USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=32 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 17 HIS : no HE2:sc= 0.91 K(o=5.2,f=-7.1!) USER MOD Set 1.2: A 27 HIS : no HE2:sc= 1.1 K(o=5.2,f=-11!) USER MOD Set 1.3: B 85 ASN : amide:sc= 2.11 K(o=5.2,f=-2.1) USER MOD Set 1.4: B 89 LYS NZ :NH3+ -143:sc= 1.09 (180deg=-0.0474) USER MOD Set 2.1: B 28 THR OG1 : rot -23:sc= 0.191 USER MOD Set 2.2: B 69 ASN : amide:sc= 1.09 K(o=1.3,f=0.14) USER MOD Set 3.1: B 17 HIS : no HE2:sc= 1.88 K(o=3.1,f=-9!) USER MOD Set 3.2: B 27 HIS : no HE2:sc= 1.26 K(o=3.1,f=-8.1!) USER MOD Set 4.1: A 31 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.056) USER MOD Set 4.2: A 66 GLN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Set 5.1: A 28 THR OG1 : rot 11:sc= 0.535 USER MOD Set 5.2: A 69 ASN : amide:sc= 0.205 K(o=0.74,f=-1.4) USER MOD Set 6.1: A 7 GLN : amide:sc= 0.633 K(o=1.5,f=-0.67) USER MOD Set 6.2: B 7 GLN : amide:sc= 0.867 K(o=1.5,f=-0.67) USER MOD Single : A 3 SER OG : rot -29:sc= 0.25 USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= -0.0499 (180deg=-0.0724) USER MOD Single : A 19 TYR OH : rot -24:sc= 1.21 USER MOD Single : A 20 SER OG : rot 73:sc= 0.919 USER MOD Single : A 30 SER OG : rot 180:sc= 0.163 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -178:sc= 0.607 (180deg=0.599) USER MOD Single : A 39 GLN : amide:sc= 0.625 K(o=0.63,f=-0.21) USER MOD Single : A 40 LYS NZ :NH3+ -165:sc= 0.979 (180deg=0.695) USER MOD Single : A 55 LYS NZ :NH3+ 176:sc= 0.714 (180deg=0.695) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -0.186! C(o=-0.19!,f=-3.5!) USER MOD Single : A 64 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0463) USER MOD Single : A 71 GLN : amide:sc= 1.21 K(o=1.2,f=-1.5!) USER MOD Single : A 73 TYR OH : rot 156:sc= 1.1 USER MOD Single : A 75 THR OG1 : rot 75:sc= 0.938 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot -176:sc= 1.2 USER MOD Single : A 85 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : B 3 SER OG : rot 9:sc= 0.806 USER MOD Single : B 18 LYS NZ :NH3+ 143:sc= -0.636 (180deg=-1.35) USER MOD Single : B 19 TYR OH : rot 180:sc=-0.00519 USER MOD Single : B 20 SER OG : rot -97:sc= 1.07 USER MOD Single : B 30 SER OG : rot 180:sc= -0.0111 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -132:sc= 0.536 (180deg=-1.22) USER MOD Single : B 39 GLN : amide:sc= 0.819 K(o=0.82,f=-0.12) USER MOD Single : B 40 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0368) USER MOD Single : B 55 LYS NZ :NH3+ 159:sc= 0.605 (180deg=0.368) USER MOD Single : B 57 MET CE :methyl -165:sc= -0.0223 (180deg=-0.259) USER MOD Single : B 71 GLN : amide:sc=-0.000643 X(o=-0.00064,f=0) USER MOD Single : B 73 TYR OH : rot -19:sc= 1.15 USER MOD Single : B 75 THR OG1 : rot 78:sc= 1.04 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -9.670 -4.024 -5.670 1.00 0.00 N ATOM 31 CA SER A 3 -8.475 -3.929 -6.490 1.00 0.00 C ATOM 32 C SER A 3 -7.567 -2.723 -6.177 1.00 0.00 C ATOM 33 O SER A 3 -6.395 -2.955 -5.870 1.00 0.00 O ATOM 34 CB SER A 3 -8.891 -4.010 -7.968 1.00 0.00 C ATOM 35 OG SER A 3 -10.132 -3.364 -8.212 1.00 0.00 O ATOM 0 HA SER A 3 -7.833 -4.775 -6.243 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.118 -3.554 -8.587 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.963 -5.056 -8.267 1.00 0.00 H new ATOM 0 HG SER A 3 -10.683 -3.398 -7.402 1.00 0.00 H new ATOM 41 N PRO A 4 -8.030 -1.461 -6.237 1.00 0.00 N ATOM 42 CA PRO A 4 -7.149 -0.314 -6.067 1.00 0.00 C ATOM 43 C PRO A 4 -6.432 -0.301 -4.717 1.00 0.00 C ATOM 44 O PRO A 4 -5.246 0.018 -4.671 1.00 0.00 O ATOM 45 CB PRO A 4 -8.019 0.932 -6.273 1.00 0.00 C ATOM 46 CG PRO A 4 -9.438 0.430 -6.009 1.00 0.00 C ATOM 47 CD PRO A 4 -9.381 -1.004 -6.529 1.00 0.00 C ATOM 0 HA PRO A 4 -6.339 -0.352 -6.795 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.743 1.732 -5.586 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -7.916 1.330 -7.283 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -9.692 0.468 -4.950 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -10.184 1.024 -6.537 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -10.124 -1.631 -6.037 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -9.588 -1.044 -7.598 1.00 0.00 H new ATOM 55 N LEU A 5 -7.122 -0.629 -3.621 1.00 0.00 N ATOM 56 CA LEU A 5 -6.466 -0.708 -2.322 1.00 0.00 C ATOM 57 C LEU A 5 -5.747 -2.049 -2.178 1.00 0.00 C ATOM 58 O LEU A 5 -4.611 -2.107 -1.704 1.00 0.00 O ATOM 59 CB LEU A 5 -7.469 -0.463 -1.189 1.00 0.00 C ATOM 60 CG LEU A 5 -6.790 -0.465 0.192 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.692 0.596 0.318 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.823 -0.170 1.275 1.00 0.00 C ATOM 0 H LEU A 5 -8.120 -0.840 -3.610 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.714 0.078 -2.253 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.968 0.493 -1.347 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.240 -1.233 -1.215 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.343 -1.452 0.309 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.250 0.546 1.313 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.921 0.413 -0.431 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -6.122 1.585 0.161 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.338 -0.172 2.251 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.270 0.807 1.095 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.600 -0.934 1.254 1.00 0.00 H new ATOM 74 N ASP A 6 -6.416 -3.130 -2.589 1.00 0.00 N ATOM 75 CA ASP A 6 -5.904 -4.489 -2.488 1.00 0.00 C ATOM 76 C ASP A 6 -4.514 -4.601 -3.100 1.00 0.00 C ATOM 77 O ASP A 6 -3.657 -5.236 -2.492 1.00 0.00 O ATOM 78 CB ASP A 6 -6.867 -5.509 -3.103 1.00 0.00 C ATOM 79 CG ASP A 6 -8.007 -5.879 -2.154 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.558 -4.955 -1.517 1.00 0.00 O ATOM 81 OD2 ASP A 6 -8.309 -7.089 -2.083 1.00 0.00 O ATOM 0 H ASP A 6 -7.345 -3.078 -3.008 1.00 0.00 H new ATOM 0 HA ASP A 6 -5.822 -4.725 -1.427 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.283 -5.102 -4.025 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.315 -6.410 -3.372 1.00 0.00 H new ATOM 86 N GLN A 7 -4.258 -3.989 -4.264 1.00 0.00 N ATOM 87 CA GLN A 7 -2.906 -4.024 -4.816 1.00 0.00 C ATOM 88 C GLN A 7 -1.906 -3.426 -3.832 1.00 0.00 C ATOM 89 O GLN A 7 -0.840 -3.992 -3.623 1.00 0.00 O ATOM 90 CB GLN A 7 -2.815 -3.385 -6.214 1.00 0.00 C ATOM 91 CG GLN A 7 -2.910 -1.852 -6.235 1.00 0.00 C ATOM 92 CD GLN A 7 -1.596 -1.089 -5.997 1.00 0.00 C ATOM 93 OE1 GLN A 7 -0.508 -1.657 -5.918 1.00 0.00 O ATOM 94 NE2 GLN A 7 -1.687 0.232 -5.894 1.00 0.00 N ATOM 0 H GLN A 7 -4.945 -3.482 -4.822 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.640 -5.071 -4.961 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.871 -3.682 -6.672 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.613 -3.792 -6.836 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -3.314 -1.547 -7.200 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -3.629 -1.542 -5.476 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -2.597 0.687 -5.962 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -0.847 0.791 -5.747 1.00 0.00 H new ATOM 103 N ALA A 8 -2.249 -2.296 -3.208 1.00 0.00 N ATOM 104 CA ALA A 8 -1.328 -1.591 -2.338 1.00 0.00 C ATOM 105 C ALA A 8 -1.035 -2.413 -1.087 1.00 0.00 C ATOM 106 O ALA A 8 0.125 -2.698 -0.796 1.00 0.00 O ATOM 107 CB ALA A 8 -1.874 -0.211 -1.995 1.00 0.00 C ATOM 0 H ALA A 8 -3.164 -1.855 -3.295 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.383 -1.451 -2.863 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.172 0.306 -1.341 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.009 0.365 -2.911 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.833 -0.315 -1.487 1.00 0.00 H new ATOM 113 N ILE A 9 -2.069 -2.823 -0.345 1.00 0.00 N ATOM 114 CA ILE A 9 -1.824 -3.665 0.825 1.00 0.00 C ATOM 115 C ILE A 9 -1.128 -4.966 0.385 1.00 0.00 C ATOM 116 O ILE A 9 -0.140 -5.384 0.989 1.00 0.00 O ATOM 117 CB ILE A 9 -3.079 -3.841 1.708 1.00 0.00 C ATOM 118 CG1 ILE A 9 -4.248 -4.548 1.011 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.516 -2.469 2.242 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.414 -4.842 1.966 1.00 0.00 C ATOM 0 H ILE A 9 -3.047 -2.596 -0.525 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.131 -3.162 1.500 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.796 -4.501 2.528 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.604 -3.928 0.188 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.895 -5.483 0.576 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.402 -2.587 2.866 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.710 -2.035 2.834 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.747 -1.810 1.405 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.214 -5.343 1.420 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.068 -5.486 2.775 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.789 -3.907 2.381 1.00 0.00 H new ATOM 132 N GLY A 10 -1.579 -5.548 -0.732 1.00 0.00 N ATOM 133 CA GLY A 10 -0.955 -6.681 -1.398 1.00 0.00 C ATOM 134 C GLY A 10 0.539 -6.466 -1.621 1.00 0.00 C ATOM 135 O GLY A 10 1.328 -7.385 -1.433 1.00 0.00 O ATOM 0 H GLY A 10 -2.421 -5.225 -1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.106 -7.580 -0.800 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.443 -6.850 -2.358 1.00 0.00 H new ATOM 139 N LEU A 11 0.937 -5.259 -2.022 1.00 0.00 N ATOM 140 CA LEU A 11 2.318 -4.891 -2.281 1.00 0.00 C ATOM 141 C LEU A 11 3.141 -5.058 -1.003 1.00 0.00 C ATOM 142 O LEU A 11 4.088 -5.846 -0.968 1.00 0.00 O ATOM 143 CB LEU A 11 2.340 -3.448 -2.808 1.00 0.00 C ATOM 144 CG LEU A 11 3.580 -3.017 -3.588 1.00 0.00 C ATOM 145 CD1 LEU A 11 4.875 -3.215 -2.807 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.635 -3.636 -4.985 1.00 0.00 C ATOM 0 H LEU A 11 0.284 -4.492 -2.179 1.00 0.00 H new ATOM 0 HA LEU A 11 2.765 -5.539 -3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.470 -3.308 -3.449 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.222 -2.775 -1.959 1.00 0.00 H new ATOM 0 HG LEU A 11 3.484 -1.941 -3.732 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.720 -2.890 -3.415 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.840 -2.627 -1.890 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.992 -4.270 -2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.536 -3.298 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.652 -4.723 -4.901 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.757 -3.329 -5.554 1.00 0.00 H new ATOM 158 N LEU A 12 2.772 -4.328 0.054 1.00 0.00 N ATOM 159 CA LEU A 12 3.432 -4.401 1.352 1.00 0.00 C ATOM 160 C LEU A 12 3.527 -5.857 1.813 1.00 0.00 C ATOM 161 O LEU A 12 4.590 -6.296 2.263 1.00 0.00 O ATOM 162 CB LEU A 12 2.662 -3.571 2.395 1.00 0.00 C ATOM 163 CG LEU A 12 2.966 -2.065 2.360 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.453 -1.372 1.095 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.318 -1.380 3.568 1.00 0.00 C ATOM 0 H LEU A 12 1.998 -3.664 0.028 1.00 0.00 H new ATOM 0 HA LEU A 12 4.437 -3.992 1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.593 -3.717 2.240 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.895 -3.953 3.389 1.00 0.00 H new ATOM 0 HG LEU A 12 4.052 -1.974 2.377 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.701 -0.311 1.135 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.921 -1.821 0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.371 -1.489 1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.535 -0.312 3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.239 -1.532 3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.718 -1.808 4.487 1.00 0.00 H new ATOM 177 N ILE A 13 2.414 -6.590 1.709 1.00 0.00 N ATOM 178 CA ILE A 13 2.337 -7.990 2.101 1.00 0.00 C ATOM 179 C ILE A 13 3.340 -8.814 1.297 1.00 0.00 C ATOM 180 O ILE A 13 4.140 -9.546 1.873 1.00 0.00 O ATOM 181 CB ILE A 13 0.892 -8.502 1.923 1.00 0.00 C ATOM 182 CG1 ILE A 13 -0.065 -7.820 2.918 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.799 -10.023 2.095 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.530 -7.953 2.484 1.00 0.00 C ATOM 0 H ILE A 13 1.536 -6.219 1.346 1.00 0.00 H new ATOM 0 HA ILE A 13 2.599 -8.094 3.154 1.00 0.00 H new ATOM 0 HB ILE A 13 0.596 -8.249 0.905 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.063 -8.262 3.906 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.194 -6.765 3.005 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.235 -10.342 1.962 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.428 -10.512 1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.137 -10.298 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.172 -7.458 3.213 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.664 -7.487 1.508 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.797 -9.008 2.422 1.00 0.00 H new ATOM 196 N GLY A 14 3.304 -8.692 -0.028 1.00 0.00 N ATOM 197 CA GLY A 14 4.165 -9.424 -0.935 1.00 0.00 C ATOM 198 C GLY A 14 5.629 -9.163 -0.609 1.00 0.00 C ATOM 199 O GLY A 14 6.395 -10.108 -0.419 1.00 0.00 O ATOM 0 H GLY A 14 2.657 -8.064 -0.506 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.955 -10.491 -0.863 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.957 -9.127 -1.963 1.00 0.00 H new ATOM 203 N ILE A 15 6.022 -7.884 -0.545 1.00 0.00 N ATOM 204 CA ILE A 15 7.378 -7.494 -0.175 1.00 0.00 C ATOM 205 C ILE A 15 7.764 -8.234 1.108 1.00 0.00 C ATOM 206 O ILE A 15 8.764 -8.953 1.157 1.00 0.00 O ATOM 207 CB ILE A 15 7.461 -5.953 -0.063 1.00 0.00 C ATOM 208 CG1 ILE A 15 7.748 -5.375 -1.458 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.521 -5.492 0.944 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.702 -3.844 -1.505 1.00 0.00 C ATOM 0 H ILE A 15 5.406 -7.097 -0.749 1.00 0.00 H new ATOM 0 HA ILE A 15 8.102 -7.779 -0.938 1.00 0.00 H new ATOM 0 HB ILE A 15 6.506 -5.583 0.311 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.731 -5.712 -1.787 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.021 -5.775 -2.165 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.537 -4.403 0.983 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.281 -5.887 1.931 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.500 -5.858 0.635 1.00 0.00 H new ATOM 0 HD11 ILE A 15 7.914 -3.505 -2.519 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.712 -3.500 -1.207 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.448 -3.436 -0.823 1.00 0.00 H new ATOM 222 N PHE A 16 6.933 -8.076 2.136 1.00 0.00 N ATOM 223 CA PHE A 16 7.203 -8.627 3.446 1.00 0.00 C ATOM 224 C PHE A 16 7.396 -10.139 3.401 1.00 0.00 C ATOM 225 O PHE A 16 8.411 -10.667 3.856 1.00 0.00 O ATOM 226 CB PHE A 16 6.051 -8.250 4.378 1.00 0.00 C ATOM 227 CG PHE A 16 6.293 -8.633 5.813 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.934 -7.731 6.678 1.00 0.00 C ATOM 229 CD2 PHE A 16 5.992 -9.932 6.253 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.153 -8.078 8.017 1.00 0.00 C ATOM 231 CE2 PHE A 16 6.331 -10.318 7.555 1.00 0.00 C ATOM 232 CZ PHE A 16 6.850 -9.373 8.455 1.00 0.00 C ATOM 0 H PHE A 16 6.055 -7.561 2.076 1.00 0.00 H new ATOM 0 HA PHE A 16 8.138 -8.209 3.820 1.00 0.00 H new ATOM 0 HB2 PHE A 16 5.884 -7.174 4.320 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.138 -8.734 4.030 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.258 -6.769 6.310 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.502 -10.630 5.590 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.553 -7.351 8.708 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.193 -11.343 7.868 1.00 0.00 H new ATOM 0 HZ PHE A 16 7.016 -9.646 9.487 1.00 0.00 H new ATOM 242 N HIS A 17 6.395 -10.854 2.895 1.00 0.00 N ATOM 243 CA HIS A 17 6.371 -12.297 3.014 1.00 0.00 C ATOM 244 C HIS A 17 7.397 -12.950 2.094 1.00 0.00 C ATOM 245 O HIS A 17 7.919 -14.005 2.444 1.00 0.00 O ATOM 246 CB HIS A 17 4.957 -12.848 2.829 1.00 0.00 C ATOM 247 CG HIS A 17 4.733 -14.102 3.637 1.00 0.00 C ATOM 248 ND1 HIS A 17 4.436 -15.355 3.154 1.00 0.00 N ATOM 249 CD2 HIS A 17 4.691 -14.167 5.004 1.00 0.00 C ATOM 250 CE1 HIS A 17 4.210 -16.151 4.217 1.00 0.00 C ATOM 251 NE2 HIS A 17 4.345 -15.471 5.372 1.00 0.00 N ATOM 0 H HIS A 17 5.596 -10.454 2.402 1.00 0.00 H new ATOM 0 HA HIS A 17 6.668 -12.559 4.030 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.231 -12.091 3.124 1.00 0.00 H new ATOM 0 HB3 HIS A 17 4.785 -13.060 1.774 1.00 0.00 H new ATOM 0 HD1 HIS A 17 4.395 -15.630 2.173 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.891 -13.351 5.682 1.00 0.00 H new ATOM 0 HE1 HIS A 17 3.954 -17.198 4.152 1.00 0.00 H new ATOM 259 N LYS A 18 7.743 -12.324 0.962 1.00 0.00 N ATOM 260 CA LYS A 18 8.871 -12.815 0.177 1.00 0.00 C ATOM 261 C LYS A 18 10.144 -12.737 1.021 1.00 0.00 C ATOM 262 O LYS A 18 10.865 -13.725 1.159 1.00 0.00 O ATOM 263 CB LYS A 18 9.037 -12.038 -1.136 1.00 0.00 C ATOM 264 CG LYS A 18 7.964 -12.424 -2.164 1.00 0.00 C ATOM 265 CD LYS A 18 8.320 -11.935 -3.577 1.00 0.00 C ATOM 266 CE LYS A 18 8.596 -10.429 -3.662 1.00 0.00 C ATOM 267 NZ LYS A 18 7.461 -9.639 -3.158 1.00 0.00 N ATOM 0 H LYS A 18 7.272 -11.503 0.582 1.00 0.00 H new ATOM 0 HA LYS A 18 8.676 -13.852 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.980 -10.968 -0.935 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.026 -12.233 -1.551 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.845 -13.507 -2.174 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.005 -12.001 -1.864 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.199 -12.476 -3.927 1.00 0.00 H new ATOM 0 HD3 LYS A 18 7.502 -12.183 -4.254 1.00 0.00 H new ATOM 0 HE2 LYS A 18 9.490 -10.190 -3.086 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.800 -10.154 -4.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.663 -8.626 -3.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.602 -9.886 -3.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.315 -9.846 -2.149 1.00 0.00 H new ATOM 281 N TYR A 19 10.415 -11.568 1.607 1.00 0.00 N ATOM 282 CA TYR A 19 11.583 -11.403 2.458 1.00 0.00 C ATOM 283 C TYR A 19 11.569 -12.366 3.649 1.00 0.00 C ATOM 284 O TYR A 19 12.607 -12.914 4.008 1.00 0.00 O ATOM 285 CB TYR A 19 11.736 -9.937 2.876 1.00 0.00 C ATOM 286 CG TYR A 19 12.666 -9.189 1.952 1.00 0.00 C ATOM 287 CD1 TYR A 19 14.046 -9.413 2.085 1.00 0.00 C ATOM 288 CD2 TYR A 19 12.180 -8.471 0.845 1.00 0.00 C ATOM 289 CE1 TYR A 19 14.931 -8.984 1.092 1.00 0.00 C ATOM 290 CE2 TYR A 19 13.074 -8.009 -0.135 1.00 0.00 C ATOM 291 CZ TYR A 19 14.446 -8.303 -0.033 1.00 0.00 C ATOM 292 OH TYR A 19 15.307 -7.933 -1.018 1.00 0.00 O ATOM 0 H TYR A 19 9.842 -10.730 1.505 1.00 0.00 H new ATOM 0 HA TYR A 19 12.468 -11.670 1.880 1.00 0.00 H new ATOM 0 HB2 TYR A 19 10.758 -9.455 2.877 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.118 -9.887 3.896 1.00 0.00 H new ATOM 0 HD1 TYR A 19 14.426 -9.920 2.960 1.00 0.00 H new ATOM 0 HD2 TYR A 19 11.122 -8.275 0.749 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.989 -9.177 1.192 1.00 0.00 H new ATOM 0 HE2 TYR A 19 12.708 -7.427 -0.968 1.00 0.00 H new ATOM 0 HH TYR A 19 16.212 -7.856 -0.650 1.00 0.00 H new ATOM 302 N SER A 20 10.404 -12.602 4.248 1.00 0.00 N ATOM 303 CA SER A 20 10.283 -13.576 5.325 1.00 0.00 C ATOM 304 C SER A 20 10.633 -14.976 4.807 1.00 0.00 C ATOM 305 O SER A 20 11.486 -15.667 5.369 1.00 0.00 O ATOM 306 CB SER A 20 8.882 -13.505 5.937 1.00 0.00 C ATOM 307 OG SER A 20 8.519 -12.163 6.220 1.00 0.00 O ATOM 0 H SER A 20 9.532 -12.132 4.005 1.00 0.00 H new ATOM 0 HA SER A 20 10.992 -13.343 6.120 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.158 -13.944 5.250 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.851 -14.095 6.853 1.00 0.00 H new ATOM 0 HG SER A 20 8.331 -11.691 5.382 1.00 0.00 H new ATOM 313 N GLY A 21 10.013 -15.367 3.691 1.00 0.00 N ATOM 314 CA GLY A 21 10.269 -16.617 2.997 1.00 0.00 C ATOM 315 C GLY A 21 11.755 -16.811 2.709 1.00 0.00 C ATOM 316 O GLY A 21 12.268 -17.918 2.854 1.00 0.00 O ATOM 0 H GLY A 21 9.298 -14.799 3.237 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.904 -17.449 3.600 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.712 -16.633 2.060 1.00 0.00 H new ATOM 398 N HIS A 27 4.961 -14.883 9.072 1.00 0.00 N ATOM 399 CA HIS A 27 4.494 -13.499 9.078 1.00 0.00 C ATOM 400 C HIS A 27 5.366 -12.621 9.988 1.00 0.00 C ATOM 401 O HIS A 27 4.862 -11.786 10.741 1.00 0.00 O ATOM 402 CB HIS A 27 3.018 -13.481 9.489 1.00 0.00 C ATOM 403 CG HIS A 27 2.149 -14.427 8.692 1.00 0.00 C ATOM 404 ND1 HIS A 27 2.376 -14.885 7.410 1.00 0.00 N ATOM 405 CD2 HIS A 27 1.010 -15.034 9.148 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.375 -15.724 7.098 1.00 0.00 C ATOM 407 NE2 HIS A 27 0.526 -15.861 8.130 1.00 0.00 N ATOM 0 HA HIS A 27 4.583 -13.074 8.078 1.00 0.00 H new ATOM 0 HB2 HIS A 27 2.942 -13.737 10.546 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.632 -12.468 9.378 1.00 0.00 H new ATOM 0 HD1 HIS A 27 3.161 -14.632 6.809 1.00 0.00 H new ATOM 0 HD2 HIS A 27 0.564 -14.898 10.122 1.00 0.00 H new ATOM 0 HE1 HIS A 27 1.267 -16.222 6.146 1.00 0.00 H new ATOM 415 N THR A 28 6.688 -12.806 9.939 1.00 0.00 N ATOM 416 CA THR A 28 7.667 -12.111 10.760 1.00 0.00 C ATOM 417 C THR A 28 8.990 -12.085 9.984 1.00 0.00 C ATOM 418 O THR A 28 9.292 -13.042 9.275 1.00 0.00 O ATOM 419 CB THR A 28 7.746 -12.772 12.150 1.00 0.00 C ATOM 420 OG1 THR A 28 6.539 -12.512 12.855 1.00 0.00 O ATOM 421 CG2 THR A 28 8.900 -12.237 13.001 1.00 0.00 C ATOM 0 H THR A 28 7.117 -13.473 9.298 1.00 0.00 H new ATOM 0 HA THR A 28 7.387 -11.076 10.956 1.00 0.00 H new ATOM 0 HB THR A 28 7.908 -13.837 11.984 1.00 0.00 H new ATOM 0 HG1 THR A 28 5.877 -12.132 12.241 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.903 -12.741 13.968 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.845 -12.424 12.491 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.775 -11.165 13.151 1.00 0.00 H new ATOM 429 N LEU A 29 9.741 -10.985 10.092 1.00 0.00 N ATOM 430 CA LEU A 29 11.079 -10.804 9.527 1.00 0.00 C ATOM 431 C LEU A 29 12.087 -10.710 10.667 1.00 0.00 C ATOM 432 O LEU A 29 11.713 -10.318 11.769 1.00 0.00 O ATOM 433 CB LEU A 29 11.162 -9.455 8.791 1.00 0.00 C ATOM 434 CG LEU A 29 10.381 -9.357 7.478 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.320 -7.893 7.029 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.075 -10.148 6.374 1.00 0.00 C ATOM 0 H LEU A 29 9.417 -10.161 10.598 1.00 0.00 H new ATOM 0 HA LEU A 29 11.283 -11.638 8.856 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.804 -8.675 9.463 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.210 -9.241 8.584 1.00 0.00 H new ATOM 0 HG LEU A 29 9.383 -9.759 7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.764 -7.822 6.094 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.821 -7.298 7.794 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.332 -7.516 6.879 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.502 -10.064 5.451 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.077 -9.750 6.216 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.142 -11.196 6.665 1.00 0.00 H new ATOM 448 N SER A 30 13.366 -10.997 10.408 1.00 0.00 N ATOM 449 CA SER A 30 14.434 -10.654 11.338 1.00 0.00 C ATOM 450 C SER A 30 14.876 -9.216 11.044 1.00 0.00 C ATOM 451 O SER A 30 14.690 -8.730 9.926 1.00 0.00 O ATOM 452 CB SER A 30 15.611 -11.626 11.199 1.00 0.00 C ATOM 453 OG SER A 30 16.239 -11.478 9.938 1.00 0.00 O ATOM 0 H SER A 30 13.682 -11.467 9.560 1.00 0.00 H new ATOM 0 HA SER A 30 14.074 -10.730 12.364 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.334 -11.445 11.994 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.258 -12.651 11.317 1.00 0.00 H new ATOM 0 HG SER A 30 16.988 -12.106 9.870 1.00 0.00 H new ATOM 459 N LYS A 31 15.472 -8.526 12.020 1.00 0.00 N ATOM 460 CA LYS A 31 15.882 -7.138 11.827 1.00 0.00 C ATOM 461 C LYS A 31 16.825 -6.951 10.626 1.00 0.00 C ATOM 462 O LYS A 31 16.706 -5.995 9.863 1.00 0.00 O ATOM 463 CB LYS A 31 16.428 -6.544 13.135 1.00 0.00 C ATOM 464 CG LYS A 31 17.889 -6.851 13.511 1.00 0.00 C ATOM 465 CD LYS A 31 18.137 -8.315 13.901 1.00 0.00 C ATOM 466 CE LYS A 31 19.594 -8.563 14.307 1.00 0.00 C ATOM 467 NZ LYS A 31 19.933 -7.904 15.582 1.00 0.00 N ATOM 0 H LYS A 31 15.679 -8.905 12.944 1.00 0.00 H new ATOM 0 HA LYS A 31 14.992 -6.565 11.565 1.00 0.00 H new ATOM 0 HB2 LYS A 31 16.317 -5.461 13.082 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.793 -6.891 13.950 1.00 0.00 H new ATOM 0 HG2 LYS A 31 18.532 -6.596 12.669 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.183 -6.209 14.342 1.00 0.00 H new ATOM 0 HD2 LYS A 31 17.479 -8.586 14.727 1.00 0.00 H new ATOM 0 HD3 LYS A 31 17.879 -8.962 13.063 1.00 0.00 H new ATOM 0 HE2 LYS A 31 19.768 -9.635 14.396 1.00 0.00 H new ATOM 0 HE3 LYS A 31 20.256 -8.197 13.