 CA GLY A 14 4.404 -9.260 -1.102 1.00 0.00 C ATOM 198 C GLY A 14 5.851 -8.966 -0.726 1.00 0.00 C ATOM 199 O GLY A 14 6.628 -9.891 -0.494 1.00 0.00 O ATOM 0 H GLY A 14 2.806 -8.005 -0.675 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.226 -10.335 -1.072 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.215 -8.934 -2.125 1.00 0.00 H new ATOM 203 N ILE A 15 6.206 -7.679 -0.638 1.00 0.00 N ATOM 204 CA ILE A 15 7.538 -7.259 -0.235 1.00 0.00 C ATOM 205 C ILE A 15 7.906 -7.959 1.077 1.00 0.00 C ATOM 206 O ILE A 15 8.908 -8.673 1.151 1.00 0.00 O ATOM 207 CB ILE A 15 7.596 -5.714 -0.181 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.900 -5.187 -1.594 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.632 -5.209 0.826 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.842 -3.660 -1.721 1.00 0.00 C ATOM 0 H ILE A 15 5.573 -6.906 -0.845 1.00 0.00 H new ATOM 0 HA ILE A 15 8.294 -7.558 -0.962 1.00 0.00 H new ATOM 0 HB ILE A 15 6.631 -5.338 0.160 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.892 -5.528 -1.891 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.189 -5.626 -2.294 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.636 -4.119 0.828 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.379 -5.573 1.822 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.620 -5.575 0.546 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.068 -3.371 -2.747 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.844 -3.311 -1.458 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.573 -3.211 -1.048 1.00 0.00 H new ATOM 222 N PHE A 16 7.074 -7.786 2.104 1.00 0.00 N ATOM 223 CA PHE A 16 7.338 -8.341 3.419 1.00 0.00 C ATOM 224 C PHE A 16 7.613 -9.842 3.347 1.00 0.00 C ATOM 225 O PHE A 16 8.618 -10.326 3.865 1.00 0.00 O ATOM 226 CB PHE A 16 6.149 -8.054 4.336 1.00 0.00 C ATOM 227 CG PHE A 16 6.388 -8.435 5.779 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.966 -7.504 6.656 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.085 -9.729 6.235 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.115 -7.818 8.016 1.00 0.00 C ATOM 231 CE2 PHE A 16 6.267 -10.057 7.586 1.00 0.00 C ATOM 232 CZ PHE A 16 6.747 -9.087 8.481 1.00 0.00 C ATOM 0 H PHE A 16 6.203 -7.258 2.042 1.00 0.00 H new ATOM 0 HA PHE A 16 8.232 -7.868 3.824 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.910 -6.992 4.285 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.278 -8.595 3.966 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.296 -6.545 6.284 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.712 -10.471 5.545 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.512 -7.084 8.701 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.039 -11.052 7.937 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.833 -9.320 9.532 1.00 0.00 H new ATOM 242 N HIS A 17 6.703 -10.589 2.724 1.00 0.00 N ATOM 243 CA HIS A 17 6.757 -12.038 2.710 1.00 0.00 C ATOM 244 C HIS A 17 7.872 -12.577 1.824 1.00 0.00 C ATOM 245 O HIS A 17 8.399 -13.643 2.131 1.00 0.00 O ATOM 246 CB HIS A 17 5.383 -12.628 2.386 1.00 0.00 C ATOM 247 CG HIS A 17 4.541 -12.688 3.632 1.00 0.00 C ATOM 248 ND1 HIS A 17 4.647 -13.667 4.594 1.00 0.00 N ATOM 249 CD2 HIS A 17 3.806 -11.664 4.167 1.00 0.00 C ATOM 250 CE1 HIS A 17 3.974 -13.245 5.674 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.453 -12.026 5.470 1.00 0.00 N ATOM 0 H HIS A 17 5.909 -10.200 2.216 1.00 0.00 H new ATOM 0 HA HIS A 17 7.017 -12.371 3.715 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.886 -12.020 1.630 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.497 -13.627 1.966 1.00 0.00 H new ATOM 0 HD1 HIS A 17 5.146 -14.552 4.502 1.00 0.00 H new ATOM 0 HD2 HIS A 17 3.545 -10.741 3.671 1.00 0.00 H new ATOM 0 HE1 HIS A 17 3.866 -13.811 6.587 1.00 0.00 H new ATOM 259 N LYS A 18 8.282 -11.859 0.775 1.00 0.00 N ATOM 260 CA LYS A 18 9.486 -12.245 0.044 1.00 0.00 C ATOM 261 C LYS A 18 10.675 -12.245 1.010 1.00 0.00 C ATOM 262 O LYS A 18 11.373 -13.249 1.165 1.00 0.00 O ATOM 263 CB LYS A 18 9.729 -11.287 -1.131 1.00 0.00 C ATOM 264 CG LYS A 18 8.728 -11.529 -2.267 1.00 0.00 C ATOM 265 CD LYS A 18 8.803 -10.378 -3.278 1.00 0.00 C ATOM 266 CE LYS A 18 7.710 -10.482 -4.347 1.00 0.00 C ATOM 267 NZ LYS A 18 7.841 -11.710 -5.152 1.00 0.00 N ATOM 0 H LYS A 18 7.810 -11.027 0.421 1.00 0.00 H new ATOM 0 HA LYS A 18 9.362 -13.246 -0.368 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.647 -10.257 -0.785 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.744 -11.418 -1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.947 -12.475 -2.762 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.718 -11.606 -1.864 1.00 0.00 H new ATOM 0 HD2 LYS A 18 8.708 -9.427 -2.753 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.781 -10.380 -3.758 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.731 -10.465 -3.868 1.00 0.00 H new ATOM 0 HE3 LYS A 18 7.759 -9.612 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.114 -11.717 -5.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.784 -11.739 -5.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.718 -12.541 -4.540 1.00 0.00 H new ATOM 281 N TYR A 19 10.889 -11.111 1.680 1.00 0.00 N ATOM 282 CA TYR A 19 12.001 -10.957 2.603 1.00 0.00 C ATOM 283 C TYR A 19 11.914 -11.948 3.767 1.00 0.00 C ATOM 284 O TYR A 19 12.897 -12.614 4.080 1.00 0.00 O ATOM 285 CB TYR A 19 12.120 -9.490 3.030 1.00 0.00 C ATOM 286 CG TYR A 19 12.887 -8.672 2.012 1.00 0.00 C ATOM 287 CD1 TYR A 19 12.220 -8.078 0.926 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.292 -8.716 2.020 1.00 0.00 C ATOM 289 CE1 TYR A 19 12.943 -7.676 -0.207 1.00 0.00 C ATOM 290 CE2 TYR A 19 15.010 -8.359 0.870 1.00 0.00 C ATOM 291 CZ TYR A 19 14.326 -7.901 -0.265 1.00 0.00 C ATOM 292 OH TYR A 19 15.002 -7.719 -1.429 1.00 0.00 O ATOM 0 H TYR A 19 10.299 -10.284 1.595 1.00 0.00 H new ATOM 0 HA TYR A 19 12.932 -11.212 2.098 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.124 -9.067 3.161 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.621 -9.431 3.996 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.151 -7.931 0.964 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.818 -9.025 2.911 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.437 -7.195 -1.031 1.00 0.00 H new ATOM 0 HE2 TYR A 19 16.087 -8.437 0.858 1.00 0.00 H new ATOM 0 HH TYR A 19 15.951 -7.918 -1.290 1.00 0.00 H new ATOM 302 N SER A 20 10.745 -12.085 4.393 1.00 0.00 N ATOM 303 CA SER A 20 10.563 -13.043 5.478 1.00 0.00 C ATOM 304 C SER A 20 10.845 -14.460 4.970 1.00 0.00 C ATOM 305 O SER A 20 11.684 -15.172 5.519 1.00 0.00 O ATOM 306 CB SER A 20 9.160 -12.909 6.086 1.00 0.00 C ATOM 307 OG SER A 20 8.849 -11.554 6.345 1.00 0.00 O ATOM 0 H SER A 20 9.911 -11.543 4.166 1.00 0.00 H new ATOM 0 HA SER A 20 11.274 -12.830 6.276 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.422 -13.332 5.404 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.104 -13.482 7.011 1.00 0.00 H new ATOM 0 HG SER A 20 8.601 -11.109 5.508 1.00 0.00 H new ATOM 313 N GLY A 21 10.191 -14.838 3.868 1.00 0.00 N ATOM 314 CA GLY A 21 10.358 -16.121 3.208 1.00 0.00 C ATOM 315 C GLY A 21 11.830 -16.467 3.006 1.00 0.00 C ATOM 316 O GLY A 21 12.238 -17.589 3.302 1.00 0.00 O ATOM 0 H GLY A 21 9.512 -14.236 3.402 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.880 -16.900 3.802 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.853 -16.101 2.242 1.00 0.00 H new ATOM 398 N HIS A 27 5.050 -14.402 9.545 1.00 0.00 N ATOM 399 CA HIS A 27 4.464 -13.113 9.912 1.00 0.00 C ATOM 400 C HIS A 27 5.461 -12.190 10.632 1.00 0.00 C ATOM 401 O HIS A 27 5.051 -11.344 11.431 1.00 0.00 O ATOM 402 CB HIS A 27 3.217 -13.352 10.782 1.00 0.00 C ATOM 403 CG HIS A 27 2.266 -14.405 10.260 1.00 0.00 C ATOM 404 ND1 HIS A 27 1.649 -15.379 11.014 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.887 -14.594 8.957 1.00 0.00 C ATOM 406 CE1 HIS A 27 0.920 -16.138 10.178 1.00 0.00 C ATOM 407 NE2 HIS A 27 1.041 -15.705 8.912 1.00 0.00 N ATOM 0 HA HIS A 27 4.183 -12.600 8.992 1.00 0.00 H new ATOM 0 HB2 HIS A 27 3.540 -13.640 11.782 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.675 -12.411 10.880 1.00 0.00 H new ATOM 0 HD1 HIS A 27 1.731 -15.502 12.023 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.189 -13.991 8.114 1.00 0.00 H new ATOM 0 HE1 HIS A 27 0.318 -16.982 10.483 1.00 0.00 H new ATOM 415 N THR A 28 6.763 -12.332 10.371 1.00 0.00 N ATOM 416 CA THR A 28 7.789 -11.540 11.024 1.00 0.00 C ATOM 417 C THR A 28 9.039 -11.479 10.146 1.00 0.00 C ATOM 418 O THR A 28 9.364 -12.458 9.480 1.00 0.00 O ATOM 419 CB THR A 28 8.052 -12.039 12.457 1.00 0.00 C ATOM 420 OG1 THR A 28 8.888 -11.137 13.147 1.00 0.00 O ATOM 421 CG2 THR A 28 8.684 -13.432 12.515 1.00 0.00 C ATOM 0 H THR A 28 7.129 -13.004 9.697 1.00 0.00 H new ATOM 0 HA THR A 28 7.441 -10.514 11.140 1.00 0.00 H new ATOM 0 HB THR A 28 7.072 -12.102 12.930 1.00 0.00 H new ATOM 0 HG1 THR A 28 8.783 -10.239 12.769 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.840 -13.718 13.555 1.00 0.00 H new ATOM 0 HG22 THR A 28 8.021 -14.153 12.037 1.00 0.00 H new ATOM 0 HG23 THR A 28 9.642 -13.419 11.995 1.00 0.00 H new ATOM 429 N LEU A 29 9.713 -10.328 10.153 1.00 0.00 N ATOM 430 CA LEU A 29 11.032 -10.124 9.559 1.00 0.00 C ATOM 431 C LEU A 29 12.055 -10.046 10.683 1.00 0.00 C ATOM 432 O LEU A 29 11.797 -9.378 11.682 1.00 0.00 O ATOM 433 CB LEU A 29 11.091 -8.780 8.814 1.00 0.00 C ATOM 434 CG LEU A 29 10.426 -8.781 7.437 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.295 -7.339 6.936 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.276 -9.546 6.424 1.00 0.00 C ATOM 0 H LEU A 29 9.341 -9.484 10.588 1.00 0.00 H new ATOM 0 HA LEU A 29 11.233 -10.944 8.869 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.616 -8.017 9.431 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.135 -8.491 8.697 1.00 0.00 H new ATOM 0 HG LEU A 29 9.450 -9.256 7.534 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.821 -7.337 5.954 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.686 -6.765 7.634 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.285 -6.888 6.862 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.783 -9.533 5.452 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.255 -9.074 6.341 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.397 -10.577 6.756 1.00 0.00 H new ATOM 448 N SER A 30 13.229 -10.654 10.519 1.00 0.00 N ATOM 449 CA SER A 30 14.328 -10.420 11.446 1.00 0.00 C ATOM 450 C SER A 30 15.023 -9.091 11.111 1.00 0.00 C ATOM 451 O SER A 30 14.959 -8.615 9.975 1.00 0.00 O ATOM 452 CB SER A 30 15.290 -11.611 11.414 1.00 0.00 C ATOM 453 OG SER A 30 15.723 -11.863 10.091 1.00 0.00 O ATOM 0 H SER A 30 13.440 -11.304 9.762 1.00 0.00 H new ATOM 0 HA SER A 30 13.949 -10.334 12.464 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.150 -11.408 12.052 1.00 0.00 H new ATOM 0 HB3 SER A 30 14.796 -12.496 11.816 1.00 0.00 H new ATOM 0 HG SER A 30 16.338 -12.626 10.088 1.00 0.00 H new ATOM 459 N LYS A 31 15.686 -8.480 12.098 1.00 0.00 N ATOM 460 CA LYS A 31 16.244 -7.136 12.017 1.00 0.00 C ATOM 461 C LYS A 31 17.074 -6.893 10.753 1.00 0.00 C ATOM 462 O LYS A 31 16.896 -5.906 10.036 1.00 0.00 O ATOM 463 CB LYS A 31 17.053 -6.851 13.291 1.00 0.00 C ATOM 464 CG LYS A 31 18.112 -7.891 13.697 1.00 0.00 C ATOM 465 CD LYS A 31 18.828 -7.400 14.964 1.00 0.00 C ATOM 466 CE LYS A 31 20.004 -8.304 15.360 1.00 0.00 C ATOM 467 NZ LYS A 31 19.568 -9.647 15.781 1.00 0.00 N ATOM 0 H LYS A 31 15.852 -8.925 13.001 1.00 0.00 H new ATOM 0 HA LYS A 31 15.412 -6.435 11.945 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.553 -5.890 13.166 1.00 0.00 H new ATOM 0 HB3 LYS A 31 16.353 -6.741 14.119 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.641 -8.857 13.880 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.830 -8.034 12.889 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.192 -6.385 14.802 1.00 0.00 H new ATOM 0 HD3 LYS A 31 18.115 -7.355 15.787 1.00 0.00 H new ATOM 0 HE2 LYS A 31 20.688 -8.396 14.516 1.00 0.00 H new ATOM 0 HE3 LYS A 31 20.561 -7.835 16.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 20.254 -10.355 15.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 19.509 -9.683 16.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 18.634 -9.852 15.373 1.00 0.00 H new ATOM 481 N LYS A 32 18.006 -7.800 10.481 1.00 0.00 N ATOM 482 CA LYS A 32 18.913 -7.638 9.353 1.00 0.00 C ATOM 483 C LYS A 32 18.196 -7.969 8.040 1.00 0.00 C ATOM 484 O LYS A 32 18.524 -7.397 7.002 1.00 0.00 O ATOM 485 CB LYS A 32 20.206 -8.424 9.600 1.00 0.00 C ATOM 486 CG LYS A 32 21.196 -8.303 8.431 1.00 0.00 C ATOM 487 CD LYS A 32 22.521 -9.029 8.701 1.00 0.00 C ATOM 488 CE LYS A 32 23.345 -8.361 9.810 1.00 0.00 C ATOM 489 NZ LYS A 32 24.677 -8.981 9.931 1.00 0.00 N ATOM 0 H LYS A 32 18.152 -8.651 11.024 1.00 0.00 H new ATOM 0 HA LYS A 32 19.220 -6.597 9.255 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.679 -8.062 10.513 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.964 -9.475 9.761 1.00 0.00 H new ATOM 0 HG2 LYS A 32 20.739 -8.712 7.530 1.00 0.00 H new ATOM 0 HG3 LYS A 32 21.396 -7.249 8.237 1.00 0.00 H new ATOM 0 HD2 LYS A 32 22.315 -10.062 8.979 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.109 -9.057 7.784 1.00 0.00 H new ATOM 0 HE2 LYS A 32 23.454 -7.298 9.596 1.00 0.00 H new ATOM 0 HE3 LYS A 32 22.816 -8.442 10.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 25.212 -8.510 10.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.571 -9.990 10.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 25.189 -8.881 9.031 1.00 0.00 H new ATOM 503 N GLU A 33 17.188 -8.844 8.072 1.00 0.00 N ATOM 504 CA GLU A 33 16.372 -9.096 6.895 1.00 0.00 C ATOM 505 C GLU A 33 15.580 -7.834 6.548 1.00 0.00 C ATOM 506 O GLU A 33 15.469 -7.474 5.378 1.00 0.00 O ATOM 507 CB GLU A 33 15.459 -10.302 7.135 1.00 0.00 C ATOM 508 CG GLU A 33 14.834 -10.794 5.822 1.00 0.00 C ATOM 509 CD GLU A 33 15.843 -11.425 4.857 1.00 0.00 C ATOM 510 OE1 GLU A 33 16.783 -12.084 5.352 1.00 0.00 O ATOM 511 OE2 GLU A 33 15.664 -11.229 3.636 1.00 0.00 O ATOM 0 H GLU A 33 16.923 -9.383 8.896 1.00 0.00 H new ATOM 0 HA GLU A 33 17.008 -9.339 6.044 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.031 -11.109 7.594 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.671 -10.031 7.837 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.058 -11.524 6.051 1.00 0.00 H new ATOM 0 HG3 GLU A 33 14.346 -9.955 5.326 1.00 0.00 H new ATOM 518 N LEU A 34 15.057 -7.133 7.558 1.00 0.00 N ATOM 519 CA LEU A 34 14.463 -5.819 7.354 1.00 0.00 C ATOM 520 C LEU A 34 15.485 -4.887 6.695 1.00 0.00 C ATOM 521 O LEU A 34 15.188 -4.263 5.677 1.00 0.00 O ATOM 522 CB LEU A 34 13.889 -5.280 8.674 1.00 0.00 C ATOM 523 CG LEU A 34 13.365 -3.832 8.638 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.491 -2.783 8.643 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.370 -3.621 7.486 1.00 0.00 C ATOM 0 H LEU A 34 15.035 -7.458 8.524 1.00 0.00 H new ATOM 0 HA LEU A 34 13.618 -5.887 6.669 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.074 -5.933 8.987 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.663 -5.347 9.439 1.00 0.00 H new ATOM 0 HG LEU A 34 12.819 -3.676 9.568 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.057 -1.783 8.617 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.089 -2.895 9.547 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.126 -2.926 7.768 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.021 -2.588 7.491 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.862 -3.833 6.537 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.520 -4.292 7.612 1.00 0.00 H new ATOM 537 N LYS A 35 16.701 -4.780 7.240 1.00 0.00 N ATOM 538 CA LYS A 35 17.716 -3.961 6.579 1.00 0.00 C ATOM 539 C LYS A 35 17.878 -4.379 5.112 1.00 0.00 C ATOM 540 O LYS A 35 17.917 -3.519 4.237 1.00 0.00 O ATOM 541 CB LYS A 35 19.047 -4.011 7.332 1.00 0.00 C ATOM 542 CG LYS A 35 20.073 -3.089 6.654 1.00 0.00 C ATOM 543 CD LYS A 35 21.450 -3.182 7.307 1.00 0.00 C ATOM 544 CE LYS A 35 21.430 -2.630 8.731 1.00 0.00 C ATOM 545 NZ LYS A 35 22.804 -2.558 9.258 1.00 0.00 N ATOM 0 H LYS A 35 16.998 -5.232 8.105 1.00 0.00 H new ATOM 0 HA LYS A 35 17.379 -2.925 6.594 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.900 -3.704 8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.424 -5.034 7.353 1.00 0.00 H new ATOM 0 HG2 LYS A 35 20.154 -3.352 5.599 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.720 -2.059 6.700 1.00 0.00 H new ATOM 0 HD2 LYS A 35 21.777 -4.222 7.323 1.00 0.00 H new ATOM 0 HD3 LYS A 35 22.175 -2.628 6.711 1.00 0.00 H new ATOM 0 HE2 LYS A 35 20.975 -1.640 8.740 1.00 0.00 H new ATOM 0 HE3 LYS A 35 20.819 -3.268 9.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 22.783 -2.634 10.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 23.368 -3.338 8.