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 20.880 -8.206 15.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 19.924 -6.872 15.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 19.235 -8.169 16.306 1.00 0.00 H new ATOM 481 N LYS A 32 17.765 -7.878 10.435 1.00 0.00 N ATOM 482 CA LYS A 32 18.708 -7.821 9.328 1.00 0.00 C ATOM 483 C LYS A 32 18.013 -8.183 8.014 1.00 0.00 C ATOM 484 O LYS A 32 18.292 -7.561 6.989 1.00 0.00 O ATOM 485 CB LYS A 32 19.951 -8.654 9.680 1.00 0.00 C ATOM 486 CG LYS A 32 20.929 -8.962 8.531 1.00 0.00 C ATOM 487 CD LYS A 32 20.492 -10.021 7.499 1.00 0.00 C ATOM 488 CE LYS A 32 19.897 -11.291 8.124 1.00 0.00 C ATOM 489 NZ LYS A 32 19.567 -12.290 7.091 1.00 0.00 N ATOM 0 H LYS A 32 17.890 -8.686 11.045 1.00 0.00 H new ATOM 0 HA LYS A 32 19.072 -6.807 9.166 1.00 0.00 H new ATOM 0 HB2 LYS A 32 20.500 -8.130 10.462 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.616 -9.601 10.104 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.127 -8.032 7.998 1.00 0.00 H new ATOM 0 HG3 LYS A 32 21.873 -9.286 8.969 1.00 0.00 H new ATOM 0 HD2 LYS A 32 19.755 -9.578 6.829 1.00 0.00 H new ATOM 0 HD3 LYS A 32 21.353 -10.297 6.889 1.00 0.00 H new ATOM 0 HE2 LYS A 32 20.607 -11.718 8.832 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.999 -11.036 8.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 19.167 -13.137 7.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 18.872 -11.889 6.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 20.429 -12.550 6.571 1.00 0.00 H new ATOM 503 N GLU A 33 17.091 -9.152 8.011 1.00 0.00 N ATOM 504 CA GLU A 33 16.343 -9.440 6.793 1.00 0.00 C ATOM 505 C GLU A 33 15.538 -8.204 6.383 1.00 0.00 C ATOM 506 O GLU A 33 15.533 -7.822 5.214 1.00 0.00 O ATOM 507 CB GLU A 33 15.456 -10.673 6.982 1.00 0.00 C ATOM 508 CG GLU A 33 14.827 -11.139 5.663 1.00 0.00 C ATOM 509 CD GLU A 33 15.863 -11.753 4.722 1.00 0.00 C ATOM 510 OE1 GLU A 33 16.458 -10.983 3.937 1.00 0.00 O ATOM 511 OE2 GLU A 33 16.066 -12.981 4.822 1.00 0.00 O ATOM 0 H GLU A 33 16.853 -9.732 8.815 1.00 0.00 H new ATOM 0 HA GLU A 33 17.036 -9.673 5.985 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.048 -11.483 7.407 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.667 -10.445 7.699 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.047 -11.871 5.872 1.00 0.00 H new ATOM 0 HG3 GLU A 33 14.346 -10.293 5.171 1.00 0.00 H new ATOM 518 N LEU A 34 14.895 -7.550 7.356 1.00 0.00 N ATOM 519 CA LEU A 34 14.285 -6.245 7.152 1.00 0.00 C ATOM 520 C LEU A 34 15.320 -5.289 6.550 1.00 0.00 C ATOM 521 O LEU A 34 15.048 -4.622 5.555 1.00 0.00 O ATOM 522 CB LEU A 34 13.668 -5.747 8.471 1.00 0.00 C ATOM 523 CG LEU A 34 13.253 -4.264 8.520 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.455 -3.305 8.620 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.295 -3.913 7.371 1.00 0.00 C ATOM 0 H LEU A 34 14.786 -7.915 8.302 1.00 0.00 H new ATOM 0 HA LEU A 34 13.464 -6.305 6.437 1.00 0.00 H new ATOM 0 HB2 LEU A 34 12.789 -6.354 8.687 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.385 -5.927 9.272 1.00 0.00 H new ATOM 0 HG LEU A 34 12.700 -4.119 9.448 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.098 -2.276 8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.018 -3.521 9.528 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.101 -3.439 7.752 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.021 -2.860 7.434 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.786 -4.104 6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.397 -4.526 7.446 1.00 0.00 H new ATOM 537 N LYS A 35 16.523 -5.206 7.123 1.00 0.00 N ATOM 538 CA LYS A 35 17.542 -4.335 6.557 1.00 0.00 C ATOM 539 C LYS A 35 17.767 -4.638 5.066 1.00 0.00 C ATOM 540 O LYS A 35 17.849 -3.713 4.259 1.00 0.00 O ATOM 541 CB LYS A 35 18.839 -4.397 7.370 1.00 0.00 C ATOM 542 CG LYS A 35 19.648 -3.131 7.087 1.00 0.00 C ATOM 543 CD LYS A 35 20.994 -3.139 7.809 1.00 0.00 C ATOM 544 CE LYS A 35 21.695 -1.809 7.524 1.00 0.00 C ATOM 545 NZ LYS A 35 23.059 -1.794 8.079 1.00 0.00 N ATOM 0 H LYS A 35 16.806 -5.719 7.958 1.00 0.00 H new ATOM 0 HA LYS A 35 17.182 -3.308 6.618 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.616 -4.474 8.434 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.414 -5.283 7.100 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.813 -3.039 6.014 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.075 -2.257 7.398 1.00 0.00 H new ATOM 0 HD2 LYS A 35 20.850 -3.271 8.881 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.606 -3.973 7.465 1.00 0.00 H new ATOM 0 HE2 LYS A 35 21.736 -1.640 6.448 1.00 0.00 H new ATOM 0 HE3 LYS A 35 21.116 -0.991 7.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 23.497 -0.868 7.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 23.019 -1.965 9.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 23.626 -2.538 7.626 1.00 0.00 H new ATOM 559 N GLU A 36 17.837 -5.921 4.695 1.00 0.00 N ATOM 560 CA GLU A 36 17.955 -6.330 3.299 1.00 0.00 C ATOM 561 C GLU A 36 16.740 -5.856 2.484 1.00 0.00 C ATOM 562 O GLU A 36 16.904 -5.294 1.403 1.00 0.00 O ATOM 563 CB GLU A 36 18.151 -7.852 3.192 1.00 0.00 C ATOM 564 CG GLU A 36 19.109 -8.248 2.052 1.00 0.00 C ATOM 565 CD GLU A 36 18.784 -7.607 0.700 1.00 0.00 C ATOM 566 OE1 GLU A 36 17.824 -8.079 0.053 1.00 0.00 O ATOM 567 OE2 GLU A 36 19.512 -6.659 0.334 1.00 0.00 O ATOM 0 H GLU A 36 17.813 -6.699 5.354 1.00 0.00 H new ATOM 0 HA GLU A 36 18.839 -5.853 2.875 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.540 -8.232 4.137 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.184 -8.329 3.031 1.00 0.00 H new ATOM 0 HG2 GLU A 36 20.125 -7.973 2.336 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.092 -9.332 1.940 1.00 0.00 H new ATOM 574 N LEU A 37 15.526 -6.069 3.006 1.00 0.00 N ATOM 575 CA LEU A 37 14.288 -5.584 2.399 1.00 0.00 C ATOM 576 C LEU A 37 14.439 -4.113 2.044 1.00 0.00 C ATOM 577 O LEU A 37 14.225 -3.719 0.899 1.00 0.00 O ATOM 578 CB LEU A 37 13.100 -5.860 3.340 1.00 0.00 C ATOM 579 CG LEU A 37 11.717 -5.348 2.903 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.679 -6.104 3.740 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.500 -3.847 3.164 1.00 0.00 C ATOM 0 H LEU A 37 15.378 -6.589 3.871 1.00 0.00 H new ATOM 0 HA LEU A 37 14.083 -6.118 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.029 -6.938 3.486 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.330 -5.421 4.311 1.00 0.00 H new ATOM 0 HG LEU A 37 11.630 -5.508 1.828 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.678 -5.773 3.464 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.771 -7.174 3.554 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.849 -5.903 4.798 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.503 -3.560 2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.597 -3.645 4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.246 -3.271 2.616 1.00 0.00 H new ATOM 593 N ILE A 38 14.841 -3.301 3.020 1.00 0.00 N ATOM 594 CA ILE A 38 15.083 -1.890 2.786 1.00 0.00 C ATOM 595 C ILE A 38 16.128 -1.722 1.686 1.00 0.00 C ATOM 596 O ILE A 38 15.884 -0.995 0.731 1.00 0.00 O ATOM 597 CB ILE A 38 15.515 -1.205 4.088 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.353 -1.255 5.088 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.969 0.247 3.869 1.00 0.00 C ATOM 600 CD1 ILE A 38 14.756 -0.612 6.408 1.00 0.00 C ATOM 0 H ILE A 38 15.005 -3.603 3.980 1.00 0.00 H new ATOM 0 HA ILE A 38 14.162 -1.411 2.452 1.00 0.00 H new ATOM 0 HB ILE A 38 16.377 -1.744 4.481 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.487 -0.738 4.674 1.00 0.00 H new ATOM 0 HG13 ILE A 38 14.055 -2.290 5.257 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.264 0.684 4.823 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.817 0.264 3.185 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.148 0.825 3.444 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.919 -0.657 7.105 1.00 0.00 H new ATOM 0 HD12 ILE A 38 15.607 -1.147 6.828 1.00 0.00 H new ATOM 0 HD13 ILE A 38 15.030 0.429 6.237 1.00 0.00 H new ATOM 612 N GLN A 39 17.289 -2.369 1.812 1.00 0.00 N ATOM 613 CA GLN A 39 18.383 -2.179 0.869 1.00 0.00 C ATOM 614 C GLN A 39 17.931 -2.438 -0.570 1.00 0.00 C ATOM 615 O GLN A 39 18.341 -1.715 -1.478 1.00 0.00 O ATOM 616 CB GLN A 39 19.584 -3.062 1.246 1.00 0.00 C ATOM 617 CG GLN A 39 20.343 -2.667 2.530 1.00 0.00 C ATOM 618 CD GLN A 39 20.030 -1.269 3.054 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.662 -0.292 2.668 1.00 0.00 O ATOM 620 NE2 GLN A 39 19.045 -1.167 3.939 1.00 0.00 N ATOM 0 H GLN A 39 17.492 -3.030 2.562 1.00 0.00 H new ATOM 0 HA GLN A 39 18.699 -1.137 0.926 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.233 -4.088 1.357 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.289 -3.054 0.415 1.00 0.00 H new ATOM 0 HG2 GLN A 39 20.111 -3.392 3.310 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.414 -2.736 2.338 1.00 0.00 H new ATOM 0 HE21 GLN A 39 18.540 -2.001 4.238 1.00 0.00 H new ATOM 0 HE22 GLN A 39 18.794 -0.255 4.319 1.00 0.00 H new ATOM 629 N LYS A 40 17.095 -3.457 -0.778 1.00 0.00 N ATOM 630 CA LYS A 40 16.573 -3.769 -2.098 1.00 0.00 C ATOM 631 C LYS A 40 15.492 -2.784 -2.526 1.00 0.00 C ATOM 632 O LYS A 40 15.555 -2.247 -3.632 1.00 0.00 O ATOM 633 CB LYS A 40 16.072 -5.220 -2.119 1.00 0.00 C ATOM 634 CG LYS A 40 15.416 -5.687 -3.432 1.00 0.00 C ATOM 635 CD LYS A 40 16.386 -6.219 -4.500 1.00 0.00 C ATOM 636 CE LYS A 40 17.301 -5.174 -5.152 1.00 0.00 C ATOM 637 NZ LYS A 40 16.551 -4.012 -5.665 1.00 0.00 N ATOM 0 H LYS A 40 16.767 -4.080 -0.040 1.00 0.00 H new ATOM 0 HA LYS A 40 17.377 -3.669 -2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.914 -5.878 -1.902 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.352 -5.347 -1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.694 -6.469 -3.199 1.00 0.00 H new ATOM 0 HG3 LYS A 40 14.857 -4.853 -3.856 1.00 0.00 H new ATOM 0 HD2 LYS A 40 17.011 -6.988 -4.045 1.00 0.00 H new ATOM 0 HD3 LYS A 40 15.803 -6.704 -5.284 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.038 -4.835 -4.424 1.00 0.00 H new ATOM 0 HE3 LYS A 40 17.852 -5.637 -5.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.157 -3.465 -6.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 15.709 -4.342 -6.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 16.258 -3.409 -4.870 1.00 0.00 H new ATOM 651 N GLU A 41 14.466 -2.592 -1.702 1.00 0.00 N ATOM 652 CA GLU A 41 13.342 -1.765 -2.095 1.00 0.00 C ATOM 653 C GLU A 41 13.749 -0.294 -2.021 1.00 0.00 C ATOM 654 O GLU A 41 13.822 0.416 -3.019 1.00 0.00 O ATOM 655 CB GLU A 41 12.115 -2.085 -1.225 1.00 0.00 C ATOM 656 CG GLU A 41 11.724 -3.574 -1.266 1.00 0.00 C ATOM 657 CD GLU A 41 11.396 -4.068 -2.672 1.00 0.00 C ATOM 658 OE1 GLU A 41 10.355 -3.627 -3.204 1.00 0.00 O ATOM 659 OE2 GLU A 41 12.185 -4.893 -3.181 1.00 0.00 O ATOM 0 H GLU A 41 14.394 -2.996 -0.768 1.00 0.00 H new ATOM 0 HA GLU A 41 13.058 -1.979 -3.125 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.322 -1.797 -0.194 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.271 -1.483 -1.561 1.00 0.00 H new ATOM 0 HG2 GLU A 41 12.541 -4.170 -0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 41 10.861 -3.735 -0.620 1.00 0.00 H new ATOM 666 N LEU A 42 14.048 0.168 -0.815 1.00 0.00 N ATOM 667 CA LEU A 42 14.336 1.564 -0.537 1.00 0.00 C ATOM 668 C LEU A 42 15.824 1.805 -0.773 1.00 0.00 C ATOM 669 O LEU A 42 16.605 1.942 0.169 1.00 0.00 O ATOM 670 CB LEU A 42 13.895 1.917 0.890 1.00 0.00 C ATOM 671 CG LEU A 42 12.387 1.726 1.138 1.00 0.00 C ATOM 672 CD1 LEU A 42 12.076 2.026 2.608 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.531 2.637 0.246 1.00 0.00 C ATOM 0 H LEU A 42 14.098 -0.429 0.011 1.00 0.00 H new ATOM 0 HA LEU A 42 13.776 2.219 -1.204 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.451 1.300 1.596 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.159 2.954 1.096 1.00 0.00 H new ATOM 0 HG LEU A 42 12.140 0.693 0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.009 1.892 2.789 1.00 0.00 H new ATOM 0 HD12 LEU A 42 12.640 1.345 3.246 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.357 3.054 2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.476 2.466 0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.777 3.679 0.448 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.732 2.413 -0.802 1.00 0.00 H new ATOM 794 N ASP A 50 23.295 4.776 5.978 1.00 0.00 N ATOM 795 CA ASP A 50 23.241 3.518 6.704 1.00 0.00 C ATOM 796 C ASP A 50 22.906 3.713 8.177 1.00 0.00 C ATOM 797 O ASP A 50 22.096 2.973 8.726 1.00 0.00 O ATOM 798 CB ASP A 50 24.557 2.756 6.529 1.00 0.00 C ATOM 799 CG ASP A 50 24.477 1.396 7.212 1.00 0.00 C ATOM 800 OD1 ASP A 50 23.918 0.476 6.578 1.00 0.00 O ATOM 801 OD2 ASP A 50 24.955 1.303 8.363 1.00 0.00 O ATOM 0 HA ASP A 50 22.431 2.924 6.281 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.771 2.626 5.468 1.00 0.00 H new ATOM 0 HB3 ASP A 50 25.379 3.335 6.951 1.00 0.00 H new ATOM 806 N ALA A 51 23.513 4.714 8.818 1.00 0.00 N ATOM 807 CA ALA A 51 23.205 5.035 10.207 1.00 0.00 C ATOM 808 C ALA A 51 21.699 5.254 10.376 1.00 0.00 C ATOM 809 O ALA A 51 21.083 4.731 11.307 1.00 0.00 O ATOM 810 CB ALA A 51 24.001 6.264 10.645 1.00 0.00 C ATOM 0 H ALA A 51 24.220 5.315 8.394 1.00 0.00 H new ATOM 0 HA ALA A 51 23.494 4.200 10.845 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.766 6.498 11.683 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.067 6.059 10.551 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.738 7.112 10.013 1.00 0.00 H new ATOM 816 N GLU A 52 21.102 6.000 9.444 1.00 0.00 N ATOM 817 CA GLU A 52 19.674 6.258 9.453 1.00 0.00 C ATOM 818 C GLU A 52 18.922 4.940 9.304 1.00 0.00 C ATOM 819 O GLU A 52 17.993 4.682 10.070 1.00 0.00 O ATOM 820 CB GLU A 52 19.269 7.273 8.373 1.00 0.00 C ATOM 821 CG GLU A 52 20.040 8.599 8.476 1.00 0.00 C ATOM 822 CD GLU A 52 21.267 8.644 7.565 1.00 0.00 C ATOM 823 OE1 GLU A 52 22.235 7.911 7.864 1.00 0.00 O ATOM 824 OE2 GLU A 52 21.206 9.400 6.572 1.00 0.00 O ATOM 0 H GLU A 52 21.599 6.437 8.668 1.00 0.00 H new ATOM 0 HA GLU A 52 19.405 6.710 10.408 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.439 6.836 7.389 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.200 7.473 8.453 1.00 0.00 H new ATOM 0 HG2 GLU A 52 19.373 9.422 8.220 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.354 8.752 9.508 1.00 0.00 H new ATOM 831 N ILE A 53 19.343 4.091 8.355 1.00 0.00 N ATOM 832 CA ILE A 53 18.764 2.759 8.247 1.00 0.00 C ATOM 833 C ILE A 53 18.807 2.046 9.589 1.00 0.00 C ATOM 834 O ILE A 53 17.775 1.538 10.004 1.00 0.00 O ATOM 835 CB ILE A 53 19.405 1.878 7.159 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.302 2.483 5.757 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.762 0.483 7.151 1.00 0.00 C ATOM 838 CD1 ILE A 53 17.907 3.006 5.397 1.00 0.00 C ATOM 0 H ILE A 53 20.067 4.303 7.668 1.00 0.00 H new ATOM 0 HA ILE A 53 17.730 2.914 7.940 1.00 0.00 H new ATOM 0 HB ILE A 53 20.463 1.808 7.411 1.00 0.00 H new ATOM 0 HG12 ILE A 53 20.017 3.302 5.674 1.00 0.00 H new ATOM 0 HG13 ILE A 53 19.594 1.729 5.026 1.00 0.00 H new ATOM 0 HG21 ILE A 53 19.226 -0.127 6.376 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.908 0.010 8.122 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.695 0.575 6.949 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.922 3.418 4.388 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.188 2.188 5.445 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.617 3.785 6.102 1.00 0.00 H new ATOM 850 N VAL A 54 19.956 1.954 10.266 1.00 0.00 N ATOM 851 CA VAL A 54 19.993 1.148 11.483 1.00 0.00 C ATOM 852 C VAL A 54 19.213 1.786 12.637 1.00 0.00 C ATOM 853 O VAL A 54 18.597 1.066 13.422 1.00 0.00 O ATOM 854 CB VAL A 54 21.385 0.625 11.864 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.812 -0.458 10.861 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.446 1.720 11.973 1.00 0.00 C ATOM 0 H VAL A 54 20.833 2.405 10.006 1.00 0.00 H new ATOM 0 HA VAL A 54 19.451 0.234 11.239 1.00 0.00 H new ATOM 0 HB VAL A 54 21.306 0.200 12.865 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.800 -0.832 11.128 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.095 -1.279 10.884 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.844 -0.033 9.858 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.403 1.274 12.245 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.543 2.229 11.014 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.150 2.439 12.737 1.00 0.00 H new ATOM 866 N LYS A 55 19.161 3.117 12.731 1.00 0.00 N ATOM 867 CA LYS A 55 18.237 3.748 13.671 1.00 0.00 C ATOM 868 C LYS A 55 16.809 3.276 13.364 1.00 0.00 C ATOM 869 O LYS A 55 16.085 2.799 14.239 1.00 0.00 O ATOM 870 CB LYS A 55 18.377 5.276 13.597 1.00 0.00 C ATOM 871 CG LYS A 55 17.375 6.034 14.485 1.00 0.00 C ATOM 872 CD LYS A 55 17.460 5.608 15.959 1.00 0.00 C ATOM 873 CE LYS A 55 16.646 6.540 16.864 1.00 0.00 C ATOM 874 NZ LYS A 55 15.209 6.508 16.538 1.00 0.00 N ATOM 0 H LYS A 55 19.731 3.762 12.184 1.00 0.00 H new ATOM 0 HA LYS A 55 18.474 3.455 14.694 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.390 5.553 13.889 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.245 5.594 12.563 1.00 0.00 H new ATOM 0 HG2 LYS A 55 17.563 7.105 14.408 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.364 5.860 14.117 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.094 4.587 16.065 1.00 0.00 H new ATOM 0 HD3 LYS A 55 18.502 5.608 16.279 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.788 6.250 17.905 1.00 0.00 H new ATOM 0 HE3 LYS A 55 17.018 7.560 16.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 14.686 7.099 17.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 15.063 6.873 15.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 14.862 5.529 16.593 1.00 0.00 H new ATOM 888 N LEU A 56 16.416 3.375 12.096 1.00 0.00 N ATOM 889 CA LEU A 56 15.113 2.941 11.626 1.00 0.00 C ATOM 890 C LEU A 56 14.884 1.437 11.863 1.00 0.00 C ATOM 891 O LEU A 56 13.790 1.044 12.263 1.00 0.00 O ATOM 892 CB LEU A 56 14.961 3.410 10.172 1.00 0.00 C ATOM 893 CG LEU A 56 13.803 2.763 9.406 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.202 3.765 8.413 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.329 1.566 8.614 1.00 0.00 C ATOM 0 H LEU A 56 17.005 3.765 11.360 1.00 0.00 H new ATOM 0 HA LEU A 56 14.312 3.400 12.205 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.823 4.491 10.166 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.890 3.205 9.640 1.00 0.00 H new ATOM 0 HG LEU A 56 13.043 2.449 10.121 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.380 3.294 7.874 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.830 4.635 8.954 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.968 4.079 7.704 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.508 1.102 8.067 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.090 1.902 7.910 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.764 0.839 9.300 1.00 0.00 H new ATOM 907 N MET A 57 15.888 0.582 11.645 1.00 0.00 N ATOM 908 CA MET A 57 15.744 -0.859 11.815 1.00 0.00 C ATOM 909 C MET A 57 15.585 -1.177 13.296 1.00 0.00 C ATOM 910 O MET A 57 14.795 -2.052 13.644 1.00 0.00 O ATOM 911 CB MET A 57 16.851 -1.662 11.103 1.00 0.00 C ATOM 912 CG MET A 57 18.113 -1.957 11.923 1.00 0.00 C ATOM 913 SD MET A 57 18.022 -3.311 13.115 1.00 0.00 S ATOM 914 CE MET A 57 19.638 -3.143 13.902 1.00 0.00 C ATOM 0 H MET A 57 16.819 0.873 11.347 1.00 0.00 H new ATOM 0 HA MET A 57 14.835 -1.189 11.312 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.427 -2.611 10.774 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.146 -1.117 10.206 1.00 0.00 H new ATOM 0 HG2 MET A 57 18.925 -2.172 11.228 1.00 0.00 H new ATOM 0 HG3 MET A 57 18.386 -1.050 12.462 1.00 0.00 H new ATOM 0 HE1 MET A 57 19.750 -3.908 14.670 1.00 0.00 H new ATOM 0 HE2 MET A 57 20.421 -3.263 13.154 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.720 -2.156 14.358 1.00 0.00 H new ATOM 924 N ASP A 58 16.289 -0.440 14.166 1.00 0.00 N ATOM 925 CA ASP A 58 16.030 -0.517 15.593 1.00 0.00 C ATOM 926 C ASP A 58 14.569 -0.156 15.836 1.00 0.00 C ATOM 927 O ASP A 58 13.839 -0.938 16.431 1.00 0.00 O ATOM 928 CB ASP A 58 16.975 0.383 16.399 1.00 0.00 C ATOM 929 CG ASP A 58 16.699 0.257 17.897 1.00 0.00 C ATOM 930 OD1 ASP A 58 15.717 0.880 18.360 1.00 0.00 O ATOM 931 OD2 ASP A 58 17.482 -0.457 18.561 1.00 0.00 O ATOM 0 H ASP A 58 17.032 0.207 13.902 1.00 0.00 H new ATOM 0 HA ASP A 58 16.220 -1.533 15.938 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.010 0.110 16.191 1.00 0.00 H new ATOM 0 HB3 ASP A 58 16.850 1.420 16.088 1.00 0.00 H new ATOM 936 N ASP A 59 14.121 1.007 15.353 1.00 0.00 N ATOM 937 CA ASP A 59 12.748 1.458 15.568 1.00 0.00 C ATOM 938 C ASP A 59 11.732 0.389 15.147 1.00 0.00 C ATOM 939 O ASP A 59 10.808 0.092 15.901 1.00 0.00 O ATOM 940 CB ASP A 59 12.471 2.788 14.853 1.00 0.00 C ATOM 941 CG ASP A 59 13.391 3.928 15.284 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.788 3.943 16.470 1.00 0.00 O ATOM 943 OD2 ASP A 59 13.668 4.788 14.419 1.00 0.00 O ATOM 0 H ASP A 59 14.693 1.653 14.809 1.00 0.00 H new ATOM 0 HA ASP A 59 12.631 1.626 16.639 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.573 2.639 13.778 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.437 3.080 15.038 1.00 0.00 H new ATOM 948 N LEU A 60 11.911 -0.204 13.963 1.00 0.00 N ATOM 949 CA LEU A 60 11.127 -1.353 13.522 1.00 0.00 C ATOM 950 C LEU A 60 11.234 -2.489 14.554 1.00 0.00 C ATOM 951 O LEU A 60 10.244 -2.850 15.194 1.00 0.00 O ATOM 952 CB LEU A 60 11.581 -1.797 12.114 1.00 0.00 C ATOM 953 CG LEU A 60 10.883 -1.008 10.990 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.728 -0.886 9.720 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.597 -1.713 10.546 1.00 0.00 C ATOM 0 H LEU A 60 12.607 0.103 13.284 1.00 0.00 H new ATOM 0 HA LEU A 60 10.076 -1.075 13.450 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.660 -1.669 12.027 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.375 -2.860 11.988 1.00 0.00 H new ATOM 0 HG LEU A 60 10.700 -0.023 11.420 