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 23.233 -1.650 8.987 1.00 0.00 H new ATOM 559 N GLU A 36 17.963 -5.684 4.837 1.00 0.00 N ATOM 560 CA GLU A 36 18.060 -6.205 3.479 1.00 0.00 C ATOM 561 C GLU A 36 16.889 -5.698 2.622 1.00 0.00 C ATOM 562 O GLU A 36 17.100 -5.201 1.516 1.00 0.00 O ATOM 563 CB GLU A 36 18.127 -7.739 3.513 1.00 0.00 C ATOM 564 CG GLU A 36 18.732 -8.312 2.227 1.00 0.00 C ATOM 565 CD GLU A 36 18.554 -9.825 2.154 1.00 0.00 C ATOM 566 OE1 GLU A 36 18.994 -10.498 3.111 1.00 0.00 O ATOM 567 OE2 GLU A 36 17.982 -10.276 1.139 1.00 0.00 O ATOM 0 H GLU A 36 17.966 -6.408 5.556 1.00 0.00 H new ATOM 0 HA GLU A 36 18.977 -5.841 3.016 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.723 -8.058 4.368 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.125 -8.143 3.654 1.00 0.00 H new ATOM 0 HG2 GLU A 36 18.260 -7.846 1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.793 -8.066 2.181 1.00 0.00 H new ATOM 574 N LEU A 37 15.662 -5.807 3.143 1.00 0.00 N ATOM 575 CA LEU A 37 14.452 -5.305 2.501 1.00 0.00 C ATOM 576 C LEU A 37 14.666 -3.859 2.088 1.00 0.00 C ATOM 577 O LEU A 37 14.509 -3.516 0.920 1.00 0.00 O ATOM 578 CB LEU A 37 13.240 -5.498 3.439 1.00 0.00 C ATOM 579 CG LEU A 37 11.872 -5.009 2.928 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.775 -5.727 3.721 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.645 -3.506 3.154 1.00 0.00 C ATOM 0 H LEU A 37 15.484 -6.256 4.041 1.00 0.00 H new ATOM 0 HA LEU A 37 14.235 -5.870 1.594 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.155 -6.560 3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.453 -4.986 4.377 1.00 0.00 H new ATOM 0 HG LEU A 37 11.846 -5.215 1.858 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.797 -5.394 3.373 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.865 -6.803 3.574 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.881 -5.496 4.781 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.664 -3.225 2.772 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.696 -3.287 4.220 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.414 -2.939 2.630 1.00 0.00 H new ATOM 593 N ILE A 38 15.045 -3.010 3.038 1.00 0.00 N ATOM 594 CA ILE A 38 15.210 -1.595 2.752 1.00 0.00 C ATOM 595 C ILE A 38 16.319 -1.389 1.725 1.00 0.00 C ATOM 596 O ILE A 38 16.105 -0.724 0.719 1.00 0.00 O ATOM 597 CB ILE A 38 15.432 -0.820 4.055 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.166 -1.000 4.907 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.694 0.670 3.785 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.257 -0.252 6.227 1.00 0.00 C ATOM 0 H ILE A 38 15.241 -3.277 4.003 1.00 0.00 H new ATOM 0 HA ILE A 38 14.300 -1.196 2.303 1.00 0.00 H new ATOM 0 HB ILE A 38 16.311 -1.202 4.574 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.300 -0.646 4.348 1.00 0.00 H new ATOM 0 HG13 ILE A 38 14.008 -2.061 5.102 1.00 0.00 H new ATOM 0 HG21 ILE A 38 15.847 1.190 4.731 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.584 0.776 3.164 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.837 1.102 3.268 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.341 -0.407 6.797 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.107 -0.624 6.798 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.388 0.813 6.034 1.00 0.00 H new ATOM 612 N GLN A 39 17.501 -1.958 1.954 1.00 0.00 N ATOM 613 CA GLN A 39 18.642 -1.737 1.081 1.00 0.00 C ATOM 614 C GLN A 39 18.405 -2.279 -0.334 1.00 0.00 C ATOM 615 O GLN A 39 19.029 -1.777 -1.271 1.00 0.00 O ATOM 616 CB GLN A 39 19.922 -2.298 1.717 1.00 0.00 C ATOM 617 CG GLN A 39 20.342 -1.542 2.993 1.00 0.00 C ATOM 618 CD GLN A 39 20.827 -0.112 2.738 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.887 0.353 1.603 1.00 0.00 O ATOM 620 NE2 GLN A 39 21.202 0.607 3.793 1.00 0.00 N ATOM 0 H GLN A 39 17.689 -2.578 2.742 1.00 0.00 H new ATOM 0 HA GLN A 39 18.773 -0.661 0.967 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.770 -3.350 1.958 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.733 -2.251 0.990 1.00 0.00 H new ATOM 0 HG2 GLN A 39 19.496 -1.511 3.680 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.135 -2.101 3.490 1.00 0.00 H new ATOM 0 HE21 GLN A 39 21.146 0.206 4.729 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.545 1.559 3.665 1.00 0.00 H new ATOM 629 N LYS A 40 17.529 -3.276 -0.518 1.00 0.00 N ATOM 630 CA LYS A 40 17.126 -3.687 -1.860 1.00 0.00 C ATOM 631 C LYS A 40 16.049 -2.754 -2.413 1.00 0.00 C ATOM 632 O LYS A 40 16.209 -2.190 -3.492 1.00 0.00 O ATOM 633 CB LYS A 40 16.702 -5.164 -1.873 1.00 0.00 C ATOM 634 CG LYS A 40 16.939 -5.858 -3.229 1.00 0.00 C ATOM 635 CD LYS A 40 16.127 -5.332 -4.424 1.00 0.00 C ATOM 636 CE LYS A 40 14.608 -5.312 -4.202 1.00 0.00 C ATOM 637 NZ LYS A 40 14.064 -6.645 -3.894 1.00 0.00 N ATOM 0 H LYS A 40 17.093 -3.804 0.238 1.00 0.00 H new ATOM 0 HA LYS A 40 17.983 -3.603 -2.528 1.00 0.00 H new ATOM 0 HB2 LYS A 40 17.252 -5.699 -1.099 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.644 -5.233 -1.618 1.00 0.00 H new ATOM 0 HG2 LYS A 40 17.998 -5.775 -3.474 1.00 0.00 H new ATOM 0 HG3 LYS A 40 16.722 -6.920 -3.111 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.461 -4.321 -4.657 1.00 0.00 H new ATOM 0 HD3 LYS A 40 16.346 -5.949 -5.296 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.373 -4.630 -3.385 1.00 0.00 H new ATOM 0 HE3 LYS A 40 14.119 -4.921 -5.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.038 -6.574 -3.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 14.248 -7.288 -4.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 14.521 -7.017 -3.037 1.00 0.00 H new ATOM 651 N GLU A 41 14.926 -2.613 -1.707 1.00 0.00 N ATOM 652 CA GLU A 41 13.796 -1.845 -2.205 1.00 0.00 C ATOM 653 C GLU A 41 14.201 -0.371 -2.322 1.00 0.00 C ATOM 654 O GLU A 41 14.299 0.194 -3.412 1.00 0.00 O ATOM 655 CB GLU A 41 12.584 -2.044 -1.278 1.00 0.00 C ATOM 656 CG GLU A 41 12.101 -3.504 -1.179 1.00 0.00 C ATOM 657 CD GLU A 41 11.503 -4.043 -2.475 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.823 -3.254 -3.163 1.00 0.00 O ATOM 659 OE2 GLU A 41 11.729 -5.241 -2.753 1.00 0.00 O ATOM 0 H GLU A 41 14.780 -3.025 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 41 13.506 -2.192 -3.197 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.841 -1.689 -0.280 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.762 -1.424 -1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.940 -4.136 -0.886 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.355 -3.578 -0.387 1.00 0.00 H new ATOM 666 N LEU A 42 14.484 0.249 -1.180 1.00 0.00 N ATOM 667 CA LEU A 42 14.864 1.650 -1.070 1.00 0.00 C ATOM 668 C LEU A 42 16.380 1.728 -1.258 1.00 0.00 C ATOM 669 O LEU A 42 17.092 2.222 -0.386 1.00 0.00 O ATOM 670 CB LEU A 42 14.452 2.214 0.306 1.00 0.00 C ATOM 671 CG LEU A 42 12.950 2.374 0.614 1.00 0.00 C ATOM 672 CD1 LEU A 42 12.282 3.401 -0.304 1.00 0.00 C ATOM 673 CD2 LEU A 42 12.166 1.060 0.592 1.00 0.00 C ATOM 0 H LEU A 42 14.454 -0.227 -0.278 1.00 0.00 H new ATOM 0 HA LEU A 42 14.357 2.247 -1.828 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.881 1.567 1.072 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.920 3.192 0.417 1.00 0.00 H new ATOM 0 HG LEU A 42 12.918 2.742 1.640 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.225 3.481 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 42 12.761 4.371 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.384 3.082 -1.341 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.118 1.258 0.818 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.245 0.606 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.576 0.379 1.338 1.00 0.00 H new ATOM 794 N ASP A 50 23.234 4.095 5.876 1.00 0.00 N ATOM 795 CA ASP A 50 22.805 2.940 6.652 1.00 0.00 C ATOM 796 C ASP A 50 22.739 3.239 8.153 1.00 0.00 C ATOM 797 O ASP A 50 21.943 2.625 8.852 1.00 0.00 O ATOM 798 CB ASP A 50 23.669 1.711 6.358 1.00 0.00 C ATOM 799 CG ASP A 50 23.048 0.450 6.952 1.00 0.00 C ATOM 800 OD1 ASP A 50 22.005 0.024 6.405 1.00 0.00 O ATOM 801 OD2 ASP A 50 23.625 -0.073 7.929 1.00 0.00 O ATOM 0 HA ASP A 50 21.788 2.709 6.334 1.00 0.00 H new ATOM 0 HB2 ASP A 50 23.783 1.592 5.281 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.668 1.857 6.770 1.00 0.00 H new ATOM 806 N ALA A 51 23.527 4.201 8.647 1.00 0.00 N ATOM 807 CA ALA A 51 23.406 4.710 10.010 1.00 0.00 C ATOM 808 C ALA A 51 21.955 5.075 10.361 1.00 0.00 C ATOM 809 O ALA A 51 21.430 4.631 11.382 1.00 0.00 O ATOM 810 CB ALA A 51 24.336 5.912 10.189 1.00 0.00 C ATOM 0 H ALA A 51 24.268 4.647 8.107 1.00 0.00 H new ATOM 0 HA ALA A 51 23.703 3.920 10.699 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.247 6.293 11.206 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.366 5.606 10.005 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.059 6.695 9.483 1.00 0.00 H new ATOM 816 N GLU A 52 21.276 5.858 9.516 1.00 0.00 N ATOM 817 CA GLU A 52 19.872 6.167 9.761 1.00 0.00 C ATOM 818 C GLU A 52 19.049 4.885 9.679 1.00 0.00 C ATOM 819 O GLU A 52 18.148 4.662 10.488 1.00 0.00 O ATOM 820 CB GLU A 52 19.327 7.204 8.773 1.00 0.00 C ATOM 821 CG GLU A 52 20.117 8.518 8.801 1.00 0.00 C ATOM 822 CD GLU A 52 21.204 8.529 7.737 1.00 0.00 C ATOM 823 OE1 GLU A 52 20.850 8.863 6.585 1.00 0.00 O ATOM 824 OE2 GLU A 52 22.355 8.186 8.081 1.00 0.00 O ATOM 0 H GLU A 52 21.669 6.280 8.675 1.00 0.00 H new ATOM 0 HA GLU A 52 19.794 6.599 10.759 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.354 6.790 7.765 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.282 7.408 9.006 1.00 0.00 H new ATOM 0 HG2 GLU A 52 19.439 9.356 8.641 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.566 8.655 9.785 1.00 0.00 H new ATOM 831 N ILE A 53 19.363 4.041 8.694 1.00 0.00 N ATOM 832 CA ILE A 53 18.647 2.795 8.485 1.00 0.00 C ATOM 833 C ILE A 53 18.717 1.910 9.733 1.00 0.00 C ATOM 834 O ILE A 53 17.713 1.290 10.064 1.00 0.00 O ATOM 835 CB ILE A 53 19.104 2.079 7.203 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.111 3.022 5.982 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.231 0.848 6.915 1.00 0.00 C ATOM 838 CD1 ILE A 53 17.803 3.784 5.751 1.00 0.00 C ATOM 0 H ILE A 53 20.116 4.206 8.027 1.00 0.00 H new ATOM 0 HA ILE A 53 17.594 3.029 8.327 1.00 0.00 H new ATOM 0 HB ILE A 53 20.129 1.751 7.376 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.919 3.744 6.103 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.337 2.437 5.090 1.00 0.00 H new ATOM 0 HG21 ILE A 53 18.577 0.362 6.003 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.302 0.149 7.748 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.194 1.159 6.789 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.903 4.421 4.872 1.00 0.00 H new ATOM 0 HD12 ILE A 53 16.991 3.074 5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.582 4.401 6.622 1.00 0.00 H new ATOM 850 N VAL A 54 19.844 1.854 10.455 1.00 0.00 N ATOM 851 CA VAL A 54 19.895 1.077 11.691 1.00 0.00 C ATOM 852 C VAL A 54 19.044 1.690 12.804 1.00 0.00 C ATOM 853 O VAL A 54 18.401 0.947 13.541 1.00 0.00 O ATOM 854 CB VAL A 54 21.310 0.689 12.149 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.846 -0.413 11.233 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.297 1.848 12.244 1.00 0.00 C ATOM 0 H VAL A 54 20.713 2.328 10.208 1.00 0.00 H new ATOM 0 HA VAL A 54 19.433 0.122 11.439 1.00 0.00 H new ATOM 0 HB VAL A 54 21.216 0.330 13.174 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.850 -0.694 11.551 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.191 -1.282 11.288 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.880 -0.048 10.206 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.266 1.474 12.575 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.403 2.317 11.266 1.00 0.00 H new ATOM 0 HG23 VAL A 54 21.928 2.582 12.960 1.00 0.00 H new ATOM 866 N LYS A 55 18.990 3.020 12.931 1.00 0.00 N ATOM 867 CA LYS A 55 18.062 3.634 13.882 1.00 0.00 C ATOM 868 C LYS A 55 16.622 3.257 13.512 1.00 0.00 C ATOM 869 O LYS A 55 15.860 2.753 14.334 1.00 0.00 O ATOM 870 CB LYS A 55 18.285 5.154 13.937 1.00 0.00 C ATOM 871 CG LYS A 55 17.234 5.912 14.768 1.00 0.00 C ATOM 872 CD LYS A 55 17.052 5.347 16.183 1.00 0.00 C ATOM 873 CE LYS A 55 16.074 6.216 16.980 1.00 0.00 C ATOM 874 NZ LYS A 55 15.649 5.542 18.219 1.00 0.00 N ATOM 0 H LYS A 55 19.563 3.677 12.401 1.00 0.00 H new ATOM 0 HA LYS A 55 18.250 3.254 14.886 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.273 5.351 14.353 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.283 5.548 12.921 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.524 6.960 14.838 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.277 5.880 14.246 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.679 4.324 16.128 1.00 0.00 H new ATOM 0 HD3 LYS A 55 18.014 5.309 16.693 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.545 7.168 17.224 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.201 6.441 16.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.310 6.250 18.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 14.882 4.873 18.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.454 5.026 18.627 1.00 0.00 H new ATOM 888 N LEU A 56 16.254 3.470 12.251 1.00 0.00 N ATOM 889 CA LEU A 56 14.953 3.087 11.723 1.00 0.00 C ATOM 890 C LEU A 56 14.662 1.600 11.990 1.00 0.00 C ATOM 891 O LEU A 56 13.574 1.244 12.439 1.00 0.00 O ATOM 892 CB LEU A 56 14.929 3.485 10.243 1.00 0.00 C ATOM 893 CG LEU A 56 13.801 2.846 9.428 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.299 3.834 8.369 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.319 1.596 8.712 1.00 0.00 C ATOM 0 H LEU A 56 16.859 3.918 11.562 1.00 0.00 H new ATOM 0 HA LEU A 56 14.141 3.610 12.229 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.840 4.569 10.174 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.884 3.214 9.792 1.00 0.00 H new ATOM 0 HG LEU A 56 12.991 2.580 10.107 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.497 3.373 7.793 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.924 4.733 8.859 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.119 4.100 7.702 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.511 1.147 8.134 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.134 1.871 8.043 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.681 0.879 9.448 1.00 0.00 H new ATOM 907 N MET A 57 15.640 0.729 11.739 1.00 0.00 N ATOM 908 CA MET A 57 15.533 -0.704 11.962 1.00 0.00 C ATOM 909 C MET A 57 15.306 -0.976 13.443 1.00 0.00 C ATOM 910 O MET A 57 14.462 -1.802 13.774 1.00 0.00 O ATOM 911 CB MET A 57 16.780 -1.404 11.410 1.00 0.00 C ATOM 912 CG MET A 57 16.906 -2.881 11.801 1.00 0.00 C ATOM 913 SD MET A 57 17.562 -3.212 13.461 1.00 0.00 S ATOM 914 CE MET A 57 19.261 -2.615 13.334 1.00 0.00 C ATOM 0 H MET A 57 16.547 1.012 11.367 1.00 0.00 H new ATOM 0 HA MET A 57 14.675 -1.111 11.428 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.772 -1.329 10.323 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.665 -0.872 11.760 1.00 0.00 H new ATOM 0 HG2 MET A 57 15.922 -3.342 11.722 1.00 0.00 H new ATOM 0 HG3 MET A 57 17.549 -3.376 11.073 1.00 0.00 H new ATOM 0 HE1 MET A 57 19.839 -2.979 14.183 1.00 0.00 H new ATOM 0 HE2 MET A 57 19.707 -2.980 12.409 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.265 -1.525 13.333 1.00 0.00 H new ATOM 924 N ASP A 58 16.027 -0.283 14.329 1.00 0.00 N ATOM 925 CA ASP A 58 15.793 -0.381 15.761 1.00 0.00 C ATOM 926 C ASP A 58 14.336 -0.023 16.062 1.00 0.00 C ATOM 927 O ASP A 58 13.640 -0.741 16.773 1.00 0.00 O ATOM 928 CB ASP A 58 16.774 0.500 16.543 1.00 0.00 C ATOM 929 CG ASP A 58 16.481 0.452 18.038 1.00 0.00 C ATOM 930 OD1 ASP A 58 16.970 -0.498 18.685 1.00 0.00 O ATOM 931 OD2 ASP A 58 15.780 1.376 18.508 1.00 0.00 O ATOM 0 H ASP A 58 16.781 0.354 14.071 1.00 0.00 H new ATOM 0 HA ASP A 58 15.970 -1.406 16.086 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.795 0.166 16.358 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.706 1.529 16.189 1.00 0.00 H new ATOM 936 N ASP A 59 13.857 1.085 15.495 1.00 0.00 N ATOM 937 CA ASP A 59 12.492 1.537 15.729 1.00 0.00 C ATOM 938 C ASP A 59 11.466 0.505 15.252 1.00 0.00 C ATOM 939 O ASP A 59 10.495 0.249 15.959 1.00 0.00 O ATOM 940 CB ASP A 59 12.245 2.909 15.084 1.00 0.00 C ATOM 941 CG ASP A 59 13.214 3.991 15.561 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.542 3.985 16.768 1.00 0.00 O ATOM 943 OD2 ASP A 59 13.598 4.822 14.709 1.00 0.00 O ATOM 0 H ASP A 59 14.397 1.684 14.871 1.00 0.00 H new ATOM 0 HA ASP A 59 12.364 1.647 16.806 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.325 2.812 14.001 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.225 3.225 15.301 1.00 0.00 H new ATOM 948 N LEU A 60 11.672 -0.088 14.071 1.00 0.00 N ATOM 949 CA LEU A 60 10.848 -1.192 13.577 1.00 0.00 C ATOM 950 C LEU A 60 10.928 -2.392 14.535 1.00 0.00 C ATOM 951 O LEU A 60 9.910 -2.846 15.056 1.00 0.00 O ATOM 952 CB LEU A 60 11.287 -1.579 12.143 1.00 0.00 C ATOM 953 CG LEU A 60 10.655 -0.731 11.017 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.564 -0.622 9.788 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.358 -1.361 10.491 1.00 0.00 C ATOM 0 H LEU A 60 12.417 0.186 13.431 1.00 0.00 H new ATOM 0 HA LEU A 60 9.807 -0.872 13.537 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.372 -1.495 12.076 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.037 -2.626 11.973 1.00 0.00 H new ATOM 0 HG LEU A 60 10.482 0.244 11.473 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.074 -0.016 9.026 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.506 -0.154 10.073 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.759 -1.618 9.390 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.944 -0.735 9.700 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.571 -2.354 10.094 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.637 -1.442 11.304 1.00 0.00 H new ATOM 967 N ASP A 61 12.131 -2.932 14.751 1.00 0.00 N ATOM 968 CA ASP A 61 12.331 -4.197 15.453 1.00 0.00 C ATOM 969 C ASP A 61 12.023 -4.122 16.945 1.00 0.00 C ATOM 970 O ASP A 61 11.717 -5.155 17.534 1.00 0.00 O ATOM 971 CB ASP A 61 13.693 -4.836 15.128 1.00 0.00 C ATOM 972 CG ASP A 61 14.898 -4.291 15.896 1.00 0.00 C ATOM 973 OD1 ASP A 61 14.725 -3.346 16.688 1.00 0.00 O ATOM 974 OD2 ASP A 61 15.994 -4.848 15.675 1.00 0.00 O ATOM 0 H ASP A 61 12.999 -2.497 14.439 1.00 0.00 H new ATOM 0 HA ASP A 61 11.581 -4.884 15.060 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.622 -5.907 15.318 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.883 -4.713 14.062 1.00 0.00 H new ATOM 979 N ARG A 62 12.052 -2.917 17.534 1.00 0.00 N ATOM 980 CA ARG A 62 11.584 -2.605 18.882 1.00 0.00 C ATOM 981 C ARG A 62 10.437 -3.537 19.279 1.00 0.00 C ATOM 982 O ARG A 62 10.514 -4.240 20.287 1.00 0.00 O ATOM 983 CB ARG A 62 11.105 -1.147 18.850 1.00 0.00 C ATOM 984 CG ARG A 62 10.485 -0.611 20.145 1.00 0.00 C ATOM 985 CD ARG A 62 9.353 0.367 19.798 1.00 0.00 C ATOM 986 NE ARG A 62 8.101 -0.346 19.489 1.00 0.00 N ATOM 987 CZ ARG A 62 7.515 -0.508 18.291 1.00 0.00 C ATOM 988 NH1 ARG A 62 8.101 -0.137 17.146 1.00 0.00 N ATOM 989 NH2 ARG A 62 6.301 -1.066 18.248 1.00 0.00 N ATOM 0 H ARG A 62 12.422 -2.096 17.054 1.00 0.00 H new ATOM 0 HA ARG A 62 12.379 -2.741 19.616 1.00 0.00 H new ATOM 0 HB2 ARG A 62 11.952 -0.513 18.588 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.371 -1.045 18.051 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.098 -1.435 20.745 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.244 -0.109 20.745 1.00 0.00 H new ATOM 0 HD2 ARG A 62 9.189 1.047 20.634 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.646 0.977 18.944 1.00 0.00 H new ATOM 0 HE ARG A 62 7.620 -0.769 20.283 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.029 0.287 17.162 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.620 -0.278 16.258 1.00 0.00 H new ATOM 0 HH21 ARG A 62 5.843 -1.357 19.111 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.833 -1.201 17.352 1.00 0.00 H new ATOM 1003 N ASN A 63 9.402 -3.551 18.432 1.00 0.00 N ATOM 1004 CA ASN A 63 8.215 -4.388 18.519 1.00 0.00 C ATOM 1005 C ASN A 63 8.455 -5.769 19.124 1.00 0.00 C ATOM 1006 O ASN A 63 7.726 -6.175 20.026 1.00 0.00 O ATOM 1007 CB ASN A 63 7.629 -4.496 17.113 1.00 0.00 C ATOM 1008 CG ASN A 63 6.592 -5.599 16.946 1.00 0.00 C ATOM 1009 OD1 ASN A 63 6.696 -6.408 16.030 1.00 0.00 O ATOM 1010 ND2 ASN A 63 5.574 -5.638 17.801 1.00 0.00 N ATOM 0 H ASN A 63 9.376 -2.937 17.618 1.00 0.00 H new ATOM 0 HA ASN A 63 7.518 -3.915 19.210 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.173 -3.542 16.849 1.00 0.00 H new ATOM 0 HB3 ASN A 63 8.441 -4.668 16.406 1.00 0.00 H new ATOM 0 HD21 ASN A 63 4.854 -6.354 17.704 1.00 0.00 H new ATOM 0 HD22 ASN A 63 5.513 -4.952 18.553 1.00 0.00 H new ATOM 1017 N LYS A 64 9.446 -6.493 18.609 1.00 0.00 N ATOM 1018 CA LYS A 64 9.874 -7.770 19.164 1.00 0.00 C ATOM 1019 C LYS A 64 11.399 -7.795 19.206 1.00 0.00 C ATOM 1020 O LYS A 64 12.018 -8.717 18.675 1.00 0.00 O ATOM 1021 CB LYS A 64 9.281 -8.944 18.367 1.00 0.00 C ATOM 1022 CG LYS A 64 7.753 -9.002 18.475 1.00 0.00 C ATOM 1023 CD LYS A 64 7.216 -10.221 17.716 1.00 0.00 C ATOM 1024 CE LYS A 64 5.685 -10.290 17.777 1.00 0.00 C ATOM 1025 NZ LYS A 64 5.198 -10.499 19.152 1.00 0.00 N ATOM 0 H LYS A 64 9.978 -6.205 17.788 1.00 0.00 H new ATOM 0 HA LYS A 64 9.500 -7.883 20.182 1.00 0.00 H new ATOM 0 HB2 LYS A 64 9.566 -8.851 17.319 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.705 -9.880 18.731 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.457 -9.057 19.523 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.317 -8.090 18.068 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.538 -10.174 16.676 1.00 0.00 H new ATOM 0 HD3 LYS A 64 7.640 -11.131 18.140 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.264 -9.367 17.379 1.00 0.00 H new ATOM 0 HE3 LYS A 64 5.333 -11.101 17.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.176 -10.692 19.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.695 -11.308 19.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.379 -9.645 19.718 1.00 0.00 H new ATOM 1039 N ASP A 65 11.983 -6.779 19.856 1.00 0.00 N ATOM 1040 CA ASP A 65 13.408 -6.574 20.124 1.00 0.00 C ATOM 1041 C ASP A 65 14.339 -6.644 18.905 1.00 0.00 C ATOM 1042 O ASP A 65 15.002 -5.663 18.586 1.00 0.00 O ATOM 1043 CB ASP A 65 13.898 -7.393 21.333 1.00 0.00 C ATOM 1044 CG ASP A 65 13.891 -8.908 21.137 1.00 0.00 C ATOM 1045 OD1 ASP A 65 12.850 -9.518 21.462 1.00 0.00 O ATOM 1046 OD2 ASP A 65 14.936 -9.436 20.691 1.00 0.00 O ATOM 0 H ASP A 65 11.422 -6.018 20.238 1.00 0.00 H new ATOM 0 HA ASP A 65 13.479 -5.523 20.405 1.00 0.00 H new ATOM 0 HB2 ASP A 65 14.913 -7.079 21.577 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.274 -7.151 22.193 1.00 0.00 H new ATOM 1051 N GLN A 66 14.437 -7.805 18.264 1.00 0.00 N ATOM 1052 CA GLN A 66 15.294 -8.097 17.122 1.00 0.00 C ATOM 1053 C GLN A 66 14.477 -8.554 15.907 1.00 0.00 C ATOM 1054 O GLN A 66 15.059 -8.876 14.866 1.00 0.00 O ATOM 1055 CB GLN A 66 16.292 -9.181 17.537 1.00 0.00 C ATOM 1056 CG GLN A 66 17.293 -8.651 18.569 1.00 0.00 C ATOM 1057 CD GLN A 66 18.083 -9.799 19.177 1.00 0.00 C ATOM 1058 OE1 GLN A 66 19.203 -10.076 18.760 1.00 0.00 O ATOM 1059 NE2 GLN A 66 17.493 -10.485 20.150 1.00 0.00 N ATOM 0 H GLN A 66 13.886 -8.616 18.546 1.00 0.00 H new ATOM 0 HA GLN A 66 15.822 -7.190 16.826 1.00 0.00 H new ATOM 0 HB2 GLN A 66 15.754 -10.033 17.953 1.00 0.00 H new ATOM 0 HB3 GLN A 66 16.828 -9.540 16.659 1.00 0.00 H new ATOM 0 HG2 GLN A 66 17.973 -7.943 18.095 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.764 -8.109 19.353 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.560 -10.221 20.467 1.00 0.00 H new ATOM 0 HE22 GLN A 66 17.973 -11.276 20.580 1.00 0.00 H new ATOM 1068 N GLU A 67 13.144 -8.593 16.025 1.00 0.00 N ATOM 1069 CA GLU A 67 12.250 -8.934 14.933 1.00 0.00 C ATOM 1070 C GLU A 67 11.144 -7.886 14.810 1.00 0.00 C ATOM 1071 O GLU A 67 10.738 -7.276 15.796 1.00 0.00 O ATOM 1072 CB GLU A 67 11.654 -10.330 15.145 1.00 0.00 C ATOM 1073 CG GLU A 67 12.726 -11.406 15.346 1.00 0.00 C ATOM 1074 CD GLU A 67 12.110 -12.799 15.277 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.476 -13.191 16.280 1.00 0.00 O ATOM 1076 OE2 GLU A 67 12.277 -13.442 14.218 1.00 0.00 O ATOM 0 H GLU A 67 12.658 -8.384 16.897 1.00 0.00 H new ATOM 0 HA GLU A 67 12.820 -8.945 14.004 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.996 -10.312 16.014 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.038 -10.592 14.285 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.497 -11.306 14.582 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.213 -11.266 16.311 1.00 0.00 H new ATOM 1083 N VAL A 68 10.661 -7.698 13.585 1.00 0.00 N ATOM 1084 CA VAL A 68 9.539 -6.841 13.235 1.00 0.00 C ATOM 1085 C VAL A 68 8.374 -7.769 12.899 1.00 0.00 C ATOM 1086 O VAL A 68 8.528 -8.613 12.019 1.00 0.00 O ATOM 1087 CB VAL A 68 9.887 -6.009 11.984 1.00 0.00 C ATOM 1088 CG1 VAL A 68 8.895 -4.853 11.839 1.00 0.00 C ATOM 1089 CG2 VAL A 68 11.319 -5.462 11.971 1.00 0.00 C ATOM 0 H VAL A 68 11.063 -8.164 12.772 1.00 0.00 H new ATOM 0 HA VAL A 68 9.297 -6.161 14.052 1.00 0.00 H new ATOM 0 HB VAL A 68 9.815 -6.693 11.138 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.145 -4.268 10.954 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.885 -5.251 11.738 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.947 -4.216 12.722 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.481 -4.889 11.058 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.470 -4.816 12.836 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.026 -6.291 12.010 1.00 0.00 H new ATOM 1099 N ASN A 69 7.212 -7.657 13.547 1.00 0.00 N ATOM 1100 CA ASN A 69 6.035 -8.390 13.084 1.00 0.00 C ATOM 1101 C ASN A 69 5.406 -7.663 11.895 1.00 0.00 C ATOM 1102 O ASN A 69 5.530 -6.449 11.759 1.00 0.00 O ATOM 1103 CB ASN A 69 5.015 -8.547 14.222 1.00 0.00 C ATOM 1104 CG ASN A 69 3.610 -8.900 13.728 1.00 0.00 C ATOM 1105 OD1 ASN A 69 2.712 -8.067 13.767 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.398 -10.099 13.198 1.00 0.00 N ATOM 0 H ASN A 69 7.063 -7.080 14.375 1.00 0.00 H new ATOM 0 HA ASN A 69 6.343 -9.386 12.765 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.359 -9.324 14.905 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.970 -7.619 14.792 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.481 -10.334 12.818 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.152 -10.785 13.170 1.00 0.00 H new ATOM 1113 N PHE A 70 4.696 -8.409 11.049 1.00 0.00 N ATOM 1114 CA PHE A 70 3.929 -7.869 9.937 1.00 0.00 C ATOM 1115 C PHE A 70 3.125 -6.606 10.300 1.00 0.00 C ATOM 1116 O PHE A 70 3.252 -5.574 9.640 1.00 0.00 O ATOM 1117 CB PHE A 70 3.036 -8.983 9.382 1.00 0.00 C ATOM 1118 CG PHE A 70 2.142 -8.505 8.268 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.710 -8.133 7.037 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.797 -8.205 8.541 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.937 -7.455 6.083 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.021 -7.541 7.581 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.592 -7.154 6.357 1.00 0.00 C ATOM 0 H PHE A 70 4.640 -9.425 11.123 1.00 0.00 H new ATOM 0 HA PHE A 70 4.625 -7.533 9.168 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.661 -9.798 9.017 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.423 -9.388 10.187 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.742 -8.369 6.826 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.362 -8.485 9.489 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.375 -7.165 5.139 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.018 -7.326 7.783 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.003 -6.625 5.627 1.00 0.00 H new ATOM 1133 N GLN A 71 2.298 -6.654 11.350 1.00 0.00 N ATOM 1134 CA GLN A 71 1.436 -5.524 11.678 1.00 0.00 C ATOM 1135 C GLN A 71 2.267 -4.311 12.117 1.00 0.00 C ATOM 1136 O GLN A 71 1.926 -3.171 11.790 1.00 0.00 O ATOM 1137 CB GLN A 71 0.397 -5.940 12.727 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.768 -4.939 12.775 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.834 -5.336 13.791 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.173 -4.561 14.678 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -2.378 -6.546 13.677 1.00 0.00 N ATOM 0 H GLN A 71 2.211 -7.454 11.977 1.00 0.00 H new ATOM 0 HA GLN A 71 0.891 -5.218 10.785 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.017 -6.935 12.493 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.869 -6.001 13.707 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.384 -3.950 13.024 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.221 -4.866 11.787 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.078 -7.172 12.929 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.095 -6.847 14.337 1.00 0.00 H new ATOM 1150 N GLU A 72 3.372 -4.555 12.832 1.00 0.00 N ATOM 1151 CA GLU A 72 4.334 -3.511 13.157 1.00 0.00 C ATOM 1152 C GLU A 72 4.881 -2.906 11.872 1.00 0.00 C ATOM 1153 O GLU A 72 4.921 -1.689 11.743 1.00 0.00 O ATOM 1154 CB GLU A 72 5.476 -4.051 14.032 1.00 0.00 C ATOM 1155 CG GLU A 72 6.653 -3.063 14.141 1.00 0.00 C ATOM 1156 CD GLU A 72 6.300 -1.765 14.862 1.00 0.00 C ATOM 1157 OE1 GLU A 72 5.376 -1.802 15.704 1.00 0.00 O ATOM 1158 OE2 GLU A 72 6.985 -0.754 14.593 1.00 0.00 O ATOM 0 H GLU A 72 3.617 -5.476 13.196 1.00 0.00 H new ATOM 0 HA GLU A 72 3.824 -2.737 13.731 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.094 -4.267 15.030 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.834 -4.993 13.616 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.475 -3.548 14.667 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.011 -2.826 13.139 1.00 0.00 H new ATOM 1165 N TYR A 73 5.337 -3.743 10.939 1.00 0.00 N ATOM 1166 CA TYR A 73 5.865 -3.283 9.666 1.00 0.00 C ATOM 1167 C TYR A 73 4.859 -2.355 8.978 1.00 0.00 C ATOM 1168 O TYR A 73 5.211 -1.229 8.626 1.00 0.00 O ATOM 1169 CB TYR A 73 6.277 -4.491 8.820 1.00 0.00 C ATOM 1170 CG TYR A 73 6.390 -4.241 7.332 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.614 -3.831 6.774 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.311 -4.575 6.489 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.766 -3.772 5.377 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.458 -4.489 5.097 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.683 -4.094 4.539 1.00 0.00 C ATOM 1176 OH TYR A 73 6.785 -3.935 3.190 1.00 0.00 O ATOM 0 H TYR A 73 5.348 -4.757 11.050 1.00 0.00 H new ATOM 0 HA TYR A 73 6.764 -2.685 9.816 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.238 -4.855 9.183 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.552 -5.289 8.982 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.438 -3.561 7.418 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.372 -4.897 6.915 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.713 -3.480 4.948 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.625 -4.728 4.452 1.00 0.00 H new ATOM 0 HH TYR A 73 6.200 -4.580 2.739 1.00 0.00 H new ATOM 1186 N ILE A 74 3.604 -2.790 8.825 1.00 0.00 N ATOM 1187 CA ILE A 74 2.574 -1.941 8.226 1.00 0.00 C ATOM 1188 C ILE A 74 2.440 -0.626 9.014 1.00 0.00 C ATOM 1189 O ILE A 74 2.550 0.459 8.442 1.00 0.00 O ATOM 1190 CB ILE A 74 1.228 -2.683 8.116 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.296 -3.984 7.289 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.170 -1.735 7.532 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.536 -3.784 5.791 1.00 0.00 C ATOM 0 H ILE A 74 3.281 -3.716 9.105 1.00 0.00 H new ATOM 0 HA ILE A 74 2.881 -1.693 7.210 1.00 0.00 H new ATOM 0 HB ILE A 74 0.955 -2.989 9.126 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.093 -4.610 7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.363 -4.531 7.423 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.783 -2.258 7.453 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.056 -0.870 8.185 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.485 -1.404 6.542 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.568 -4.754 5.295 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.727 -3.187 5.369 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.484 -3.268 5.640 1.00 0.00 H new ATOM 1205 N THR A 75 2.217 -0.718 10.330 1.00 0.00 N ATOM 1206 CA THR A 75 2.097 0.442 11.214 1.00 0.00 C ATOM 1207 C THR A 75 3.238 1.432 10.980 1.00 0.00 C ATOM 1208 O THR A 75 3.013 2.625 10.767 1.00 0.00 O ATOM 1209 CB THR A 75 2.069 -0.038 12.673 1.00 0.00 C ATOM 1210 OG1 THR A 75 0.903 -0.809 12.863 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.107 1.105 13.693 1.00 0.00 C ATOM 0 H THR A 75 2.114 -1.610 10.814 1.00 0.00 H new ATOM 0 HA THR A 75 1.168 0.967 10.993 1.00 0.00 H new ATOM 0 HB THR A 75 2.970 -0.627 12.845 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.056 -1.720 12.535 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.084 0.693 14.702 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.021 1.683 13.557 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.243 1.753 13.546 1.00 0.00 H new ATOM 1219 N PHE A 76 4.467 0.925 11.014 1.00 0.00 N ATOM 1220 CA PHE A 76 5.667 1.714 10.856 1.00 0.00 C ATOM 1221 C PHE A 76 5.727 2.316 9.459 1.00 0.00 C ATOM 1222 O PHE A 76 6.110 3.467 9.326 1.00 0.00 O ATOM 1223 CB PHE A 76 6.907 0.873 11.142 1.00 0.00 C ATOM 1224 CG PHE A 76 8.181 1.691 11.054 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.799 1.897 9.805 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.664 2.369 12.190 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.912 2.743 9.698 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.753 3.251 12.073 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.369 3.446 10.824 1.00 0.00 C ATOM 0 H PHE A 76 4.652 -0.068 11.156 1.00 0.00 H new ATOM 0 HA PHE A 76 5.642 2.530 11.578 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.826 0.434 12.136 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.957 0.047 10.432 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.414 1.401 8.926 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.198 2.211 13.151 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.417 2.854 8.750 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.116 3.779 12.942 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.194 4.137 10.731 1.00 0.00 H new ATOM 1239 N LEU A 77 5.351 1.584 8.407 1.00 0.00 N ATOM 1240 CA LEU A 77 5.235 2.199 7.089 1.00 0.00 C ATOM 1241 C LEU A 77 4.239 3.364 7.135 1.00 0.00 C ATOM 1242 O LEU A 77 4.463 4.395 6.505 1.00 0.00 O ATOM 1243 CB LEU A 77 4.907 1.154 6.013 1.00 0.00 C ATOM 1244 CG LEU A 77 6.110 0.242 5.715 