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.177 -0.319 8.969 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.660 -0.371 9.951 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.949 -1.881 9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.122 -1.137 9.752 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.837 -2.710 10.177 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.915 -1.794 11.393 1.00 0.00 H new ATOM 967 N ASP A 61 12.427 -3.070 14.725 1.00 0.00 N ATOM 968 CA ASP A 61 12.619 -4.271 15.537 1.00 0.00 C ATOM 969 C ASP A 61 12.205 -4.096 17.000 1.00 0.00 C ATOM 970 O ASP A 61 11.853 -5.082 17.646 1.00 0.00 O ATOM 971 CB ASP A 61 14.011 -4.895 15.347 1.00 0.00 C ATOM 972 CG ASP A 61 15.185 -4.219 16.059 1.00 0.00 C ATOM 973 OD1 ASP A 61 14.953 -3.473 17.032 1.00 0.00 O ATOM 974 OD2 ASP A 61 16.324 -4.500 15.626 1.00 0.00 O ATOM 0 H ASP A 61 13.286 -2.718 14.302 1.00 0.00 H new ATOM 0 HA ASP A 61 11.917 -5.010 15.151 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.965 -5.931 15.682 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.229 -4.914 14.279 1.00 0.00 H new ATOM 979 N ARG A 62 12.172 -2.853 17.492 1.00 0.00 N ATOM 980 CA ARG A 62 11.724 -2.488 18.829 1.00 0.00 C ATOM 981 C ARG A 62 10.336 -3.056 19.130 1.00 0.00 C ATOM 982 O ARG A 62 10.032 -3.345 20.285 1.00 0.00 O ATOM 983 CB ARG A 62 11.740 -0.957 18.974 1.00 0.00 C ATOM 984 CG ARG A 62 11.975 -0.515 20.420 1.00 0.00 C ATOM 985 CD ARG A 62 12.066 1.014 20.485 1.00 0.00 C ATOM 986 NE ARG A 62 12.638 1.457 21.763 1.00 0.00 N ATOM 987 CZ ARG A 62 13.949 1.509 22.047 1.00 0.00 C ATOM 988 NH1 ARG A 62 14.870 1.171 21.135 1.00 0.00 N ATOM 989 NH2 ARG A 62 14.336 1.903 23.264 1.00 0.00 N ATOM 0 H ARG A 62 12.470 -2.046 16.944 1.00 0.00 H new ATOM 0 HA ARG A 62 12.409 -2.922 19.557 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.521 -0.542 18.338 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.792 -0.551 18.621 1.00 0.00 H new ATOM 0 HG2 ARG A 62 11.162 -0.868 21.055 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.894 -0.960 20.802 1.00 0.00 H new ATOM 0 HD2 ARG A 62 12.680 1.380 19.662 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.073 1.446 20.358 1.00 0.00 H new ATOM 0 HE ARG A 62 11.988 1.748 22.493 1.00 0.00 H new ATOM 0 HH11 ARG A 62 14.580 0.867 20.205 1.00 0.00 H new ATOM 0 HH12 ARG A 62 15.861 1.217 21.370 1.00 0.00 H new ATOM 0 HH21 ARG A 62 13.639 2.159 23.963 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.329 1.947 23.494 1.00 0.00 H new ATOM 1003 N ASN A 63 9.502 -3.244 18.097 1.00 0.00 N ATOM 1004 CA ASN A 63 8.212 -3.925 18.228 1.00 0.00 C ATOM 1005 C ASN A 63 8.306 -5.267 18.974 1.00 0.00 C ATOM 1006 O ASN A 63 7.333 -5.674 19.601 1.00 0.00 O ATOM 1007 CB ASN A 63 7.526 -4.108 16.863 1.00 0.00 C ATOM 1008 CG ASN A 63 8.045 -5.335 16.113 1.00 0.00 C ATOM 1009 OD1 ASN A 63 7.318 -6.275 15.798 1.00 0.00 O ATOM 1010 ND2 ASN A 63 9.338 -5.336 15.841 1.00 0.00 N ATOM 0 H ASN A 63 9.705 -2.927 17.149 1.00 0.00 H new ATOM 0 HA ASN A 63 7.594 -3.269 18.841 1.00 0.00 H new ATOM 0 HB2 ASN A 63 6.450 -4.203 17.009 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.688 -3.218 16.255 1.00 0.00 H new ATOM 0 HD21 ASN A 63 9.757 -6.131 15.358 1.00 0.00 H new ATOM 0 HD22 ASN A 63 9.917 -4.542 16.114 1.00 0.00 H new ATOM 1017 N LYS A 64 9.449 -5.961 18.887 1.00 0.00 N ATOM 1018 CA LYS A 64 9.729 -7.184 19.633 1.00 0.00 C ATOM 1019 C LYS A 64 11.068 -7.070 20.362 1.00 0.00 C ATOM 1020 O LYS A 64 11.109 -7.119 21.588 1.00 0.00 O ATOM 1021 CB LYS A 64 9.714 -8.402 18.699 1.00 0.00 C ATOM 1022 CG LYS A 64 8.297 -8.705 18.190 1.00 0.00 C ATOM 1023 CD LYS A 64 8.280 -9.812 17.126 1.00 0.00 C ATOM 1024 CE LYS A 64 8.818 -11.162 17.621 1.00 0.00 C ATOM 1025 NZ LYS A 64 8.063 -11.663 18.783 1.00 0.00 N ATOM 0 H LYS A 64 10.219 -5.677 18.281 1.00 0.00 H new ATOM 0 HA LYS A 64 8.946 -7.322 20.379 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.375 -8.220 17.851 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.105 -9.271 19.227 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.668 -9.002 19.029 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.862 -7.797 17.772 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.258 -9.947 16.773 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.872 -9.488 16.270 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.766 -11.892 16.813 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.869 -11.057 17.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 8.390 -12.621 19.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 8.216 -11.031 19.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 7.049 -11.691 18.552 1.00 0.00 H new ATOM 1039 N ASP A 65 12.152 -6.939 19.591 1.00 0.00 N ATOM 1040 CA ASP A 65 13.540 -6.796 20.026 1.00 0.00 C ATOM 1041 C ASP A 65 14.469 -6.839 18.811 1.00 0.00 C ATOM 1042 O ASP A 65 15.309 -5.965 18.631 1.00 0.00 O ATOM 1043 CB ASP A 65 13.988 -7.841 21.077 1.00 0.00 C ATOM 1044 CG ASP A 65 14.089 -9.276 20.554 1.00 0.00 C ATOM 1045 OD1 ASP A 65 13.162 -9.692 19.823 1.00 0.00 O ATOM 1046 OD2 ASP A 65 15.122 -9.917 20.848 1.00 0.00 O ATOM 0 H ASP A 65 12.074 -6.930 18.574 1.00 0.00 H new ATOM 0 HA ASP A 65 13.604 -5.829 20.525 1.00 0.00 H new ATOM 0 HB2 ASP A 65 14.959 -7.544 21.472 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.285 -7.822 21.910 1.00 0.00 H new ATOM 1051 N GLN A 66 14.344 -7.900 18.011 1.00 0.00 N ATOM 1052 CA GLN A 66 15.270 -8.257 16.936 1.00 0.00 C ATOM 1053 C GLN A 66 14.530 -8.841 15.726 1.00 0.00 C ATOM 1054 O GLN A 66 15.156 -9.310 14.773 1.00 0.00 O ATOM 1055 CB GLN A 66 16.280 -9.276 17.486 1.00 0.00 C ATOM 1056 CG GLN A 66 17.244 -8.647 18.499 1.00 0.00 C ATOM 1057 CD GLN A 66 18.207 -9.691 19.043 1.00 0.00 C ATOM 1058 OE1 GLN A 66 19.344 -9.785 18.592 1.00 0.00 O ATOM 1059 NE2 GLN A 66 17.755 -10.487 20.006 1.00 0.00 N ATOM 0 H GLN A 66 13.568 -8.556 18.097 1.00 0.00 H new ATOM 0 HA GLN A 66 15.784 -7.359 16.595 1.00 0.00 H new ATOM 0 HB2 GLN A 66 15.743 -10.098 17.960 1.00 0.00 H new ATOM 0 HB3 GLN A 66 16.850 -9.702 16.660 1.00 0.00 H new ATOM 0 HG2 GLN A 66 17.804 -7.841 18.024 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.679 -8.203 19.319 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.803 -10.376 20.354 1.00 0.00 H new ATOM 0 HE22 GLN A 66 18.360 -11.209 20.397 1.00 0.00 H new ATOM 1068 N GLU A 67 13.197 -8.818 15.752 1.00 0.00 N ATOM 1069 CA GLU A 67 12.355 -9.305 14.680 1.00 0.00 C ATOM 1070 C GLU A 67 11.249 -8.283 14.476 1.00 0.00 C ATOM 1071 O GLU A 67 10.921 -7.556 15.410 1.00 0.00 O ATOM 1072 CB GLU A 67 11.759 -10.668 15.050 1.00 0.00 C ATOM 1073 CG GLU A 67 12.829 -11.732 15.326 1.00 0.00 C ATOM 1074 CD GLU A 67 12.201 -13.108 15.526 1.00 0.00 C ATOM 1075 OE1 GLU A 67 11.210 -13.176 16.287 1.00 0.00 O ATOM 1076 OE2 GLU A 67 12.720 -14.065 14.912 1.00 0.00 O ATOM 0 H GLU A 67 12.668 -8.449 16.543 1.00 0.00 H new ATOM 0 HA GLU A 67 12.933 -9.434 13.765 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.129 -10.556 15.932 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.115 -11.009 14.240 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.533 -11.768 14.494 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.399 -11.457 16.214 1.00 0.00 H new ATOM 1083 N VAL A 68 10.686 -8.230 13.272 1.00 0.00 N ATOM 1084 CA VAL A 68 9.590 -7.347 12.911 1.00 0.00 C ATOM 1085 C VAL A 68 8.398 -8.211 12.524 1.00 0.00 C ATOM 1086 O VAL A 68 8.468 -8.919 11.521 1.00 0.00 O ATOM 1087 CB VAL A 68 10.001 -6.414 11.762 1.00 0.00 C ATOM 1088 CG1 VAL A 68 8.962 -5.296 11.631 1.00 0.00 C ATOM 1089 CG2 VAL A 68 11.383 -5.789 11.986 1.00 0.00 C ATOM 0 H VAL A 68 10.993 -8.821 12.499 1.00 0.00 H new ATOM 0 HA VAL A 68 9.323 -6.711 13.755 1.00 0.00 H new ATOM 0 HB VAL A 68 10.051 -7.011 10.851 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.246 -4.629 10.817 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.985 -5.730 11.420 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.915 -4.732 12.563 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.628 -5.138 11.147 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.374 -5.206 12.907 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.131 -6.578 12.064 1.00 0.00 H new ATOM 1099 N ASN A 69 7.309 -8.168 13.295 1.00 0.00 N ATOM 1100 CA ASN A 69 6.109 -8.901 12.907 1.00 0.00 C ATOM 1101 C ASN A 69 5.360 -8.121 11.828 1.00 0.00 C ATOM 1102 O ASN A 69 5.369 -6.892 11.851 1.00 0.00 O ATOM 1103 CB ASN A 69 5.198 -9.137 14.109 1.00 0.00 C ATOM 1104 CG ASN A 69 3.948 -9.889 13.658 1.00 0.00 C ATOM 1105 OD1 ASN A 69 2.940 -9.286 13.289 1.00 0.00 O ATOM 1106 ND2 ASN A 69 4.033 -11.214 13.613 1.00 0.00 N ATOM 0 H ASN A 69 7.235 -7.647 14.169 1.00 0.00 H new ATOM 0 HA ASN A 69 6.408 -9.873 12.514 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.725 -9.710 14.872 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.920 -8.185 14.561 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.248 -11.764 13.265 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.884 -11.681 13.927 1.00 0.00 H new ATOM 1113 N PHE A 70 4.701 -8.824 10.902 1.00 0.00 N ATOM 1114 CA PHE A 70 3.947 -8.224 9.805 1.00 0.00 C ATOM 1115 C PHE A 70 3.111 -7.002 10.216 1.00 0.00 C ATOM 1116 O PHE A 70 3.246 -5.923 9.634 1.00 0.00 O ATOM 1117 CB PHE A 70 3.068 -9.297 9.154 1.00 0.00 C ATOM 1118 CG PHE A 70 2.129 -8.718 8.121 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.661 -8.201 6.926 1.00 0.00 C ATOM 1120 CD2 PHE A 70 0.807 -8.411 8.488 1.00 0.00 C ATOM 1121 CE1 PHE A 70 1.863 -7.412 6.084 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.007 -7.626 7.645 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.531 -7.137 6.437 1.00 0.00 C ATOM 0 H PHE A 70 4.678 -9.844 10.897 1.00 0.00 H new ATOM 0 HA PHE A 70 4.673 -7.842 9.088 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.703 -10.048 8.684 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.489 -9.806 9.924 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.685 -8.412 6.656 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.407 -8.780 9.421 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.272 -7.017 5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.011 -7.398 7.924 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.091 -6.549 5.778 1.00 0.00 H new ATOM 1133 N GLN A 71 2.229 -7.158 11.208 1.00 0.00 N ATOM 1134 CA GLN A 71 1.322 -6.076 11.572 1.00 0.00 C ATOM 1135 C GLN A 71 2.131 -4.853 12.014 1.00 0.00 C ATOM 1136 O GLN A 71 1.830 -3.716 11.648 1.00 0.00 O ATOM 1137 CB GLN A 71 0.367 -6.556 12.670 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.668 -5.485 13.042 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.547 -5.953 14.194 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.706 -6.304 14.001 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -1.002 -5.962 15.407 1.00 0.00 N ATOM 0 H GLN A 71 2.127 -8.008 11.762 1.00 0.00 H new ATOM 0 HA GLN A 71 0.721 -5.783 10.711 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.148 -7.456 12.334 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.941 -6.828 13.556 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.158 -4.563 13.320 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.289 -5.257 12.175 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.035 -5.664 15.534 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.551 -6.267 16.211 1.00 0.00 H new ATOM 1150 N GLU A 72 3.173 -5.100 12.803 1.00 0.00 N ATOM 1151 CA GLU A 72 4.019 -4.065 13.367 1.00 0.00 C ATOM 1152 C GLU A 72 4.856 -3.409 12.262 1.00 0.00 C ATOM 1153 O GLU A 72 5.075 -2.199 12.290 1.00 0.00 O ATOM 1154 CB GLU A 72 4.860 -4.659 14.500 1.00 0.00 C ATOM 1155 CG GLU A 72 4.035 -4.878 15.784 1.00 0.00 C ATOM 1156 CD GLU A 72 2.771 -5.712 15.588 1.00 0.00 C ATOM 1157 OE1 GLU A 72 2.927 -6.923 15.331 1.00 0.00 O ATOM 1158 OE2 GLU A 72 1.669 -5.126 15.677 1.00 0.00 O ATOM 0 H GLU A 72 3.454 -6.043 13.070 1.00 0.00 H new ATOM 0 HA GLU A 72 3.414 -3.270 13.803 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.284 -5.609 14.176 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.696 -3.994 14.716 1.00 0.00 H new ATOM 0 HG2 GLU A 72 4.666 -5.366 16.527 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.755 -3.907 16.191 1.00 0.00 H new ATOM 1165 N TYR A 73 5.284 -4.182 11.261 1.00 0.00 N ATOM 1166 CA TYR A 73 5.893 -3.652 10.048 1.00 0.00 C ATOM 1167 C TYR A 73 4.951 -2.631 9.402 1.00 0.00 C ATOM 1168 O TYR A 73 5.362 -1.497 9.168 1.00 0.00 O ATOM 1169 CB TYR A 73 6.297 -4.802 9.111 1.00 0.00 C ATOM 1170 CG TYR A 73 6.272 -4.519 7.620 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.441 -4.093 6.961 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.156 -4.922 6.864 1.00 0.00 C ATOM 1173 CE1 TYR A 73 7.503 -4.117 5.555 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.198 -4.885 5.460 1.00 0.00 C ATOM 1175 CZ TYR A 73 6.378 -4.499 4.805 1.00 0.00 C ATOM 1176 OH TYR A 73 6.469 -4.602 3.448 1.00 0.00 O ATOM 0 H TYR A 73 5.215 -5.200 11.274 1.00 0.00 H new ATOM 0 HA TYR A 73 6.814 -3.119 10.286 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.305 -5.118 9.379 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.636 -5.646 9.306 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.289 -3.748 7.534 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.262 -5.262 7.366 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.418 -3.841 5.051 1.00 0.00 H new ATOM 0 HE2 TYR A 73 4.324 -5.153 4.886 1.00 0.00 H new ATOM 0 HH TYR A 73 5.775 -5.210 3.119 1.00 0.00 H new ATOM 1186 N ILE A 74 3.689 -2.990 9.142 1.00 0.00 N ATOM 1187 CA ILE A 74 2.761 -2.030 8.544 1.00 0.00 C ATOM 1188 C ILE A 74 2.527 -0.829 9.467 1.00 0.00 C ATOM 1189 O ILE A 74 2.544 0.312 9.006 1.00 0.00 O ATOM 1190 CB ILE A 74 1.465 -2.703 8.053 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.848 -3.713 6.949 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.473 -1.633 7.563 1.00 0.00 C ATOM 1193 CD1 ILE A 74 0.833 -3.873 5.818 1.00 0.00 C ATOM 0 H ILE A 74 3.296 -3.912 9.331 1.00 0.00 H new ATOM 0 HA ILE A 74 3.228 -1.628 7.645 1.00 0.00 H new ATOM 0 HB ILE A 74 0.964 -3.241 8.858 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.801 -3.407 6.517 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.006 -4.687 7.412 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.441 -2.116 7.217 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.237 -0.953 8.382 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.920 -1.071 6.742 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.202 -4.605 5.099 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.118 -4.214 6.228 1.00 0.00 H new ATOM 0 HD13 ILE A 74 0.690 -2.914 5.319 1.00 0.00 H new ATOM 1205 N THR A 75 2.348 -1.067 10.769 1.00 0.00 N ATOM 1206 CA THR A 75 2.250 0.007 11.756 1.00 0.00 C ATOM 1207 C THR A 75 3.412 0.991 11.566 1.00 0.00 C ATOM 1208 O THR A 75 3.212 2.198 11.419 1.00 0.00 O ATOM 1209 CB THR A 75 2.234 -0.582 13.176 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.224 -1.564 13.288 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.986 0.489 14.242 1.00 0.00 C ATOM 0 H THR A 75 2.268 -2.004 11.165 1.00 0.00 H new ATOM 0 HA THR A 75 1.317 0.553 11.613 1.00 0.00 H new ATOM 0 HB THR A 75 3.217 -1.022 13.344 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.513 -2.384 12.836 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.983 0.026 15.229 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.776 1.239 14.195 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.022 0.965 14.062 1.00 0.00 H new ATOM 1219 N PHE A 76 4.638 0.462 11.521 1.00 0.00 N ATOM 1220 CA PHE A 76 5.815 1.275 11.287 1.00 0.00 C ATOM 1221 C PHE A 76 5.747 1.965 9.927 1.00 0.00 C ATOM 1222 O PHE A 76 6.060 3.143 9.846 1.00 0.00 O ATOM 1223 CB PHE A 76 7.099 0.458 11.417 1.00 0.00 C ATOM 1224 CG PHE A 76 8.330 1.326 11.238 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.858 1.540 9.949 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.830 2.068 12.326 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.915 2.442 9.761 1.00 0.00 C ATOM 1228 CE2 PHE A 76 9.847 3.017 12.123 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.385 3.209 10.839 1.00 0.00 C ATOM 0 H PHE A 76 4.832 -0.532 11.645 1.00 0.00 H new ATOM 0 HA PHE A 76 5.834 2.045 12.058 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.129 -0.021 12.396 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.102 -0.338 10.672 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.447 1.008 9.104 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.432 1.908 13.317 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.368 2.547 8.786 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.215 3.599 12.955 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.159 3.946 10.682 1.00 0.00 H new ATOM 1239 N LEU A 77 5.339 1.282 8.854 1.00 0.00 N ATOM 1240 CA LEU A 77 5.168 1.942 7.561 1.00 0.00 C ATOM 1241 C LEU A 77 4.201 3.130 7.677 1.00 0.00 C ATOM 1242 O LEU A 77 4.397 4.144 7.012 1.00 0.00 O ATOM 1243 CB LEU A 77 4.785 0.949 6.451 1.00 0.00 C ATOM 1244 CG LEU A 77 5.940 -0.008 6.094 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.481 -1.141 5.177 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.080 0.706 5.357 1.00 0.00 C ATOM 0 H LEU A 77 5.124 0.285 8.855 1.00 0.00 H new ATOM 0 HA LEU A 77 6.132 2.352 7.259 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.920 0.367 6.770 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.486 1.502 5.560 1.00 0.00 H new ATOM 0 HG LEU A 77 6.285 -0.397 7.052 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.326 -1.791 4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.702 -1.719 5.674 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.087 -0.723 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.869 -0.010 5.127 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.701 1.137 4.431 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.481 1.499 5.989 1.00 0.00 H new ATOM 1258 N GLY A 78 3.204 3.056 8.563 1.00 0.00 N ATOM 1259 CA GLY A 78 2.383 4.210 8.910 1.00 0.00 C ATOM 1260 C GLY A 78 3.231 5.351 9.479 1.00 0.00 C ATOM 1261 O GLY A 78 3.112 6.501 9.051 1.00 0.00 O ATOM 0 H GLY A 78 2.948 2.200 9.054 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.850 4.558 8.025 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.630 3.916 9.641 1.00 0.00 H new ATOM 1265 N ALA A 79 4.109 5.045 10.435 1.00 0.00 N ATOM 1266 CA ALA A 79 5.066 6.024 10.938 1.00 0.00 C ATOM 1267 C ALA A 79 5.960 6.550 9.807 1.00 0.00 C ATOM 1268 O ALA A 79 6.218 7.745 9.731 1.00 0.00 O ATOM 1269 CB ALA A 79 5.885 5.447 12.097 1.00 0.00 C ATOM 0 H ALA A 79 4.175 4.127 10.875 1.00 0.00 H new ATOM 0 HA ALA A 79 4.510 6.875 11.331 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.591 6.198 12.453 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.216 5.164 12.910 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.432 4.569 11.754 1.00 0.00 H new ATOM 1275 N LEU A 80 6.412 5.680 8.904 1.00 0.00 N ATOM 1276 CA LEU A 80 7.251 6.059 7.778 1.00 0.00 C ATOM 1277 C LEU A 80 6.505 7.049 6.880 1.00 0.00 C ATOM 1278 O LEU A 80 7.063 8.066 6.479 1.00 0.00 O ATOM 1279 CB LEU A 80 7.710 4.810 7.011 1.00 0.00 C ATOM 1280 CG LEU A 80 8.959 5.054 6.150 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.201 5.317 7.011 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.232 3.810 5.298 1.00 0.00 C ATOM 0 H LEU A 80 6.201 4.683 8.938 1.00 0.00 H new ATOM 0 HA LEU A 80 8.148 6.559 8.143 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.917 4.010 7.722 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.897 4.465 6.372 1.00 0.00 H new ATOM 0 HG LEU A 80 8.767 5.930 5.530 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.063 5.485 6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.035 6.199 7.630 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.389 4.455 7.651 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.117 3.976 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.398 2.952 5.950 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.375 3.615 4.653 1.00 0.00 H new ATOM 1294 N ALA A 81 5.228 6.782 6.600 1.00 0.00 N ATOM 1295 CA ALA A 81 4.354 7.707 5.896 1.00 0.00 C ATOM 1296 C ALA A 81 4.286 9.050 6.639 1.00 0.00 C ATOM 1297 O ALA A 81 4.417 10.114 6.034 1.00 0.00 O ATOM 1298 CB ALA A 81 2.975 7.071 5.722 1.00 0.00 C ATOM 0 H ALA A 81 4.772 5.907 6.860 1.00 0.00 H new ATOM 0 HA ALA A 81 4.755 7.914 4.904 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.319 7.763 5.194 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.069 6.150 5.146 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.552 6.845 6.701 1.00 0.00 H new ATOM 1304 N MET A 82 4.111 9.011 7.964 1.00 0.00 N ATOM 1305 CA MET A 82 4.126 10.218 8.783 1.00 0.00 C ATOM 1306 C MET A 82 5.468 10.960 8.698 1.00 0.00 C ATOM 1307 O MET A 82 5.480 12.191 8.706 1.00 0.00 O ATOM 1308 CB MET A 82 3.711 9.879 10.222 1.00 0.00 C ATOM 1309 CG MET A 82 3.449 11.138 11.055 1.00 0.00 C ATOM 1310 SD MET A 82 2.801 10.803 12.711 1.00 0.00 S ATOM 1311 CE MET A 82 2.652 12.490 13.335 1.00 0.00 C ATOM 0 H MET A 82 3.957 8.151 8.490 1.00 0.00 H new ATOM 0 HA MET A 82 3.391 10.918 8.386 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.812 9.262 10.205 1.00 0.00 H new ATOM 0 HB3 MET A 82 4.494 9.287 10.696 1.00 0.00 H new ATOM 0 HG2 MET A 82 4.378 11.701 11.147 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.743 11.774 10.521 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.263 12.468 14.353 1.00 0.00 H new ATOM 0 HE2 MET A 82 3.632 12.967 13.331 1.00 0.00 H new ATOM 0 HE3 MET A 82 1.971 13.055 12.698 1.00 0.00 H new ATOM 1321 N ILE A 83 6.584 10.231 8.610 1.00 0.00 N ATOM 1322 CA ILE A 83 7.921 10.797 8.455 1.00 0.00 C ATOM 1323 C ILE A 83 8.085 11.414 7.059 1.00 0.00 C ATOM 1324 O ILE A 83 8.632 12.508 6.950 1.00 0.00 O ATOM 1325 CB ILE A 83 8.996 9.742 8.789 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.979 9.460 10.305 1.00 0.00 C ATOM 1327 CG2 ILE A 83 10.398 10.209 8.365 1.00 0.00 C ATOM 1328 CD1 ILE A 83 9.704 8.163 10.687 1.00 0.00 C ATOM 0 H ILE A 83 6.580 9.212 8.645 1.00 0.00 H new ATOM 0 HA ILE A 83 8.057 11.610 9.168 1.00 0.00 H new ATOM 0 HB ILE A 83 8.765 8.832 8.234 1.00 0.00 H new ATOM 0 HG12 ILE A 83 9.443 10.296 10.829 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.945 9.405 10.646 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.129 9.440 8.616 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.413 10.386 7.290 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.648 11.132 8.888 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.655 8.024 11.767 1.00 0.00 H new ATOM 0 HD12 ILE A 83 9.226 7.319 10.190 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.747 8.224 10.376 1.00 0.00 H new ATOM 1340 N TYR A 84 7.606 10.747 5.998 1.00 0.00 N ATOM 1341 CA TYR A 84 7.536 11.345 4.664 1.00 0.00 C ATOM 1342 C TYR A 84 6.804 12.683 4.790 1.00 0.00 C ATOM 1343 O TYR A 84 7.291 13.712 4.325 1.00 0.00 O ATOM 1344 CB TYR A 84 6.799 10.437 3.661 1.00 0.00 C ATOM 1345 CG TYR A 84 7.542 9.263 3.039 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.620 8.623 3.686 1.00 0.00 C ATOM 1347 CD2 TYR A 84 7.098 8.775 1.795 1.00 0.00 C ATOM 1348 CE1 TYR A 84 9.256 7.526 3.075 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.744 7.691 1.179 1.00 0.00 C ATOM 1350 CZ TYR A 84 8.821 7.059 1.824 1.00 0.00 C ATOM 1351 OH TYR A 84 9.437 5.991 1.241 1.00 