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.691 -0.918 4.815 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.239 0.975 4.985 1.00 0.00 C ATOM 0 H LEU A 77 5.127 0.589 8.442 1.00 0.00 H new ATOM 0 HA LEU A 77 6.199 2.620 6.803 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.063 0.547 6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.599 1.659 5.098 1.00 0.00 H new ATOM 0 HG LEU A 77 6.465 -0.105 6.686 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.554 -1.553 4.614 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.918 -1.503 5.312 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.302 -0.527 3.875 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.062 0.284 4.800 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.868 1.360 4.035 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.592 1.803 5.599 1.00 0.00 H new ATOM 1258 N GLY A 78 3.177 3.244 7.936 1.00 0.00 N ATOM 1259 CA GLY A 78 2.304 4.371 8.237 1.00 0.00 C ATOM 1260 C GLY A 78 3.087 5.526 8.863 1.00 0.00 C ATOM 1261 O GLY A 78 3.014 6.660 8.390 1.00 0.00 O ATOM 0 H GLY A 78 2.904 2.371 8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.817 4.711 7.323 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.515 4.052 8.918 1.00 0.00 H new ATOM 1265 N ALA A 79 3.864 5.247 9.909 1.00 0.00 N ATOM 1266 CA ALA A 79 4.728 6.259 10.509 1.00 0.00 C ATOM 1267 C ALA A 79 5.651 6.884 9.458 1.00 0.00 C ATOM 1268 O ALA A 79 5.835 8.095 9.432 1.00 0.00 O ATOM 1269 CB ALA A 79 5.528 5.676 11.678 1.00 0.00 C ATOM 0 H ALA A 79 3.912 4.331 10.356 1.00 0.00 H new ATOM 0 HA ALA A 79 4.094 7.052 10.906 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.163 6.451 12.107 1.00 0.00 H new ATOM 0 HB2 ALA A 79 4.842 5.307 12.440 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.149 4.855 11.320 1.00 0.00 H new ATOM 1275 N LEU A 80 6.217 6.068 8.569 1.00 0.00 N ATOM 1276 CA LEU A 80 7.119 6.491 7.513 1.00 0.00 C ATOM 1277 C LEU A 80 6.392 7.443 6.562 1.00 0.00 C ATOM 1278 O LEU A 80 6.919 8.498 6.220 1.00 0.00 O ATOM 1279 CB LEU A 80 7.675 5.251 6.794 1.00 0.00 C ATOM 1280 CG LEU A 80 9.016 5.489 6.087 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.156 5.733 7.084 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.373 4.243 5.270 1.00 0.00 C ATOM 0 H LEU A 80 6.051 5.062 8.569 1.00 0.00 H new ATOM 0 HA LEU A 80 7.965 7.038 7.930 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.796 4.447 7.520 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.944 4.911 6.060 1.00 0.00 H new ATOM 0 HG LEU A 80 8.904 6.372 5.457 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.086 5.897 6.540 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.929 6.612 7.688 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.264 4.864 7.733 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.325 4.401 4.763 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.454 3.383 5.935 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.594 4.057 4.530 1.00 0.00 H new ATOM 1294 N ALA A 81 5.160 7.096 6.178 1.00 0.00 N ATOM 1295 CA ALA A 81 4.287 7.974 5.410 1.00 0.00 C ATOM 1296 C ALA A 81 4.121 9.314 6.135 1.00 0.00 C ATOM 1297 O ALA A 81 4.299 10.382 5.546 1.00 0.00 O ATOM 1298 CB ALA A 81 2.943 7.285 5.155 1.00 0.00 C ATOM 0 H ALA A 81 4.742 6.191 6.395 1.00 0.00 H new ATOM 0 HA ALA A 81 4.737 8.181 4.439 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.297 7.949 4.580 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.107 6.364 4.595 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.467 7.051 6.108 1.00 0.00 H new ATOM 1304 N MET A 82 3.805 9.255 7.433 1.00 0.00 N ATOM 1305 CA MET A 82 3.643 10.441 8.260 1.00 0.00 C ATOM 1306 C MET A 82 4.925 11.286 8.268 1.00 0.00 C ATOM 1307 O MET A 82 4.862 12.507 8.137 1.00 0.00 O ATOM 1308 CB MET A 82 3.174 10.035 9.667 1.00 0.00 C ATOM 1309 CG MET A 82 2.355 11.129 10.366 1.00 0.00 C ATOM 1310 SD MET A 82 3.239 12.642 10.826 1.00 0.00 S ATOM 1311 CE MET A 82 1.887 13.586 11.560 1.00 0.00 C ATOM 0 H MET A 82 3.656 8.379 7.934 1.00 0.00 H new ATOM 0 HA MET A 82 2.869 11.080 7.835 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.573 9.129 9.596 1.00 0.00 H new ATOM 0 HB3 MET A 82 4.044 9.794 10.278 1.00 0.00 H new ATOM 0 HG2 MET A 82 1.528 11.404 9.712 1.00 0.00 H new ATOM 0 HG3 MET A 82 1.919 10.702 11.269 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.260 14.552 11.899 1.00 0.00 H new ATOM 0 HE2 MET A 82 1.105 13.739 10.817 1.00 0.00 H new ATOM 0 HE3 MET A 82 1.479 13.037 12.408 1.00 0.00 H new ATOM 1321 N ILE A 83 6.084 10.637 8.403 1.00 0.00 N ATOM 1322 CA ILE A 83 7.394 11.279 8.449 1.00 0.00 C ATOM 1323 C ILE A 83 7.715 11.934 7.104 1.00 0.00 C ATOM 1324 O ILE A 83 8.190 13.067 7.080 1.00 0.00 O ATOM 1325 CB ILE A 83 8.466 10.265 8.899 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.279 9.953 10.397 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.889 10.794 8.656 1.00 0.00 C ATOM 1328 CD1 ILE A 83 8.974 8.656 10.828 1.00 0.00 C ATOM 0 H ILE A 83 6.135 9.622 8.485 1.00 0.00 H new ATOM 0 HA ILE A 83 7.385 12.079 9.189 1.00 0.00 H new ATOM 0 HB ILE A 83 8.342 9.358 8.307 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.670 10.782 10.987 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.214 9.879 10.617 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.615 10.051 8.986 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.028 10.990 7.593 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.035 11.717 9.217 1.00 0.00 H new ATOM 0 HD11 ILE A 83 8.807 8.490 11.892 1.00 0.00 H new ATOM 0 HD12 ILE A 83 8.566 7.819 10.262 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.044 8.736 10.637 1.00 0.00 H new ATOM 1340 N TYR A 84 7.457 11.245 5.985 1.00 0.00 N ATOM 1341 CA TYR A 84 7.562 11.850 4.659 1.00 0.00 C ATOM 1342 C TYR A 84 6.707 13.117 4.631 1.00 0.00 C ATOM 1343 O TYR A 84 7.156 14.164 4.170 1.00 0.00 O ATOM 1344 CB TYR A 84 7.147 10.854 3.566 1.00 0.00 C ATOM 1345 CG TYR A 84 7.977 9.586 3.425 1.00 0.00 C ATOM 1346 CD1 TYR A 84 9.268 9.473 3.984 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.480 8.539 2.625 1.00 0.00 C ATOM 1348 CE1 TYR A 84 10.060 8.342 3.718 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.273 7.409 2.362 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.566 7.317 2.895 1.00 0.00 C ATOM 1351 OH TYR A 84 10.334 6.225 2.622 1.00 0.00 O ATOM 0 H TYR A 84 7.173 10.265 5.976 1.00 0.00 H new ATOM 0 HA TYR A 84 8.598 12.119 4.455 1.00 0.00 H new ATOM 0 HB2 TYR A 84 6.113 10.562 3.751 1.00 0.00 H new ATOM 0 HB3 TYR A 84 7.164 11.376 2.610 1.00 0.00 H new ATOM 0 HD1 TYR A 84 9.649 10.259 4.619 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.484 8.605 2.212 1.00 0.00 H new ATOM 0 HE1 TYR A 84 11.048 8.262 4.147 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.885 6.610 1.748 1.00 0.00 H new ATOM 0 HH TYR A 84 9.838 5.614 2.039 1.00 0.00 H new ATOM 1361 N ASN A 85 5.480 13.015 5.147 1.00 0.00 N ATOM 1362 CA ASN A 85 4.598 14.128 5.479 1.00 0.00 C ATOM 1363 C ASN A 85 4.004 14.832 4.262 1.00 0.00 C ATOM 1364 O ASN A 85 2.786 14.893 4.119 1.00 0.00 O ATOM 1365 CB ASN A 85 5.290 15.115 6.430 1.00 0.00 C ATOM 1366 CG ASN A 85 4.262 15.813 7.310 1.00 0.00 C ATOM 1367 OD1 ASN A 85 3.936 16.976 7.102 1.00 0.00 O ATOM 1368 ND2 ASN A 85 3.738 15.097 8.301 1.00 0.00 N ATOM 0 H ASN A 85 5.058 12.110 5.353 1.00 0.00 H new ATOM 0 HA ASN A 85 3.745 13.691 5.998 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.011 14.585 7.052 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.848 15.854 5.855 1.00 0.00 H new ATOM 0 HD21 ASN A 85 3.041 15.514 8.918 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.034 14.131 8.444 1.00 0.00 H new ATOM 1375 N GLU A 86 4.844 15.338 3.359 1.00 0.00 N ATOM 1376 CA GLU A 86 4.400 15.905 2.092 1.00 0.00 C ATOM 1377 C GLU A 86 3.499 14.903 1.369 1.00 0.00 C ATOM 1378 O GLU A 86 2.456 15.278 0.842 1.00 0.00 O ATOM 1379 CB GLU A 86 5.615 16.313 1.245 1.00 0.00 C ATOM 1380 CG GLU A 86 5.218 16.914 -0.115 1.00 0.00 C ATOM 1381 CD GLU A 86 4.259 18.096 0.011 1.00 0.00 C ATOM 1382 OE1 GLU A 86 4.538 18.969 0.861 1.00 0.00 O ATOM 1383 OE2 GLU A 86 3.259 18.101 -0.739 1.00 0.00 O ATOM 0 H GLU A 86 5.855 15.365 3.489 1.00 0.00 H new ATOM 0 HA GLU A 86 3.814 16.806 2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.211 17.039 1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.248 15.441 1.081 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.117 17.237 -0.639 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.754 16.140 -0.726 1.00 0.00 H new ATOM 1390 N ALA A 87 3.874 13.621 1.415 1.00 0.00 N ATOM 1391 CA ALA A 87 3.084 12.510 0.899 1.00 0.00 C ATOM 1392 C ALA A 87 1.610 12.591 1.320 1.00 0.00 C ATOM 1393 O ALA A 87 0.728 12.274 0.527 1.00 0.00 O ATOM 1394 CB ALA A 87 3.705 11.193 1.372 1.00 0.00 C ATOM 0 H ALA A 87 4.760 13.324 1.824 1.00 0.00 H new ATOM 0 HA ALA A 87 3.099 12.563 -0.190 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.119 10.357 0.990 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.728 11.119 1.002 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.711 11.164 2.462 1.00 0.00 H new ATOM 1400 N LEU A 88 1.340 13.009 2.562 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.016 13.133 3.083 1.00 0.00 C ATOM 1402 C LEU A 88 -0.815 14.168 2.285 1.00 0.00 C ATOM 1403 O LEU A 88 -2.028 14.047 2.145 1.00 0.00 O ATOM 1404 CB LEU A 88 0.010 13.538 4.566 1.00 0.00 C ATOM 1405 CG LEU A 88 0.912 12.688 5.480 1.00 0.00 C ATOM 1406 CD1 LEU A 88 0.999 13.371 6.851 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.393 11.258 5.652 1.00 0.00 C ATOM 0 H LEU A 88 2.063 13.271 3.233 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.500 12.161 2.985 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.333 14.577 4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.008 13.496 4.952 1.00 0.00 H new ATOM 0 HG LEU A 88 1.894 12.617 5.013 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.635 12.781 7.512 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.423 14.368 6.734 1.00 0.00 H new ATOM 0 HD13 LEU A 88 0.001 13.449 7.283 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.066 10.703 6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.603 11.283 6.094 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.346 10.769 4.679 1.00 0.00 H new ATOM 1479 N SER B 3 9.932 2.460 -5.961 1.00 0.00 N ATOM 1480 CA SER B 3 8.759 2.865 -6.715 1.00 0.00 C ATOM 1481 C SER B 3 7.492 2.041 -6.421 1.00 0.00 C ATOM 1482 O SER B 3 6.516 2.638 -5.965 1.00 0.00 O ATOM 1483 CB SER B 3 9.136 2.962 -8.198 1.00 0.00 C ATOM 1484 OG SER B 3 10.425 3.545 -8.290 1.00 0.00 O ATOM 0 HA SER B 3 8.455 3.855 -6.376 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.132 1.973 -8.657 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.406 3.566 -8.737 1.00 0.00 H new ATOM 0 HG SER B 3 10.886 3.457 -7.430 1.00 0.00 H new ATOM 1490 N PRO B 4 7.462 0.709 -6.639 1.00 0.00 N ATOM 1491 CA PRO B 4 6.300 -0.112 -6.319 1.00 0.00 C ATOM 1492 C PRO B 4 5.808 0.081 -4.879 1.00 0.00 C ATOM 1493 O PRO B 4 4.606 0.229 -4.657 1.00 0.00 O ATOM 1494 CB PRO B 4 6.669 -1.564 -6.646 1.00 0.00 C ATOM 1495 CG PRO B 4 8.181 -1.552 -6.828 1.00 0.00 C ATOM 1496 CD PRO B 4 8.481 -0.119 -7.264 1.00 0.00 C ATOM 0 HA PRO B 4 5.446 0.196 -6.922 1.00 0.00 H new ATOM 0 HB2 PRO B 4 6.373 -2.238 -5.842 1.00 0.00 H new ATOM 0 HB3 PRO B 4 6.165 -1.906 -7.550 1.00 0.00 H new ATOM 0 HG2 PRO B 4 8.698 -1.806 -5.902 1.00 0.00 H new ATOM 0 HG3 PRO B 4 8.500 -2.274 -7.579 1.00 0.00 H new ATOM 0 HD2 PRO B 4 9.479 0.185 -6.948 1.00 0.00 H new ATOM 0 HD3 PRO B 4 8.448 -0.026 -8.350 1.00 0.00 H new ATOM 1504 N LEU B 5 6.707 0.109 -3.888 1.00 0.00 N ATOM 1505 CA LEU B 5 6.258 0.352 -2.524 1.00 0.00 C ATOM 1506 C LEU B 5 5.696 1.767 -2.397 1.00 0.00 C ATOM 1507 O LEU B 5 4.621 1.954 -1.833 1.00 0.00 O ATOM 1508 CB LEU B 5 7.371 0.107 -1.499 1.00 0.00 C ATOM 1509 CG LEU B 5 6.864 0.348 -0.063 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.685 -0.553 0.317 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.974 0.087 0.948 1.00 0.00 C ATOM 0 H LEU B 5 7.711 -0.029 -4.002 1.00 0.00 H new ATOM 0 HA LEU B 5 5.464 -0.362 -2.304 1.00 0.00 H new ATOM 0 HB2 LEU B 5 7.737 -0.915 -1.592 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.213 0.767 -1.707 1.00 0.00 H new ATOM 0 HG LEU B 5 6.538 1.388 -0.040 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.375 -0.335 1.339 1.00 0.00 H new ATOM 0 HD12 LEU B 5 4.853 -0.369 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU B 5 5.987 -1.598 0.245 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.597 0.262 1.956 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.310 -0.946 0.861 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.810 0.758 0.752 1.00 0.00 H new ATOM 1523 N ASP B 6 6.424 2.762 -2.911 1.00 0.00 N ATOM 1524 CA ASP B 6 6.052 4.167 -2.818 1.00 0.00 C ATOM 1525 C ASP B 6 4.634 4.369 -3.341 1.00 0.00 C ATOM 1526 O ASP B 6 3.810 4.977 -2.662 1.00 0.00 O ATOM 1527 CB ASP B 6 7.034 5.063 -3.589 1.00 0.00 C ATOM 1528 CG ASP B 6 8.475 4.980 -3.091 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.662 4.741 -1.878 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.370 5.171 -3.943 1.00 0.00 O ATOM 0 H ASP B 6 7.300 2.607 -3.410 1.00 0.00 H new ATOM 0 HA ASP B 6 6.093 4.455 -1.768 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.009 4.788 -4.644 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.696 6.097 -3.521 1.00 0.00 H new ATOM 1535 N GLN B 7 4.333 3.848 -4.535 1.00 0.00 N ATOM 1536 CA GLN B 7 2.980 3.944 -5.068 1.00 0.00 C ATOM 1537 C GLN B 7 1.978 3.234 -4.156 1.00 0.00 C ATOM 1538 O GLN B 7 0.888 3.752 -3.937 1.00 0.00 O ATOM 1539 CB GLN B 7 2.891 3.476 -6.528 1.00 0.00 C ATOM 1540 CG GLN B 7 3.259 2.004 -6.738 1.00 0.00 C ATOM 1541 CD GLN B 7 3.201 1.623 -8.212 1.00 0.00 C ATOM 1542 OE1 GLN B 7 4.228 1.425 -8.853 1.00 0.00 O ATOM 1543 NE2 GLN B 7 1.998 1.520 -8.768 1.00 0.00 N ATOM 0 H GLN B 7 4.999 3.364 -5.138 1.00 0.00 H new ATOM 0 HA GLN B 7 2.708 4.999 -5.082 1.00 0.00 H new ATOM 0 HB2 GLN B 7 1.876 3.640 -6.889 1.00 0.00 H new ATOM 0 HB3 GLN B 7 3.550 4.094 -7.137 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.261 1.819 -6.352 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.577 1.372 -6.170 1.00 0.00 H new ATOM 0 HE21 GLN B 7 1.162 1.691 -8.209 1.00 0.00 H new ATOM 0 HE22 GLN B 7 1.911 1.270 -9.753 1.00 0.00 H new ATOM 1552 N ALA B 8 2.325 2.064 -3.610 1.00 0.00 N ATOM 1553 CA ALA B 8 1.423 1.345 -2.722 1.00 0.00 C ATOM 1554 C ALA B 8 1.094 2.157 -1.466 1.00 0.00 C ATOM 1555 O ALA B 8 -0.079 2.396 -1.188 1.00 0.00 O ATOM 1556 CB ALA B 8 1.985 -0.028 -2.378 1.00 0.00 C ATOM 0 H ALA B 8 3.220 1.602 -3.770 1.00 0.00 H new ATOM 0 HA ALA B 8 0.482 1.196 -3.252 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.295 -0.548 -1.713 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.114 -0.608 -3.292 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.949 0.087 -1.882 1.00 0.00 H new ATOM 1562 N ILE B 9 2.103 2.605 -0.709 1.00 0.00 N ATOM 1563 CA ILE B 9 1.847 3.453 0.456 1.00 0.00 C ATOM 1564 C ILE B 9 1.084 4.711 0.006 1.00 0.00 C ATOM 1565 O ILE B 9 0.067 5.077 0.597 1.00 0.00 O ATOM 1566 CB ILE B 9 3.126 3.716 1.287 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.218 4.494 0.540 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.648 2.387 1.847 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.464 4.757 1.393 1.00 0.00 C ATOM 0 H ILE B 9 3.087 2.398 -0.880 1.00 0.00 H new ATOM 0 HA ILE B 9 1.201 2.931 1.162 1.00 0.00 H new ATOM 0 HB ILE B 9 2.845 4.376 2.108 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.507 3.937 -0.351 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.810 5.446 0.202 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.549 2.568 2.433 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.886 1.936 2.483 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.880 1.711 1.024 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.197 5.311 0.806 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.187 5.340 2.271 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.895 3.807 1.710 1.00 0.00 H new ATOM 1581 N GLY B 10 1.525 5.310 -1.106 1.00 0.00 N ATOM 1582 CA GLY B 10 0.843 6.387 -1.809 1.00 0.00 C ATOM 1583 C GLY B 10 -0.654 6.122 -1.972 1.00 0.00 C ATOM 1584 O GLY B 10 -1.465 7.011 -1.736 1.00 0.00 O ATOM 0 H GLY B 10 2.402 5.043 -1.553 1.00 0.00 H new ATOM 0 HA2 GLY B 10 0.987 7.320 -1.265 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.295 6.519 -2.792 1.00 0.00 H new ATOM 1588 N LEU B 11 -1.025 4.906 -2.374 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.403 4.509 -2.614 1.00 0.00 C ATOM 1590 C LEU B 11 -3.236 4.718 -1.347 1.00 0.00 C ATOM 1591 O LEU B 11 -4.193 5.490 -1.356 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.421 3.048 -3.102 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.654 2.609 -3.902 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.958 2.841 -3.153 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.677 3.232 -5.300 1.00 0.00 C ATOM 0 H LEU B 11 -0.356 4.155 -2.544 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.853 5.128 -3.390 