0.00 O ATOM 0 H TYR A 84 7.261 9.788 6.043 1.00 0.00 H new ATOM 0 HA TYR A 84 8.548 11.483 4.282 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.918 10.038 4.165 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.442 11.068 2.847 1.00 0.00 H new ATOM 0 HD1 TYR A 84 8.957 8.975 4.650 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.252 9.239 1.310 1.00 0.00 H new ATOM 0 HE1 TYR A 84 10.083 7.041 3.571 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.414 7.344 0.211 1.00 0.00 H new ATOM 0 HH TYR A 84 9.054 5.838 0.352 1.00 0.00 H new ATOM 1361 N ASN A 85 5.633 12.649 5.433 1.00 0.00 N ATOM 1362 CA ASN A 85 4.858 13.797 5.892 1.00 0.00 C ATOM 1363 C ASN A 85 4.203 14.581 4.760 1.00 0.00 C ATOM 1364 O ASN A 85 2.979 14.691 4.702 1.00 0.00 O ATOM 1365 CB ASN A 85 5.691 14.720 6.788 1.00 0.00 C ATOM 1366 CG ASN A 85 4.763 15.452 7.746 1.00 0.00 C ATOM 1367 OD1 ASN A 85 4.315 16.561 7.476 1.00 0.00 O ATOM 1368 ND2 ASN A 85 4.440 14.809 8.863 1.00 0.00 N ATOM 0 H ASN A 85 5.177 11.765 5.659 1.00 0.00 H new ATOM 0 HA ASN A 85 4.045 13.381 6.487 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.426 14.140 7.346 1.00 0.00 H new ATOM 0 HB3 ASN A 85 6.245 15.435 6.180 1.00 0.00 H new ATOM 0 HD21 ASN A 85 3.799 15.237 9.531 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.833 13.887 9.053 1.00 0.00 H new ATOM 1375 N GLU A 86 5.011 15.100 3.837 1.00 0.00 N ATOM 1376 CA GLU A 86 4.555 15.824 2.662 1.00 0.00 C ATOM 1377 C GLU A 86 3.522 14.991 1.905 1.00 0.00 C ATOM 1378 O GLU A 86 2.508 15.513 1.459 1.00 0.00 O ATOM 1379 CB GLU A 86 5.748 16.187 1.765 1.00 0.00 C ATOM 1380 CG GLU A 86 6.848 16.959 2.509 1.00 0.00 C ATOM 1381 CD GLU A 86 6.306 18.193 3.226 1.00 0.00 C ATOM 1382 OE1 GLU A 86 5.958 19.156 2.509 1.00 0.00 O ATOM 1383 OE2 GLU A 86 6.233 18.143 4.472 1.00 0.00 O ATOM 0 H GLU A 86 6.027 15.024 3.891 1.00 0.00 H new ATOM 0 HA GLU A 86 4.078 16.753 2.974 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.172 15.274 1.347 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.395 16.787 0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.324 16.300 3.235 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.619 17.262 1.800 1.00 0.00 H new ATOM 1390 N ALA A 87 3.762 13.679 1.815 1.00 0.00 N ATOM 1391 CA ALA A 87 2.813 12.726 1.258 1.00 0.00 C ATOM 1392 C ALA A 87 1.436 12.845 1.923 1.00 0.00 C ATOM 1393 O ALA A 87 0.415 12.785 1.244 1.00 0.00 O ATOM 1394 CB ALA A 87 3.372 11.309 1.409 1.00 0.00 C ATOM 0 H ALA A 87 4.632 13.250 2.132 1.00 0.00 H new ATOM 0 HA ALA A 87 2.675 12.950 0.200 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.664 10.592 0.993 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.320 11.233 0.877 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.531 11.091 2.465 1.00 0.00 H new ATOM 1400 N LEU A 88 1.396 13.005 3.251 1.00 0.00 N ATOM 1401 CA LEU A 88 0.141 13.173 3.969 1.00 0.00 C ATOM 1402 C LEU A 88 -0.458 14.539 3.642 1.00 0.00 C ATOM 1403 O LEU A 88 -1.655 14.653 3.397 1.00 0.00 O ATOM 1404 CB LEU A 88 0.321 13.048 5.489 1.00 0.00 C ATOM 1405 CG LEU A 88 1.112 11.840 6.010 1.00 0.00 C ATOM 1406 CD1 LEU A 88 0.811 11.703 7.509 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.765 10.527 5.311 1.00 0.00 C ATOM 0 H LEU A 88 2.225 13.021 3.846 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.529 12.376 3.647 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.814 13.952 5.845 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.669 13.024 5.945 1.00 0.00 H new ATOM 0 HG LEU A 88 2.168 12.022 5.808 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.358 10.852 7.914 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.119 12.612 8.026 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.258 11.548 7.653 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.364 9.720 5.733 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.293 10.307 5.455 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.976 10.616 4.245 1.00 0.00 H new ATOM 1479 N SER B 3 9.862 2.668 -5.933 1.00 0.00 N ATOM 1480 CA SER B 3 8.617 3.114 -6.531 1.00 0.00 C ATOM 1481 C SER B 3 7.451 2.144 -6.296 1.00 0.00 C ATOM 1482 O SER B 3 6.388 2.595 -5.873 1.00 0.00 O ATOM 1483 CB SER B 3 8.845 3.450 -8.013 1.00 0.00 C ATOM 1484 OG SER B 3 10.236 3.625 -8.251 1.00 0.00 O ATOM 0 HA SER B 3 8.305 4.027 -6.025 1.00 0.00 H new ATOM 0 HB2 SER B 3 8.455 2.650 -8.642 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.303 4.357 -8.279 1.00 0.00 H new ATOM 0 HG SER B 3 10.741 3.352 -7.457 1.00 0.00 H new ATOM 1490 N PRO B 4 7.618 0.830 -6.533 1.00 0.00 N ATOM 1491 CA PRO B 4 6.586 -0.160 -6.274 1.00 0.00 C ATOM 1492 C PRO B 4 6.026 -0.117 -4.851 1.00 0.00 C ATOM 1493 O PRO B 4 4.829 -0.327 -4.685 1.00 0.00 O ATOM 1494 CB PRO B 4 7.208 -1.520 -6.602 1.00 0.00 C ATOM 1495 CG PRO B 4 8.234 -1.151 -7.670 1.00 0.00 C ATOM 1496 CD PRO B 4 8.772 0.172 -7.131 1.00 0.00 C ATOM 0 HA PRO B 4 5.716 0.047 -6.897 1.00 0.00 H new ATOM 0 HB2 PRO B 4 7.674 -1.977 -5.729 1.00 0.00 H new ATOM 0 HB3 PRO B 4 6.468 -2.228 -6.975 1.00 0.00 H new ATOM 0 HG2 PRO B 4 9.016 -1.904 -7.765 1.00 0.00 H new ATOM 0 HG3 PRO B 4 7.779 -1.038 -8.654 1.00 0.00 H new ATOM 0 HD2 PRO B 4 9.559 0.008 -6.395 1.00 0.00 H new ATOM 0 HD3 PRO B 4 9.203 0.778 -7.928 1.00 0.00 H new ATOM 1504 N LEU B 5 6.853 0.155 -3.832 1.00 0.00 N ATOM 1505 CA LEU B 5 6.350 0.330 -2.473 1.00 0.00 C ATOM 1506 C LEU B 5 5.785 1.738 -2.308 1.00 0.00 C ATOM 1507 O LEU B 5 4.684 1.904 -1.781 1.00 0.00 O ATOM 1508 CB LEU B 5 7.436 0.042 -1.424 1.00 0.00 C ATOM 1509 CG LEU B 5 6.915 0.255 0.013 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.739 -0.662 0.364 1.00 0.00 C ATOM 1511 CD2 LEU B 5 8.012 -0.005 1.044 1.00 0.00 C ATOM 0 H LEU B 5 7.863 0.257 -3.927 1.00 0.00 H new ATOM 0 HA LEU B 5 5.551 -0.392 -2.308 1.00 0.00 H new ATOM 0 HB2 LEU B 5 7.786 -0.984 -1.535 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.293 0.692 -1.600 1.00 0.00 H new ATOM 0 HG LEU B 5 6.585 1.293 0.044 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.417 -0.465 1.387 1.00 0.00 H new ATOM 0 HD12 LEU B 5 4.912 -0.471 -0.320 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.050 -1.703 0.275 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.614 0.153 2.046 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.363 -1.033 0.951 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.843 0.679 0.871 1.00 0.00 H new ATOM 1523 N ASP B 6 6.540 2.756 -2.738 1.00 0.00 N ATOM 1524 CA ASP B 6 6.143 4.149 -2.561 1.00 0.00 C ATOM 1525 C ASP B 6 4.731 4.386 -3.098 1.00 0.00 C ATOM 1526 O ASP B 6 3.922 5.028 -2.431 1.00 0.00 O ATOM 1527 CB ASP B 6 7.143 5.115 -3.204 1.00 0.00 C ATOM 1528 CG ASP B 6 8.503 5.107 -2.510 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.524 5.331 -1.278 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.500 4.896 -3.230 1.00 0.00 O ATOM 0 H ASP B 6 7.434 2.635 -3.213 1.00 0.00 H new ATOM 0 HA ASP B 6 6.141 4.352 -1.490 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.274 4.850 -4.253 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.733 6.125 -3.179 1.00 0.00 H new ATOM 1535 N GLN B 7 4.412 3.848 -4.279 1.00 0.00 N ATOM 1536 CA GLN B 7 3.067 3.945 -4.832 1.00 0.00 C ATOM 1537 C GLN B 7 2.036 3.300 -3.904 1.00 0.00 C ATOM 1538 O GLN B 7 0.940 3.826 -3.756 1.00 0.00 O ATOM 1539 CB GLN B 7 3.006 3.380 -6.261 1.00 0.00 C ATOM 1540 CG GLN B 7 3.210 1.860 -6.343 1.00 0.00 C ATOM 1541 CD GLN B 7 1.953 1.018 -6.089 1.00 0.00 C ATOM 1542 OE1 GLN B 7 0.828 1.477 -6.269 1.00 0.00 O ATOM 1543 NE2 GLN B 7 2.130 -0.229 -5.668 1.00 0.00 N ATOM 0 H GLN B 7 5.072 3.341 -4.868 1.00 0.00 H new ATOM 0 HA GLN B 7 2.809 5.002 -4.902 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.039 3.630 -6.698 1.00 0.00 H new ATOM 0 HB3 GLN B 7 3.767 3.871 -6.867 1.00 0.00 H new ATOM 0 HG2 GLN B 7 3.599 1.614 -7.331 1.00 0.00 H new ATOM 0 HG3 GLN B 7 3.973 1.572 -5.620 1.00 0.00 H new ATOM 0 HE21 GLN B 7 3.073 -0.590 -5.525 1.00 0.00 H new ATOM 0 HE22 GLN B 7 1.323 -0.826 -5.488 1.00 0.00 H new ATOM 1552 N ALA B 8 2.368 2.167 -3.275 1.00 0.00 N ATOM 1553 CA ALA B 8 1.427 1.443 -2.436 1.00 0.00 C ATOM 1554 C ALA B 8 1.114 2.254 -1.183 1.00 0.00 C ATOM 1555 O ALA B 8 -0.049 2.540 -0.904 1.00 0.00 O ATOM 1556 CB ALA B 8 1.966 0.063 -2.077 1.00 0.00 C ATOM 0 H ALA B 8 3.290 1.735 -3.337 1.00 0.00 H new ATOM 0 HA ALA B 8 0.502 1.298 -2.994 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.243 -0.458 -1.449 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.134 -0.510 -2.989 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.906 0.169 -1.536 1.00 0.00 H new ATOM 1562 N ILE B 9 2.145 2.656 -0.433 1.00 0.00 N ATOM 1563 CA ILE B 9 1.923 3.511 0.730 1.00 0.00 C ATOM 1564 C ILE B 9 1.219 4.803 0.278 1.00 0.00 C ATOM 1565 O ILE B 9 0.225 5.223 0.874 1.00 0.00 O ATOM 1566 CB ILE B 9 3.217 3.709 1.553 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.323 4.448 0.791 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.710 2.344 2.054 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.610 4.613 1.607 1.00 0.00 C ATOM 0 H ILE B 9 3.119 2.409 -0.607 1.00 0.00 H new ATOM 0 HA ILE B 9 1.249 3.027 1.437 1.00 0.00 H new ATOM 0 HB ILE B 9 2.970 4.352 2.398 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.549 3.905 -0.126 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.958 5.432 0.497 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.622 2.478 2.635 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.944 1.888 2.681 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.914 1.696 1.202 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.353 5.144 1.011 1.00 0.00 H new ATOM 0 HD12 ILE B 9 5.397 5.182 2.512 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.997 3.631 1.879 1.00 0.00 H new ATOM 1581 N GLY B 10 1.674 5.372 -0.844 1.00 0.00 N ATOM 1582 CA GLY B 10 1.027 6.469 -1.545 1.00 0.00 C ATOM 1583 C GLY B 10 -0.470 6.234 -1.743 1.00 0.00 C ATOM 1584 O GLY B 10 -1.263 7.143 -1.530 1.00 0.00 O ATOM 0 H GLY B 10 2.534 5.065 -1.299 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.176 7.392 -0.985 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.502 6.606 -2.517 1.00 0.00 H new ATOM 1588 N LEU B 11 -0.868 5.026 -2.144 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.253 4.648 -2.382 1.00 0.00 C ATOM 1590 C LEU B 11 -3.067 4.864 -1.104 1.00 0.00 C ATOM 1591 O LEU B 11 -4.015 5.649 -1.092 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.292 3.183 -2.871 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.503 2.747 -3.705 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.818 3.016 -2.990 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.485 3.357 -5.109 1.00 0.00 C ATOM 0 H LEU B 11 -0.212 4.264 -2.316 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.701 5.270 -3.157 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.394 3.001 -3.462 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.235 2.535 -1.997 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.423 1.667 -3.827 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.647 2.691 -3.619 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.839 2.467 -2.049 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -4.911 4.083 -2.789 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.361 3.020 -5.663 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.499 4.444 -5.034 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.582 3.041 -5.631 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.677 4.191 -0.016 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.331 4.319 1.282 1.00 0.00 C ATOM 1609 C LEU B 12 -3.424 5.790 1.691 1.00 0.00 C ATOM 1610 O LEU B 12 -4.483 6.254 2.125 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.556 