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.538 2.883 -3.719 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.329 2.397 -2.233 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.567 1.530 -4.030 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.795 2.511 -3.769 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.948 2.275 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -5.067 3.903 -2.932 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.566 2.896 -5.834 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.695 4.318 -5.214 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.787 2.926 -5.849 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.858 4.049 -0.255 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.508 4.189 1.046 1.00 0.00 C ATOM 1609 C LEU B 12 -3.594 5.671 1.424 1.00 0.00 C ATOM 1610 O LEU B 12 -4.653 6.172 1.804 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.715 3.419 2.119 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.948 1.899 2.124 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.357 1.190 0.902 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.325 1.285 3.383 1.00 0.00 C ATOM 0 H LEU B 12 -2.082 3.387 -0.252 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.515 3.775 0.987 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.652 3.609 1.972 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.977 3.816 3.100 1.00 0.00 H new ATOM 0 HG LEU B 12 -4.028 1.756 2.101 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.557 0.121 0.969 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.812 1.588 -0.005 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.280 1.356 0.871 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.492 0.208 3.383 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.254 1.486 3.394 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.786 1.724 4.268 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.468 6.378 1.316 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.392 7.778 1.711 1.00 0.00 C ATOM 1628 C ILE B 13 -3.404 8.609 0.919 1.00 0.00 C ATOM 1629 O ILE B 13 -4.144 9.406 1.501 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.951 8.294 1.538 1.00 0.00 C ATOM 1631 CG1 ILE B 13 0.023 7.570 2.484 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.871 9.794 1.827 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.473 7.677 2.000 1.00 0.00 C ATOM 0 H ILE B 13 -1.593 5.997 0.955 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.652 7.875 2.765 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.669 8.096 0.504 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.058 7.995 3.484 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.258 6.520 2.560 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.156 10.135 1.698 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.521 10.333 1.138 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.191 9.985 2.851 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.128 7.153 2.696 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.560 7.228 1.011 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.763 8.726 1.949 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.437 8.418 -0.399 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.345 9.097 -1.302 1.00 0.00 C ATOM 1647 C GLY B 14 -5.789 8.782 -0.932 1.00 0.00 C ATOM 1648 O GLY B 14 -6.562 9.702 -0.670 1.00 0.00 O ATOM 0 H GLY B 14 -2.812 7.767 -0.875 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -4.177 10.173 -1.257 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -4.149 8.786 -2.328 1.00 0.00 H new ATOM 1652 N ILE B 15 -6.143 7.490 -0.899 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.472 7.026 -0.508 1.00 0.00 C ATOM 1654 C ILE B 15 -7.912 7.761 0.757 1.00 0.00 C ATOM 1655 O ILE B 15 -8.999 8.333 0.807 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.476 5.484 -0.366 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.778 4.863 -1.743 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.473 4.984 0.688 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.740 3.331 -1.743 1.00 0.00 C ATOM 0 H ILE B 15 -5.505 6.734 -1.146 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.205 7.259 -1.280 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.491 5.172 -0.017 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.762 5.194 -2.074 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.055 5.237 -2.468 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.430 3.896 0.742 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.217 5.406 1.660 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.481 5.294 0.412 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.962 2.962 -2.744 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.749 2.992 -1.442 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.482 2.949 -1.043 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.042 7.771 1.768 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.325 8.437 3.021 1.00 0.00 C ATOM 1673 C PHE B 16 -7.585 9.930 2.820 1.00 0.00 C ATOM 1674 O PHE B 16 -8.691 10.410 3.063 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.171 8.173 3.993 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.416 8.661 5.401 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.143 9.993 5.747 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.957 7.791 6.360 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.347 10.434 7.061 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -7.118 8.217 7.689 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.791 9.533 8.042 1.00 0.00 C ATOM 0 H PHE B 16 -6.129 7.318 1.733 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.242 8.032 3.448 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.975 7.101 4.022 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.271 8.651 3.607 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.775 10.680 4.999 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -7.250 6.791 6.076 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.163 11.466 7.319 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.492 7.533 8.436 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.881 9.854 9.069 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.571 10.676 2.381 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.643 12.131 2.385 1.00 0.00 C ATOM 1693 C HIS B 17 -7.720 12.666 1.447 1.00 0.00 C ATOM 1694 O HIS B 17 -8.353 13.677 1.760 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.265 12.739 2.127 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.337 12.473 3.283 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -3.602 11.328 3.467 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.267 13.201 4.441 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -3.091 11.370 4.710 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.471 12.492 5.348 1.00 0.00 N ATOM 0 H HIS B 17 -5.696 10.296 2.021 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.953 12.448 3.381 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.844 12.321 1.213 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -5.360 13.814 1.971 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -3.468 10.581 2.785 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -4.742 14.154 4.622 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -2.460 10.606 5.139 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.969 11.977 0.327 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.068 12.347 -0.555 1.00 0.00 C ATOM 1710 C LYS B 18 -10.380 12.341 0.230 1.00 0.00 C ATOM 1711 O LYS B 18 -11.178 13.269 0.110 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.143 11.407 -1.765 1.00 0.00 C ATOM 1713 CG LYS B 18 -8.019 11.702 -2.770 1.00 0.00 C ATOM 1714 CD LYS B 18 -8.175 10.902 -4.070 1.00 0.00 C ATOM 1715 CE LYS B 18 -8.001 9.393 -3.856 1.00 0.00 C ATOM 1716 NZ LYS B 18 -8.088 8.657 -5.128 1.00 0.00 N ATOM 0 H LYS B 18 -7.428 11.170 0.017 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.892 13.353 -0.936 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.072 10.372 -1.430 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.110 11.517 -2.255 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -8.011 12.767 -3.000 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -7.057 11.467 -2.315 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -9.160 11.094 -4.495 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -7.441 11.250 -4.797 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -7.036 9.199 -3.387 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -8.767 9.030 -3.171 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -7.966 7.640 -4.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -9.018 8.824 -5.563 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -7.341 8.987 -5.772 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.591 11.314 1.056 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.759 11.272 1.915 1.00 0.00 C ATOM 1732 C TYR B 19 -11.681 12.327 3.013 1.00 0.00 C ATOM 1733 O TYR B 19 -12.654 13.049 3.195 1.00 0.00 O ATOM 1734 CB TYR B 19 -12.004 9.858 2.442 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.945 9.091 1.541 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -12.472 8.489 0.362 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.329 9.190 1.767 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -13.380 7.958 -0.569 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -15.232 8.737 0.797 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.763 8.114 -0.368 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.650 7.460 -1.165 1.00 0.00 O ATOM 0 H TYR B 19 -9.969 10.510 1.143 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.635 11.529 1.320 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -11.055 9.326 2.518 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.421 9.910 3.448 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -11.410 8.435 0.172 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.696 9.616 2.689 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -13.016 7.430 -1.438 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -16.293 8.868 0.947 1.00 0.00 H new ATOM 0 HH TYR B 19 -16.212 6.873 -0.617 1.00 0.00 H new ATOM 1751 N SER B 20 -10.556 12.457 3.726 1.00 0.00 N ATOM 1752 CA SER B 20 -10.397 13.481 4.757 1.00 0.00 C ATOM 1753 C SER B 20 -10.842 14.859 4.262 1.00 0.00 C ATOM 1754 O SER B 20 -11.553 15.572 4.970 1.00 0.00 O ATOM 1755 CB SER B 20 -8.947 13.532 5.239 1.00 0.00 C ATOM 1756 OG SER B 20 -8.523 12.243 5.627 1.00 0.00 O ATOM 0 H SER B 20 -9.739 11.859 3.604 1.00 0.00 H new ATOM 0 HA SER B 20 -11.040 13.208 5.593 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.304 13.912 4.445 1.00 0.00 H new ATOM 0 HB3 SER B 20 -8.858 14.221 6.079 1.00 0.00 H new ATOM 0 HG SER B 20 -8.798 12.073 6.552 1.00 0.00 H new ATOM 1762 N GLY B 21 -10.442 15.221 3.039 1.00 0.00 N ATOM 1763 CA GLY B 21 -10.828 16.471 2.394 1.00 0.00 C ATOM 1764 C GLY B 21 -12.334 16.760 2.452 1.00 0.00 C ATOM 1765 O GLY B 21 -12.732 17.922 2.464 1.00 0.00 O ATOM 0 H GLY B 21 -9.831 14.641 2.464 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -10.291 17.294 2.867 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -10.513 16.443 1.351 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.370 14.966 9.174 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.944 13.583 8.979 1.00 0.00 C ATOM 1849 C HIS B 27 -5.861 12.628 9.758 1.00 0.00 C ATOM 1850 O HIS B 27 -5.394 11.790 10.533 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.467 13.448 9.366 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.588 14.387 8.579 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.504 14.449 7.206 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.868 15.436 9.085 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.747 15.516 6.896 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -1.331 16.145 8.007 1.00 0.00 N ATOM 0 HA HIS B 27 -5.032 13.304 7.929 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.351 13.650 10.431 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.141 12.421 9.199 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -2.937 13.804 6.545 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.738 15.673 10.131 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.506 15.825 5.890 1.00 0.00 H new ATOM 1864 N THR B 28 -7.174 12.754 9.553 1.00 0.00 N ATOM 1865 CA THR B 28 -8.202 12.002 10.247 1.00 0.00 C ATOM 1866 C THR B 28 -9.332 11.658 9.277 1.00 0.00 C ATOM 1867 O THR B 28 -9.481 12.292 8.231 1.00 0.00 O ATOM 1868 CB THR B 28 -8.734 12.796 11.450 1.00 0.00 C ATOM 1869 OG1 THR B 28 -9.298 14.019 11.031 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.655 13.095 12.495 1.00 0.00 C ATOM 0 H THR B 28 -7.557 13.410 8.872 1.00 0.00 H new ATOM 0 HA THR B 28 -7.771 11.075 10.625 1.00 0.00 H new ATOM 0 HB THR B 28 -9.491 12.162 11.912 1.00 0.00 H new ATOM 0 HG1 THR B 28 -9.974 14.307 11.680 1.00 0.00 H new ATOM 0 HG21 THR B 28 -8.093 13.658 13.319 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.245 12.158 12.873 1.00 0.00 H new ATOM 0 HG23 THR B 28 -6.858 13.682 12.038 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.113 10.637 9.632 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.377 10.308 8.987 1.00 0.00 C ATOM 1880 C LEU B 29 -12.417 10.126 10.086 1.00 0.00 C ATOM 1881 O LEU B 29 -12.163 9.387 11.034 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.273 9.005 8.185 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.411 9.090 6.923 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.255 7.679 6.351 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -11.069 9.957 5.853 1.00 0.00 C ATOM 0 H LEU B 29 -9.875 10.003 10.395 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.649 11.107 8.298 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -10.867 8.228 8.833 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.277 8.690 7.901 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.451 9.530 7.192 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.643 7.717 5.450 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.773 7.038 7.090 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.237 7.275 6.106 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.429 9.995 4.971 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -12.035 9.530 5.582 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -11.213 10.966 6.240 1.00 0.00 H new ATOM 1897 N SER B 30 -13.582 10.764 9.968 1.00 0.00 N ATOM 1898 CA SER B 30 -14.680 10.527 10.896 1.00 0.00 C ATOM 1899 C SER B 30 -15.399 9.226 10.536 1.00 0.00 C ATOM 1900 O SER B 30 -15.053 8.555 9.566 1.00 0.00 O ATOM 1901 CB SER B 30 -15.631 11.732 10.933 1.00 0.00 C ATOM 1902 OG SER B 30 -16.587 11.562 11.966 1.00 0.00 O ATOM 0 H SER B 30 -13.786 11.447 9.239 1.00 0.00 H new ATOM 0 HA SER B 30 -14.281 10.412 11.904 1.00 0.00 H new ATOM 0 HB2 SER B 30 -15.064 12.648 11.098 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.136 11.837 9.973 1.00 0.00 H new ATOM 0 HG SER B 30 -17.189 12.335 11.985 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.408 8.870 11.328 1.00 0.00 N ATOM 1909 CA LYS B 31 -17.054 7.567 11.277 1.00 0.00 C ATOM 1910 C LYS B 31 -17.743 7.344 9.926 1.00 0.00 C ATOM 1911 O LYS B 31 -17.358 6.476 9.144 1.00 0.00 O ATOM 1912 CB LYS B 31 -18.022 7.420 12.466 1.00 0.00 C ATOM 1913 CG LYS B 31 -17.340 7.764 13.798 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.095 7.209 15.016 1.00 0.00 C ATOM 1915 CE LYS B 31 -19.501 7.793 15.191 1.00 0.00 C ATOM 1916 NZ LYS B 31 -19.472 9.255 15.360 1.00 0.00 N ATOM 0 H LYS B 31 -16.804 9.491 12.034 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.298 6.787 11.366 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.882 8.073 12.318 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -18.400 6.398 12.504 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -16.325 7.367 13.794 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.258 8.847 13.890 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.171 6.126 14.922 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.513 7.411 15.915 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -20.110 7.540 14.323 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.978 7.337 16.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -20.423 9.595 15.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -18.805 9.504 16.118 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -19.167 9.701 14.471 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.761 8.153 9.628 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.503 8.026 8.381 1.00 0.00 C ATOM 1932 C LYS B 32 -18.607 8.368 7.185 1.00 0.00 C ATOM 1933 O LYS B 32 -18.747 7.766 6.125 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.782 8.868 8.461 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.654 8.740 7.203 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.902 9.633 7.264 1.00 0.00 C ATOM 1937 CE LYS B 32 -23.869 9.225 8.383 1.00 0.00 C ATOM 1938 NZ LYS B 32 -25.119 10.002 8.317 1.00 0.00 N ATOM 0 H LYS B 32 -19.088 8.903 10.237 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.815 6.993 8.227 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.361 8.561 9.332 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.515 9.914 8.608 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -21.063 9.005 6.326 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.959 7.701 7.080 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -22.596 10.668 7.414 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -23.422 9.590 6.307 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -24.094 8.162 8.303 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -23.393 9.378 9.352 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -25.754 9.705 9.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -24.904 11.015 8.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -25.583 9.836 7.401 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.666 9.303 7.352 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.665 9.625 6.338 1.00 0.00 C ATOM 1954 C GLU B 33 -15.894 8.354 5.952 1.00 0.00 C ATOM 1955 O GLU B 33 -15.797 8.002 4.776 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.751 10.724 6.898 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.789 11.351 5.878 1.00 0.00 C ATOM 1958 CD GLU B 33 -13.987 12.491 6.512 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -13.739 12.403 7.733 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -13.665 13.460 5.791 1.00 0.00 O ATOM 0 H GLU B 33 -17.580 9.860 8.202 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.130 10.000 5.426 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.373 11.513 7.320 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.166 10.306 7.717 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.108 10.589 5.498 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.353 11.728 5.025 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.380 7.638 6.955 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.725 6.355 6.763 1.00 0.00 C ATOM 1969 C LEU B 34 -15.693 5.383 6.093 1.00 0.00 C ATOM 1970 O LEU B 34 -15.338 4.724 5.117 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.180 5.853 8.113 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.566 4.443 8.134 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.629 3.335 8.071 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.499 4.274 7.043 1.00 0.00 C ATOM 0 H LEU B 34 -15.410 7.940 7.929 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.869 6.449 6.095 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.423 6.558 8.457 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.993 5.880 8.838 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.068 4.335 9.097 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.141 2.361 8.089 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.296 3.422 8.928 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.205 3.435 7.151 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -12.088 3.265 7.089 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.950 4.438 6.064 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.700 4.999 7.200 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.932 5.279 6.574 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.875 4.384 5.920 1.00 0.00 C ATOM 1988 C LYS B 35 -18.037 4.736 4.435 1.00 0.00 C ATOM 1989 O LYS B 35 -18.104 3.842 3.597 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.212 4.343 6.663 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.013 3.148 6.137 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.265 2.883 6.971 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.856 1.521 6.591 1.00 0.00 C ATOM 1994 NZ LYS B 35 -22.176 1.442 5.155 1.00 0.00 N ATOM 0 H LYS B 35 -17.293 5.784 7.383 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.466 3.375 5.960 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.048 4.248 7.736 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.764 5.270 6.505 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.300 3.332 5.102 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.382 2.260 6.140 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.018 2.900 8.032 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -22.000 3.670 6.802 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.148 0.733 6.849 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -22.759 1.342 7.175 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -22.936 0.748 5.006 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -22.488 2.375 4.817 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -21.330 1.148 4.626 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.067 6.025 4.093 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.165 6.495 2.717 1.00 0.00 C ATOM 2010 C GLU B 36 -16.916 6.107 1.908 1.00 0.00 C ATOM 2011 O GLU B 36 -17.008 5.827 0.710 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.427 8.008 2.729 1.00 0.00 C ATOM 2013 CG GLU B 36 -19.114 8.476 1.437 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.362 9.982 1.425 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -19.806 10.498 2.472 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -19.088 10.594 0.369 1.00 0.00 O ATOM 0 H GLU B 36 -18.023 6.780 4.777 1.00 0.00 H new ATOM 0 HA GLU B 36 -19.002 6.010 2.214 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.051 8.262 3.586 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.484 8.540 2.853 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.496 8.205 0.581 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -20.063 7.953 1.323 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.744 6.091 2.551 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.525 5.533 1.969 1.00 0.00 C ATOM 2025 C LEU B 37 -14.760 4.067 1.631 1.00 0.00 C ATOM 2026 O LEU B 37 -14.598 3.653 0.482 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.333 5.773 2.916 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.959 5.267 2.448 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.902 6.025 3.257 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.750 3.767 2.719 1.00 0.00 C ATOM 0 H LEU B 37 -15.617 6.466 3.491 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.271 6.035 1.035 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.255 6.845 3.099 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.560 5.302 3.873 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.887 5.428 1.372 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.908 5.695 2.956 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.001 7.095 3.073 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.044 5.825 4.319 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.763 3.468 2.367 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.827 3.576 3.789 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.512 3.193 2.193 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.164 3.281 2.627 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.371 1.854 2.445 1.00 0.00 C ATOM 2044 C ILE B 38 -16.383 1.596 1.333 1.00 0.00 C ATOM 2045 O ILE B 38 -16.088 0.847 0.412 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.786 1.208 3.771 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.577 1.268 4.713 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -16.250 -0.245 3.588 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.887 0.630 6.057 1.00 0.00 C ATOM 0 H ILE B 38 -15.354 3.615 3.572 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.434 1.391 2.135 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.635 1.752 4.186 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.730 0.758 4.253 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.281 2.307 4.861 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -16.534 -0.661 4.555 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -17.108 -0.271 2.916 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -15.438 -0.835 3.163 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -14.009 0.690 6.700 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.717 1.157 6.527 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -15.158 -0.415 5.910 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.569 2.199 1.408 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.623 1.992 0.424 1.00 0.00 C ATOM 2063 C GLN B 39 -18.120 2.226 -1.000 1.00 0.00 C ATOM 2064 O GLN B 39 -18.553 1.536 -1.919 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.820 2.898 0.745 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.569 2.459 2.010 1.00 0.00 C ATOM 2067 CD GLN B 39 -21.407 1.208 1.778 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -22.568 1.292 1.392 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.840 0.033 2.027 1.00 0.00 N ATOM 0 H GLN B 39 -17.823 2.845 2.155 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.944 0.952 0.479 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.472 3.923 0.871 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.509 2.897 -0.100 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.851 2.270 2.808 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.215 3.270 2.347 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -19.872 -0.009 2.347 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -21.372 -0.828 1.898 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.209 3.184 -1.188 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.613 3.409 -2.490 1.00 0.00 C ATOM 2080 C LYS B 40 -15.607 2.314 -2.821 1.00 0.00 C ATOM 2081 O LYS B 40 -15.757 1.612 -3.820 1.00 0.00 O ATOM 2082 CB LYS B 40 -15.987 4.806 -2.508 1.00 0.00 C ATOM 2083 CG LYS B 40 -15.435 5.247 -3.871 1.00 0.00 C ATOM 2084 CD LYS B 40 -16.515 5.485 -4.937 1.00 0.00 C ATOM 2085 CE LYS B 40 -17.610 6.470 -4.499 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.050 7.713 -3.931 1.00 0.00 N ATOM 0 H LYS B 40 -16.875 3.809 -0.454 1.00 0.00 H new ATOM 0 HA LYS B 40 -17.377 3.364 -3.267 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.736 5.529 -2.184 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -15.179 4.836 -1.778 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -14.861 6.164 -3.739 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -14.743 4.487 -4.234 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -16.041 5.862 -5.843 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -16.977 4.531 -5.192 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.239 6.715 -5.355 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.251 5.991 -3.759 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -17.813 8.406 -3.791 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -16.600 7.505 -3.017 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.342 8.105 -4.584 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.561 2.190 -2.005 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.460 1.299 -2.319 1.00 0.00 C ATOM 2102 C GLU B 41 -13.940 -0.149 -2.221 1.00 0.00 C ATOM 2103 O GLU B 41 -14.000 -0.884 -3.199 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.266 1.587 -1.395 1.00 0.00 C ATOM 2105 CG GLU B 41 -11.805 3.052 -1.462 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.434 3.487 -2.876 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.408 2.982 -3.377 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -12.185 4.320 -3.430 1.00 0.00 O ATOM 0 H GLU B 41 -14.459 2.696 -1.126 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.117 1.468 -3.340 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.539 1.343 -0.368 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.435 0.936 -1.668 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.599 3.696 -1.084 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -10.945 3.189 -0.807 1.00 0.00 H new ATOM 2115 N LEU B 42 -14.340 -0.557 -1.025 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.848 -1.895 -0.785 1.00 0.00 C ATOM 2117 C LEU B 42 -16.333 -1.888 -1.134 1.00 0.00 C ATOM 2118 O LEU B 42 -17.194 -1.882 -0.254 1.00 0.00 O ATOM 2119 CB LEU B 42 -14.567 -2.327 0.661 1.00 0.00 C ATOM 2120 CG LEU B 42 -13.086 -2.210 1.068 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.892 -2.778 2.480 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -12.151 -2.950 0.103 1.00 0.00 C ATOM 0 H LEU B 42 -14.320 0.034 -0.194 1.00 0.00 H new ATOM 0 HA LEU B 42 -14.345 -2.632 -1.411 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -15.169 -1.718 1.336 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -14.889 -3.360 0.791 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.829 -1.151 1.037 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.843 -2.694 2.765 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -13.506 -2.218 3.185 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -13.189 -3.827 2.494 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -11.120 -2.835 0.436 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -12.411 -4.008 0.084 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -12.257 -2.533 -0.898 1.00 0.00 H new ATOM 2243 N ASP B 50 -23.011 -4.822 5.541 1.00 0.00 N ATOM 2244 CA ASP B 50 -23.095 -3.492 6.137 1.00 0.00 C ATOM 2245 C ASP B 50 -22.918 -3.513 7.657 1.00 0.00 C ATOM 2246 O ASP B 50 -22.162 -2.712 8.199 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.423 -2.833 5.756 1.00 0.00 C ATOM 2248 CG ASP B 50 -24.444 -1.362 6.146 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -24.743 -1.081 7.326 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -24.154 -0.545 5.246 1.00 0.00 O ATOM 0 HA ASP B 50 -22.269 -2.904 5.737 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.584 -2.929 4.682 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -25.244 -3.354 6.249 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.586 -4.447 8.339 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.436 -4.634 9.780 1.00 0.00 C ATOM 2257 C ALA B 51 -21.962 -4.814 10.157 1.00 0.00 C ATOM 2258 O ALA B 51 -21.456 -4.189 11.091 1.00 0.00 O ATOM 2259 CB ALA B 51 -24.261 -5.846 10.223 1.00 0.00 C ATOM 0 H ALA B 51 -24.245 -5.093 7.906 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.801 -3.745 10.294 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -24.151 -5.988 11.298 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.311 -5.678 9.985 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.909 -6.736 9.702 1.00 0.00 H new ATOM 2265 N GLU B 52 -21.261 -5.657 9.395 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.852 -5.914 9.613 1.00 0.00 C ATOM 2267 C GLU B 52 -19.069 -4.632 9.353 1.00 0.00 C ATOM 2268 O GLU B 52 -18.178 -4.292 10.126 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.360 -7.075 8.733 1.00 0.00 C ATOM 2270 CG GLU B 52 -20.277 -8.307 8.797 1.00 0.00 C ATOM 2271 CD GLU B 52 -20.519 -8.773 10.229 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -19.553 -9.297 10.824 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -21.660 -8.587 10.705 1.00 0.00 O ATOM 0 H GLU B 52 -21.661 -6.175 8.613 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.691 -6.219 10.647 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.288 -6.735 7.700 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.355 -7.360 9.045 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -21.232 -8.071 8.327 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -19.831 -9.119 8.223 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.421 -3.899 8.289 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.803 -2.609 8.029 1.00 0.00 C ATOM 2282 C ILE B 53 -18.972 -1.670 9.219 1.00 0.00 C ATOM 2283 O ILE B 53 -17.987 -1.062 9.612 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.278 -1.954 6.723 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -19.012 -2.838 5.495 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.593 -0.589 6.545 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.593 -3.409 5.394 1.00 0.00 C ATOM 0 H ILE B 53 -20.124 -4.180 7.605 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.739 -2.804 7.892 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.357 -1.821 6.799 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.720 -3.667 5.504 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.216 -2.255 4.597 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.934 -0.129 5.617 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.847 0.058 7.385 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.512 -0.726 6.506 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.509 -4.018 4.494 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -16.874 -2.591 5.348 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.386 -4.025 6.269 1.00 0.00 H new ATOM 2299 N VAL B 54 -20.167 -1.510 9.795 1.00 0.00 N ATOM 2300 CA VAL B 54 -20.298 -0.573 10.911 1.00 0.00 C ATOM 2301 C VAL B 54 -19.550 -1.052 12.159 1.00 0.00 C ATOM 2302 O VAL B 54 -18.982 -0.228 12.876 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.736 -0.105 11.185 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -22.158 0.880 10.087 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.750 -1.238 11.325 1.00 0.00 C ATOM 0 H VAL B 54 -21.022 -1.994 9.522 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.795 0.338 10.587 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.732 0.386 12.158 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -23.178 1.218 10.273 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.486 1.738 10.090 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -22.111 0.385 9.117 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.738 -0.820 11.517 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.775 -1.820 10.404 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -22.462 -1.884 12.155 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.479 -2.363 12.412 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.597 -2.862 13.465 1.00 0.00 C ATOM 2317 C LYS B 55 -17.141 -2.482 13.160 1.00 0.00 C ATOM 2318 O LYS B 55 -16.441 -1.934 14.006 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.793 -4.374 13.652 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.847 -5.003 14.691 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.785 -4.283 16.049 1.00 0.00 C ATOM 2322 CE LYS B 55 -19.147 -4.186 16.744 1.00 0.00 C ATOM 2323 NZ LYS B 55 -19.036 -3.468 18.026 1.00 0.00 N ATOM 0 H LYS B 55 -20.008 -3.080 11.915 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.855 -2.392 14.414 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.824 -4.562 13.953 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.645 -4.871 12.693 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -18.155 -6.035 14.860 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.842 -5.035 14.270 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -17.089 -4.810 16.701 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -17.387 -3.279 15.903 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -19.855 -3.671 16.095 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -19.543 -5.187 16.917 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -19.972 -3.416 18.477 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -18.378 -3.975 18.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -18.680 -2.506 17.855 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.682 -2.750 11.941 1.00 0.00 N ATOM 2338 CA LEU B 56 -15.338 -2.418 11.488 1.00 0.00 C ATOM 2339 C LEU B 56 -15.068 -0.906 11.578 1.00 0.00 C ATOM 2340 O LEU B 56 -13.995 -0.492 12.009 1.00 0.00 O ATOM 2341 CB LEU B 56 -15.151 -3.036 10.095 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.974 -2.482 9.284 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.379 -3.579 8.391 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.469 -1.365 8.365 1.00 0.00 C ATOM 0 H LEU B 56 -17.246 -3.213 11.228 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.578 -2.846 12.142 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.018 -4.112 10.208 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -16.067 -2.886 9.523 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.223 -2.113 9.982 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.544 -3.171 7.821 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -13.026 -4.402 9.012 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -14.143 -3.944 7.705 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.632 -0.971 7.788 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.224 -1.761 7.685 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.904 -0.566 8.965 1.00 0.00 H new ATOM 2356 N MET B 57 -16.043 -0.074 11.203 1.00 0.00 N ATOM 2357 CA MET B 57 -15.994 1.376 11.321 1.00 0.00 C ATOM 2358 C MET B 57 -15.775 1.721 12.786 1.00 0.00 C ATOM 2359 O MET B 57 -14.834 2.440 13.110 1.00 0.00 O ATOM 2360 CB MET B 57 -17.311 1.975 10.802 1.00 0.00 C ATOM 2361 CG MET B 57 -17.458 3.492 11.003 1.00 0.00 C ATOM 2362 SD MET B 57 -19.114 4.150 10.674 1.00 0.00 S ATOM 2363 CE MET B 57 -20.020 3.525 12.108 1.00 0.00 C ATOM 0 H MET B 57 -16.916 -0.408 10.795 1.00 0.00 H new ATOM 0 HA MET B 57 -15.179 1.790 10.727 1.00 0.00 H new ATOM 0 HB2 MET B 57 -17.399 1.754 9.738 1.00 0.00 H new ATOM 0 HB3 MET B 57 -18.141 1.475 11.301 1.00 0.00 H new ATOM 0 HG2 MET B 57 -17.184 3.736 12.029 1.00 0.00 H new ATOM 0 HG3 MET B 57 -16.746 4.000 10.353 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.999 4.002 12.156 1.00 0.00 H new ATOM 0 HE2 MET B 57 -20.146 2.446 12.017 1.00 0.00 H new ATOM 0 HE3 MET B 57 -19.462 3.750 13.017 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.638 1.191 13.660 1.00 0.00 N ATOM 2374 CA ASP B 58 -16.501 1.362 15.095 1.00 0.00 C ATOM 2375 C ASP B 58 -15.079 1.001 15.518 1.00 0.00 C ATOM 2376 O ASP B 58 -14.414 1.816 16.140 1.00 0.00 O ATOM 2377 CB ASP B 58 -17.579 0.565 15.845 1.00 0.00 C ATOM 2378 CG ASP B 58 -17.458 0.706 17.359 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.247 1.849 17.819 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -17.592 -0.338 18.034 1.00 0.00 O ATOM 0 H ASP B 58 -17.447 0.634 13.384 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.663 2.406 15.362 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.565 0.906 15.529 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.503 -0.488 15.574 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.573 -0.175 15.135 1.00 0.00 N ATOM 2386 CA ASP B 59 -13.205 -0.578 15.455 1.00 0.00 C ATOM 2387 C ASP B 59 -12.179 0.470 15.005 1.00 0.00 C ATOM 2388 O ASP B 59 -11.338 0.882 15.801 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.866 -1.958 14.865 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.738 -3.093 15.397 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.874 -3.180 16.637 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.231 -3.877 14.559 1.00 0.00 O ATOM 0 H ASP B 59 -15.097 -0.867 14.599 1.00 0.00 H new ATOM 0 HA ASP B 59 -13.148 -0.653 16.541 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.968 -1.913 13.781 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.822 -2.186 15.078 1.00 0.00 H new ATOM 2397 N LEU B 60 -12.238 0.896 13.739 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.362 1.934 13.198 1.00 0.00 C ATOM 2399 C LEU B 60 -11.431 3.200 14.058 1.00 0.00 C ATOM 2400 O LEU B 60 -10.413 3.653 14.582 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.725 2.226 11.721 1.00 0.00 C ATOM 2402 CG LEU B 60 -11.047 1.294 10.694 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.889 1.070 9.431 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.723 1.892 10.198 1.00 0.00 C ATOM 0 H LEU B 60 -12.901 0.526 13.058 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.333 1.577 13.224 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.806 2.148 11.604 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.453 3.256 11.491 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.908 0.354 11.228 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.355 0.406 8.751 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.843 0.619 9.705 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.068 2.026 8.939 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.266 1.215 9.476 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.914 2.855 9.723 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -9.048 2.031 11.042 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.618 3.793 14.187 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.770 5.074 14.865 1.00 0.00 C ATOM 2418 C ASP B 61 -12.487 4.983 16.364 1.00 0.00 C ATOM 2419 O ASP B 61 -11.966 5.939 16.932 1.00 0.00 O ATOM 2420 CB ASP B 61 -14.114 5.737 14.533 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.345 4.996 15.050 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.437 4.779 16.276 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.209 4.694 14.198 1.00 0.00 O ATOM 0 H ASP B 61 -13.489 3.402 13.828 1.00 0.00 H new ATOM 0 HA ASP B 61 -12.001 5.739 14.472 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -14.116 6.746 14.946 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.196 5.835 13.451 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.788 3.843 17.000 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.751 3.682 18.451 1.00 0.00 C ATOM 2430 C ARG B 62 -11.455 4.235 19.026 1.00 0.00 C ATOM 2431 O ARG B 62 -11.490 4.922 20.047 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.939 2.210 18.848 1.00 0.00 C ATOM 2433 CG ARG B 62 -13.039 2.013 20.369 1.00 0.00 C ATOM 2434 CD ARG B 62 -13.106 0.525 20.732 1.00 0.00 C ATOM 2435 NE ARG B 62 -14.209 -0.151 20.028 1.00 0.00 N ATOM 2436 CZ ARG B 62 -14.101 -1.178 19.170 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -12.940 -1.806 18.953 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -15.175 -1.588 18.493 1.00 0.00 N ATOM 0 H ARG B 62 -13.068 2.995 16.508 1.00 0.00 H new ATOM 0 HA ARG B 62 -13.579 4.252 18.871 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -13.842 1.823 18.376 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -12.103 1.625 18.464 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -12.177 2.470 20.855 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -13.925 2.523 20.747 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -12.161 0.044 20.478 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -13.239 0.417 21.808 1.00 0.00 H new ATOM 0 HE ARG B 62 -15.150 0.196 20.211 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -12.099 -1.508 19.447 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -12.896 -2.583 18.293 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -16.072 -1.122 18.629 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -15.099 -2.368 17.840 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.093 9.910 15.502 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.376 9.732 14.247 1.00 0.00 C ATOM 2519 C GLU B 67 -11.308 8.648 14.350 1.00 0.00 C ATOM 2520 O GLU B 67 -10.867 8.305 15.439 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.693 11.046 13.825 1.00 0.00 C ATOM 2522 CG GLU B 67 -12.629 12.257 13.728 1.00 0.00 C ATOM 2523 CD GLU B 67 -12.069 13.310 12.775 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -11.084 13.975 13.164 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -12.611 13.407 11.653 1.00 0.00 O ATOM 0 HA GLU B 67 -13.115 9.432 13.504 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -10.902 11.273 14.539 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.215 10.896 12.857 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.611 11.935 13.382 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -12.767 12.694 14.717 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.867 8.153 13.192 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.673 7.333 13.058 1.00 0.00 C ATOM 2534 C VAL B 68 -8.597 8.249 12.474 1.00 0.00 C ATOM 2535 O VAL B 68 -8.850 8.954 11.495 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.934 6.077 12.200 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -10.368 6.357 10.758 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -8.693 5.178 12.189 1.00 0.00 C ATOM 0 H VAL B 68 -11.344 8.318 12.305 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.348 6.936 14.020 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.778 5.579 12.677 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -10.527 5.413 10.236 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -11.295 6.930 10.762 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.591 6.927 10.248 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -8.889 4.295 11.581 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -7.850 5.727 11.771 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -8.457 4.871 13.208 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.412 8.291 13.089 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.285 9.053 12.562 1.00 0.00 C ATOM 2550 C ASN B 69 -5.534 8.220 11.527 1.00 0.00 C ATOM 2551 O ASN B 69 -5.555 6.993 11.580 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.351 9.489 13.698 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.953 9.873 13.203 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.007 9.102 13.322 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.799 11.034 12.577 1.00 0.00 N ATOM 0 H ASN B 69 -7.211 7.800 13.960 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.662 9.953 12.076 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.793 10.338 14.220 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.265 8.679 14.423 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.890 11.289 12.192 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -4.590 11.671 12.481 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.845 8.897 10.608 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.010 8.290 9.585 1.00 0.00 C ATOM 2564 C PHE B 70 -3.174 7.098 10.083 1.00 0.00 C ATOM 2565 O PHE B 70 -3.224 6.020 9.492 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.145 9.386 8.958 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.203 8.863 7.903 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.731 8.274 6.740 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.826 8.774 8.176 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.887 7.581 5.860 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.017 8.085 7.294 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.515 7.469 6.148 1.00 0.00 C ATOM 0 H PHE B 70 -4.857 9.916 10.558 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.662 7.851 8.830 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.792 10.143 8.516 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.568 9.878 9.741 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.786 8.355 6.525 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.419 9.236 9.064 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.290 7.134 4.963 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.077 8.027 7.495 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.131 6.909 5.488 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.417 7.255 11.177 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.578 6.168 11.671 1.00 0.00 C ATOM 2584 C GLN B 71 -2.434 4.947 12.017 1.00 0.00 C ATOM 2585 O GLN B 71 -2.091 3.816 11.665 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.769 6.643 12.886 1.00 0.00 C ATOM 2587 CG GLN B 71 0.071 5.535 13.541 1.00 0.00 C ATOM 2588 CD GLN B 71 1.109 4.936 12.597 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.251 5.378 12.575 1.00 0.00 O ATOM 2590 NE2 GLN B 71 0.737 3.922 11.822 1.00 0.00 N ATOM 0 H GLN B 71 -2.371 8.113 11.726 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.879 5.872 10.889 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.108 7.453 12.577 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.453 7.055 13.628 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.576 5.940 14.418 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -0.592 4.744 13.892 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.221 3.575 11.862 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.410 3.491 11.188 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.544 5.188 12.716 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.456 4.149 13.164 1.00 0.00 C ATOM 2601 C GLU B 72 -5.100 3.475 11.956 1.00 0.00 C ATOM 2602 O GLU B 72 -5.255 2.259 11.940 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.517 4.746 14.096 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.997 5.004 15.515 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.669 5.752 15.575 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.699 6.975 15.328 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -2.646 5.086 15.843 1.00 0.00 O ATOM 0 H GLU B 72 -3.834 6.127 12.988 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.902 3.395 13.724 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.878 5.683 13.672 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.370 4.069 14.146 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.746 5.574 16.065 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -4.885 4.048 16.027 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.462 4.259 10.941 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.938 3.749 9.667 1.00 0.00 C ATOM 2616 C TYR B 73 -4.918 2.775 9.069 1.00 0.00 C ATOM 2617 O TYR B 73 -5.276 1.638 8.759 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.273 4.927 8.746 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.265 4.622 7.262 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.436 4.152 6.640 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.139 4.954 6.480 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.488 4.026 5.242 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.177 4.774 5.088 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.344 4.296 4.470 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.345 4.048 3.131 1.00 0.00 O ATOM 0 H TYR B 73 -5.431 5.278 10.986 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.855 3.176 9.802 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.259 5.306 9.015 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.560 5.729 8.938 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.296 3.888 7.238 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.250 5.346 6.951 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.406 3.722 4.760 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.307 5.004 4.491 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.803 4.724 2.673 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.653 3.190 8.927 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.626 2.303 8.384 1.00 0.00 C ATOM 2637 C ILE B 74 -2.529 1.030 9.238 1.00 0.00 C ATOM 2638 O ILE B 74 -2.628 -0.076 8.708 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.259 3.006 8.250 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.281 4.248 7.337 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.223 1.991 7.744 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.306 3.946 5.835 1.00 0.00 C ATOM 0 H ILE B 74 -3.323 4.122 9.178 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.922 2.022 7.373 1.00 0.00 H new ATOM 0 HB ILE B 74 -0.991 3.375 9.240 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.156 4.848 7.586 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.404 4.857 7.556 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.747 2.479 7.646 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.145 1.167 8.453 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.535 1.606 6.773 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.320 4.882 5.276 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.418 3.375 5.564 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.197 3.366 5.595 1.00 0.00 H new ATOM 2654 N THR B 75 -2.356 1.169 10.557 1.00 0.00 N ATOM 2655 CA THR B 75 -2.298 0.032 11.472 1.00 0.00 C ATOM 2656 C THR B 75 -3.497 -0.900 11.285 1.00 0.00 C ATOM 2657 O THR B 75 -3.331 -2.115 11.194 1.00 0.00 O ATOM 2658 CB THR B 75 -2.208 0.548 12.913 1.00 0.00 C ATOM 2659 OG1 THR B 75 -0.993 1.251 13.043 1.00 0.00 O ATOM 2660 CG2 THR B 75 -2.243 -0.572 13.957 1.00 0.00 C ATOM 0 H THR B 75 -2.253 2.074 11.017 1.00 0.00 H new ATOM 0 HA THR B 75 -1.408 -0.557 11.250 1.00 0.00 H new ATOM 0 HB THR B 75 -3.076 1.181 13.098 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.245 0.619 13.012 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.176 -0.141 14.956 1.00 0.00 H new ATOM 0 HG22 THR B 75 -3.176 -1.127 13.864 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.402 -1.246 13.796 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.705 -0.339 11.221 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.916 -1.114 11.043 1.00 0.00 C ATOM 2670 C PHE B 76 -5.874 -1.859 9.714 1.00 0.00 C ATOM 2671 O PHE B 76 -6.169 -3.046 9.678 1.00 0.00 O ATOM 2672 CB PHE B 76 -7.162 -0.233 11.135 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.438 -1.049 11.046 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.984 -1.366 9.787 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.984 -1.629 12.206 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.084 -2.230 9.692 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.062 -2.526 12.106 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.602 -2.838 10.847 1.00 0.00 C ATOM 0 H PHE B 76 -4.863 0.666 11.292 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.973 -1.844 11.851 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.148 0.319 12.075 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.146 0.504 10.332 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.554 -0.942 8.892 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.574 -1.385 13.175 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.533 -2.428 8.730 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.475 -2.975 12.997 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.415 -3.545 10.768 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.492 -1.195 8.621 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.302 -1.889 7.352 1.00 0.00 C ATOM 2690 C LEU B 77 -4.267 -3.006 7.501 1.00 0.00 C ATOM 2691 O LEU B 77 -4.437 -4.082 6.933 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.952 -0.902 6.231 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.164 -0.047 5.818 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.718 1.066 4.872 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.228 -0.869 5.081 1.00 0.00 C ATOM 0 H LEU B 77 -5.311 -0.192 8.591 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.242 -2.361 7.065 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.144 -0.250 6.561 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.584 -1.452 5.365 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.590 0.354 6.738 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.581 1.667 4.584 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.987 1.699 5.374 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.268 0.628 3.981 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.063 -0.223 4.810 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.794 -1.300 4.178 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.584 -1.669 5.730 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.227 -2.793 8.309 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.305 -3.847 8.700 1.00 0.00 C ATOM 2709 C GLY B 78 -3.037 -5.012 9.365 1.00 0.00 C ATOM 2710 O GLY B 78 -2.867 -6.162 8.968 1.00 0.00 O ATOM 0 H GLY B 78 -3.005 -1.881 8.708 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.768 -4.207 7.822 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.560 -3.444 9.386 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.868 -4.733 10.370 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.673 -5.760 11.015 1.00 0.00 C ATOM 2716 C ALA B 79 -5.559 -6.481 9.996 1.00 0.00 C ATOM 2717 O ALA B 79 -5.632 -7.705 10.004 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.491 -5.161 12.163 1.00 0.00 C ATOM 0 H ALA B 79 -3.998 -3.797 10.754 1.00 0.00 H new ATOM 0 HA ALA B 79 -4.005 -6.507 11.444 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -6.086 -5.944 12.633 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -4.817 -4.725 12.901 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -6.152 -4.387 11.773 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.203 -5.739 9.096 1.00 0.00 N ATOM 2725 CA LEU B 80 -7.037 -6.280 8.033 1.00 0.00 C ATOM 2726 C LEU B 80 -6.217 -7.243 7.169 1.00 0.00 C ATOM 2727 O LEU B 80 -6.628 -8.372 6.915 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.620 -5.121 7.204 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.950 -5.466 6.517 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.108 -5.546 7.521 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.287 -4.369 5.502 1.00 0.00 C ATOM 0 H LEU B 80 -6.156 -4.720 9.089 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.868 -6.844 8.457 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.769 -4.259 7.854 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.894 -4.826 6.446 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.831 -6.437 6.037 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -11.030 -5.792 6.994 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.896 -6.318 8.261 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.222 -4.585 8.022 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.230 -4.606 5.010 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.377 -3.412 6.017 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.494 -4.307 4.757 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.030 -6.804 6.749 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.092 -7.615 5.990 1.00 0.00 C ATOM 2745 C ALA B 81 -3.700 -8.874 6.768 1.00 0.00 C ATOM 2746 O ALA B 81 -3.612 -9.955 6.194 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.877 -6.773 5.608 1.00 0.00 C ATOM 0 H ALA B 81 -4.693 -5.859 6.932 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.571 -7.953 5.071 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.176 -7.383 5.039 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.197 -5.927 5.000 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.389 -6.407 6.512 1.00 0.00 H new ATOM 2753 N MET B 82 -3.476 -8.749 8.077 1.00 0.00 N ATOM 2754 CA MET B 82 -3.143 -9.888 8.917 1.00 0.00 C ATOM 2755 C MET B 82 -4.322 -10.864 9.016 1.00 0.00 C ATOM 2756 O MET B 82 -4.130 -12.075 8.948 1.00 0.00 O ATOM 2757 CB MET B 82 -2.640 -9.394 10.280 1.00 0.00 C ATOM 2758 CG MET B 82 -1.922 -10.503 11.056 1.00 0.00 C ATOM 2759 SD MET B 82 -0.947 -9.913 12.463 1.00 0.00 S ATOM 2760 CE MET B 82 -0.325 -11.486 13.093 1.00 0.00 C ATOM 0 H MET B 82 -3.521 -7.861 8.576 1.00 0.00 H new ATOM 0 HA MET B 82 -2.331 -10.456 8.463 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.961 -8.554 10.134 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.482 -9.026 10.867 1.00 0.00 H new ATOM 0 HG2 MET B 82 -2.663 -11.217 11.416 1.00 0.00 H new ATOM 0 HG3 MET B 82 -1.265 -11.042 10.373 1.00 0.00 H new ATOM 0 HE1 MET B 82 0.300 -11.306 13.968 1.00 0.00 H new ATOM 0 HE2 MET B 82 -1.164 -12.124 13.371 1.00 0.00 H new ATOM 0 HE3 MET B 82 0.265 -11.979 12.321 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.542 -10.337 9.155 1.00 0.00 N ATOM 2771 CA ILE B 83 -6.771 -11.121 9.129 1.00 0.00 C ATOM 2772 C ILE B 83 -6.882 -11.839 7.781 1.00 0.00 C ATOM 2773 O ILE B 83 -7.241 -13.016 7.743 1.00 0.00 O ATOM 2774 CB ILE B 83 -7.988 -10.231 9.459 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -7.940 -9.835 10.948 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.311 -10.951 9.151 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -8.840 -8.640 11.276 1.00 0.00 C ATOM 0 H ILE B 83 -5.701 -9.339 9.291 1.00 0.00 H new ATOM 0 HA ILE B 83 -6.749 -11.890 9.901 1.00 0.00 H new ATOM 0 HB ILE B 83 -7.942 -9.339 8.834 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.242 -10.688 11.556 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -6.913 -9.596 11.222 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.147 -10.296 9.395 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.348 -11.207 8.092 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.377 -11.861 9.747 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -8.764 -8.408 12.338 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.524 -7.775 10.692 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -9.874 -8.885 11.031 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.523 -11.172 6.679 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.371 -11.800 5.371 1.00 0.00 C ATOM 2791 C TYR B 84 -5.116 -12.689 5.351 1.00 0.00 C ATOM 2792 O TYR B 84 -4.253 -12.544 4.487 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.288 -10.725 4.272 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.416 -9.713 4.174 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.718 -10.011 4.621 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.168 -8.488 3.525 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.759 -9.087 4.424 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.209 -7.566 3.326 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.508 -7.873 3.765 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.528 -6.993 3.560 1.00 0.00 O ATOM 0 H TYR B 84 -6.329 -10.171 6.675 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.242 -12.426 5.178 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.358 -10.175 4.414 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.213 -11.235 3.312 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.917 -10.950 5.116 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.172 -8.256 3.178 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.754 -9.311 4.780 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.011 -6.624 2.837 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.188 -6.202 3.092 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.004 -13.643 6.279 1.00 0.00 N ATOM 2811 CA ASN B 85 -3.776 -14.401 6.484 1.00 0.00 C ATOM 2812 C ASN B 85 -3.398 -15.193 5.230 1.00 0.00 C ATOM 2813 O ASN B 85 -2.220 -15.449 4.996 1.00 0.00 O ATOM 2814 CB ASN B 85 -3.886 -15.303 7.723 1.00 0.00 C ATOM 2815 CG ASN B 85 -2.531 -15.560 8.392 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -2.415 -15.472 9.611 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -1.488 -15.875 7.630 1.00 0.00 N ATOM 0 H ASN B 85 -5.763 -13.908 6.906 1.00 0.00 H new ATOM 0 HA ASN B 85 -2.968 -13.693 6.670 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.561 -14.841 8.444 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -4.331 -16.256 7.435 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -0.578 -16.047 8.057 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -1.598 -15.945 6.618 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.376 -15.569 4.402 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.115 -16.185 3.109 1.00 0.00 C ATOM 2826 C GLU B 86 -3.227 -15.298 2.226 1.00 0.00 C ATOM 2827 O GLU B 86 -2.372 -15.810 1.508 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.426 -16.607 2.420 1.00 0.00 C ATOM 2829 CG GLU B 86 -6.317 -15.475 1.875 1.00 0.00 C ATOM 2830 CD GLU B 86 -6.927 -14.562 2.938 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -7.038 -15.010 4.100 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -7.269 -13.421 2.565 1.00 0.00 O ATOM 0 H GLU B 86 -5.367 -15.453 4.613 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.547 -17.100 3.278 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -5.177 -17.272 1.593 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -6.012 -17.189 3.131 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -5.726 -14.866 1.191 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -7.124 -15.918 1.292 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.399 -13.972 2.288 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.548 -13.037 1.564 1.00 0.00 C ATOM 2841 C ALA B 87 -1.119 -13.113 2.100 1.00 0.00 C ATOM 2842 O ALA B 87 -0.171 -13.161 1.320 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.105 -11.614 1.670 1.00 0.00 C ATOM 0 H ALA B 87 -4.130 -13.525 2.841 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.534 -13.310 0.509 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.457 -10.928 1.124 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.108 -11.583 1.244 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.147 -11.317 2.718 1.00 0.00 H new ATOM 2849 N LEU B 88 -0.965 -13.143 3.428 1.00 0.00 N ATOM 2850 CA LEU B 88 0.344 -13.294 4.051 1.00 0.00 C ATOM 2851 C LEU B 88 0.993 -14.614 3.622 1.00 0.00 C ATOM 2852 O LEU B 88 2.172 -14.655 3.281 1.00 0.00 O ATOM 2853 CB LEU B 88 0.245 -13.221 5.582 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.353 -11.930 6.170 1.00 0.00 C ATOM 2855 CD1 LEU B 88 0.108 -11.812 7.628 1.00 0.00 C ATOM 2856 CD2 LEU B 88 0.051 -10.656 5.424 1.00 0.00 C ATOM 0 H LEU B 88 -1.737 -13.064 4.090 1.00 0.00 H new ATOM 0 HA LEU B 88 0.971 -12.468 3.715 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.356 -14.063 5.926 1.00 0.00 H new ATOM 0 HB3 LEU B 88 1.245 -13.353 5.995 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.436 -12.010 6.078 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.304 -10.903 8.067 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.241 -12.678 8.191 1.00 0.00 H new ATOM 0 HD13 LEU B 88 1.197 -11.771 7.663 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.412 -9.792 5.901 1.00 0.00 H new ATOM 0 HD22 LEU B 88 1.135 -10.547 5.450 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.282 -10.720 4.388 1.00 0.00 H new ATOM 2868 N LYS B 89 0.221 -15.703 3.650 1.00 0.00 N ATOM 2869 CA LYS B 89 0.686 -17.023 3.250 1.00 0.00 C ATOM 2870 C LYS B 89 1.122 -17.012 1.782 1.00 0.00 C ATOM 2871 O LYS B 89 2.169 -17.558 1.439 1.00 0.00 O ATOM 2872 CB LYS B 89 -0.432 -18.044 3.507 1.00 0.00 C ATOM 2873 CG LYS B 89 0.044 -19.490 3.303 1.00 0.00 C ATOM 2874 CD LYS B 89 -1.114 -20.494 3.382 1.00 0.00 C ATOM 2875 CE LYS B 89 -1.800 -20.497 4.753 1.00 0.00 C ATOM 2876 NZ LYS B 89 -2.805 -21.570 4.845 1.00 0.00 N ATOM 0 H LYS B 89 -0.752 -15.688 3.955 1.00 0.00 H new ATOM 0 HA LYS B 89 1.557 -17.308 3.840 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -0.803 -17.926 4.525 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -1.268 -17.841 2.838 1.00 0.00 H new ATOM 0 HG2 LYS B 89 0.533 -19.577 2.333 1.00 0.00 H new ATOM 0 HG3 LYS B 89 0.789 -19.736 4.059 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -1.849 -20.256 2.613 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -0.738 -21.494 3.166 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -1.053 -20.627 5.536 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -2.278 -19.532 4.925 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -3.252 -21.547 5.784 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -3.530 -21.430 4.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -2.343 -22.491 4.704 1.00 0.00 H new ATOM 2890 N GLY B 90 0.299 -16.426 0.910 1.00 0.00 N ATOM 2891 CA GLY B 90 0.520 -16.453 -0.525 1.00 0.00 C ATOM 2892 C GLY B 90 0.447 -17.882 -1.067 1.00 0.00 C ATOM 2893 O GLY B 90 1.146 -18.144 -2.069 1.00 0.00 O ATOM 2894 OXT GLY B 90 -0.320 -18.684 -0.487 1.00 0.00 O ATOM 0 H GLY B 90 -0.541 -15.919 1.187 1.00 0.00 H new ATOM 0 HA2 GLY B 90 -0.226 -15.834 -1.023 1.00 0.00 H new ATOM 0 HA3 GLY B 90 1.495 -16.023 -0.754 1.00 0.00 H new