3.533 2.356 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.834 2.021 2.378 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.321 1.292 1.134 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.169 1.389 3.607 1.00 0.00 C ATOM 0 H LEU B 12 -1.893 3.539 -0.016 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.337 3.908 1.197 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.489 3.689 2.200 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.799 3.947 3.335 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.918 1.913 2.407 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.550 0.229 1.215 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.805 1.701 0.247 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.242 1.426 1.053 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.369 0.318 3.618 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.093 1.557 3.565 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.572 1.843 4.512 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.306 6.510 1.574 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.210 7.904 1.988 1.00 0.00 C ATOM 1628 C ILE B 13 -3.180 8.761 1.176 1.00 0.00 C ATOM 1629 O ILE B 13 -3.936 9.554 1.741 1.00 0.00 O ATOM 1630 CB ILE B 13 -0.754 8.382 1.832 1.00 0.00 C ATOM 1631 CG1 ILE B 13 0.169 7.668 2.835 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -0.642 9.899 2.027 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.644 7.756 2.419 1.00 0.00 C ATOM 0 H ILE B 13 -1.439 6.137 1.187 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.490 8.002 3.037 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.440 8.134 0.818 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.043 8.111 3.823 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.124 6.621 2.916 1.00 0.00 H new ATOM 0 HG21 ILE B 13 0.398 10.205 1.911 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.255 10.408 1.283 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.989 10.164 3.026 1.00 0.00 H new ATOM 0 HD11 ILE B 13 2.261 7.239 3.154 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.775 7.289 1.443 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.945 8.802 2.364 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.132 8.610 -0.147 1.00 0.00 N ATOM 1646 CA GLY B 14 -3.928 9.356 -1.098 1.00 0.00 C ATOM 1647 C GLY B 14 -5.406 9.102 -0.852 1.00 0.00 C ATOM 1648 O GLY B 14 -6.184 10.049 -0.767 1.00 0.00 O ATOM 0 H GLY B 14 -2.511 7.936 -0.595 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -3.714 10.421 -1.008 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -3.665 9.063 -2.114 1.00 0.00 H new ATOM 1652 N ILE B 15 -5.797 7.830 -0.705 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.162 7.479 -0.351 1.00 0.00 C ATOM 1654 C ILE B 15 -7.555 8.242 0.907 1.00 0.00 C ATOM 1655 O ILE B 15 -8.540 8.981 0.908 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.284 5.953 -0.211 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.549 5.396 -1.616 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.394 5.543 0.762 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.504 3.875 -1.640 1.00 0.00 C ATOM 0 H ILE B 15 -5.178 7.029 -0.828 1.00 0.00 H new ATOM 0 HA ILE B 15 -7.862 7.770 -1.134 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.364 5.546 0.207 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.525 5.736 -1.964 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -6.808 5.792 -2.310 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.439 4.456 0.825 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.184 5.956 1.749 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.350 5.926 0.405 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.697 3.521 -2.653 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.520 3.535 -1.318 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.263 3.478 -0.966 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.765 8.080 1.968 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.085 8.687 3.243 1.00 0.00 C ATOM 1673 C PHE B 16 -7.334 10.184 3.066 1.00 0.00 C ATOM 1674 O PHE B 16 -8.420 10.678 3.354 1.00 0.00 O ATOM 1675 CB PHE B 16 -5.958 8.407 4.237 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.290 8.834 5.645 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -6.142 10.178 6.021 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.893 7.926 6.532 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -6.548 10.594 7.292 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -7.206 8.321 7.840 1.00 0.00 C ATOM 1681 CZ PHE B 16 -7.017 9.656 8.227 1.00 0.00 C ATOM 0 H PHE B 16 -5.903 7.534 1.962 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.001 8.252 3.642 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.733 7.340 4.231 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.056 8.925 3.910 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -5.715 10.889 5.330 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -7.116 6.921 6.205 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -6.501 11.640 7.556 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -7.591 7.601 8.547 1.00 0.00 H new ATOM 0 HZ PHE B 16 -7.231 9.962 9.240 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.331 10.904 2.561 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.387 12.355 2.499 1.00 0.00 C ATOM 1693 C HIS B 17 -7.415 12.853 1.486 1.00 0.00 C ATOM 1694 O HIS B 17 -7.980 13.923 1.687 1.00 0.00 O ATOM 1695 CB HIS B 17 -4.989 12.933 2.282 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.121 12.669 3.483 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -3.441 11.499 3.729 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -4.124 13.396 4.644 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -3.026 11.535 5.007 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.419 12.669 5.609 1.00 0.00 N ATOM 0 H HIS B 17 -5.471 10.500 2.190 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.740 12.726 3.461 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.538 12.489 1.395 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -5.056 14.006 2.102 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -3.281 10.743 3.064 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -4.589 14.360 4.789 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -2.453 10.755 5.486 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.707 12.085 0.433 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.822 12.389 -0.454 1.00 0.00 C ATOM 1710 C LYS B 18 -10.117 12.401 0.365 1.00 0.00 C ATOM 1711 O LYS B 18 -10.861 13.384 0.359 1.00 0.00 O ATOM 1712 CB LYS B 18 -8.858 11.350 -1.586 1.00 0.00 C ATOM 1713 CG LYS B 18 -9.969 11.573 -2.617 1.00 0.00 C ATOM 1714 CD LYS B 18 -10.209 10.332 -3.494 1.00 0.00 C ATOM 1715 CE LYS B 18 -8.990 9.878 -4.312 1.00 0.00 C ATOM 1716 NZ LYS B 18 -8.046 9.059 -3.530 1.00 0.00 N ATOM 0 H LYS B 18 -7.183 11.248 0.178 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.706 13.372 -0.910 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -7.896 11.357 -2.099 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -8.979 10.359 -1.149 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -10.893 11.835 -2.101 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -9.708 12.419 -3.252 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -10.528 9.509 -2.855 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -11.031 10.541 -4.178 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -9.331 9.306 -5.175 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -8.470 10.755 -4.696 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -7.651 8.311 -4.135 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -7.275 9.661 -3.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -8.545 8.627 -2.726 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.385 11.305 1.077 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.597 11.184 1.872 1.00 0.00 C ATOM 1732 C TYR B 19 -11.655 12.241 2.980 1.00 0.00 C ATOM 1733 O TYR B 19 -12.699 12.858 3.175 1.00 0.00 O ATOM 1734 CB TYR B 19 -11.762 9.743 2.368 1.00 0.00 C ATOM 1735 CG TYR B 19 -12.475 8.865 1.358 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -11.760 8.233 0.325 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -13.880 8.852 1.332 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -12.443 7.685 -0.771 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.562 8.337 0.220 1.00 0.00 C ATOM 1740 CZ TYR B 19 -13.839 7.796 -0.854 1.00 0.00 C ATOM 1741 OH TYR B 19 -14.492 7.393 -1.977 1.00 0.00 O ATOM 0 H TYR B 19 -9.774 10.489 1.116 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.462 11.394 1.243 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -10.781 9.321 2.584 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.321 9.745 3.304 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -10.683 8.169 0.376 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.437 9.240 2.172 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -11.894 7.178 -1.551 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -15.641 8.357 0.190 1.00 0.00 H new ATOM 0 HH TYR B 19 -15.455 7.539 -1.866 1.00 0.00 H new ATOM 1751 N SER B 20 -10.550 12.499 3.682 1.00 0.00 N ATOM 1752 CA SER B 20 -10.485 13.584 4.653 1.00 0.00 C ATOM 1753 C SER B 20 -10.808 14.922 3.981 1.00 0.00 C ATOM 1754 O SER B 20 -11.673 15.665 4.442 1.00 0.00 O ATOM 1755 CB SER B 20 -9.098 13.607 5.294 1.00 0.00 C ATOM 1756 OG SER B 20 -8.776 12.325 5.786 1.00 0.00 O ATOM 0 H SER B 20 -9.685 11.966 3.593 1.00 0.00 H new ATOM 0 HA SER B 20 -11.228 13.420 5.434 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.355 13.923 4.562 1.00 0.00 H new ATOM 0 HB3 SER B 20 -9.075 14.334 6.106 1.00 0.00 H new ATOM 0 HG SER B 20 -8.972 12.284 6.745 1.00 0.00 H new ATOM 1762 N GLY B 21 -10.132 15.204 2.866 1.00 0.00 N ATOM 1763 CA GLY B 21 -10.312 16.402 2.065 1.00 0.00 C ATOM 1764 C GLY B 21 -11.779 16.618 1.713 1.00 0.00 C ATOM 1765 O GLY B 21 -12.271 17.742 1.801 1.00 0.00 O ATOM 0 H GLY B 21 -9.421 14.578 2.488 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.936 17.267 2.611 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.724 16.322 1.150 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.327 14.924 8.736 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.871 13.561 9.001 1.00 0.00 C ATOM 1849 C HIS B 27 -5.895 12.768 9.830 1.00 0.00 C ATOM 1850 O HIS B 27 -5.530 11.964 10.689 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.494 13.622 9.678 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.492 14.448 8.906 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.349 14.473 7.536 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.641 15.388 9.425 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.436 15.412 7.241 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -0.969 15.995 8.358 1.00 0.00 N ATOM 0 HA HIS B 27 -4.775 13.022 8.058 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.606 14.039 10.679 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.108 12.609 9.796 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -2.846 13.885 6.867 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.512 15.619 10.472 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -1.119 15.665 6.240 1.00 0.00 H new ATOM 1864 N THR B 28 -7.190 12.967 9.575 1.00 0.00 N ATOM 1865 CA THR B 28 -8.283 12.357 10.313 1.00 0.00 C ATOM 1866 C THR B 28 -9.467 12.160 9.353 1.00 0.00 C ATOM 1867 O THR B 28 -9.579 12.877 8.360 1.00 0.00 O ATOM 1868 CB THR B 28 -8.577 13.212 11.558 1.00 0.00 C ATOM 1869 OG1 THR B 28 -7.439 13.264 12.403 1.00 0.00 O ATOM 1870 CG2 THR B 28 -9.732 12.699 12.417 1.00 0.00 C ATOM 0 H THR B 28 -7.510 13.578 8.824 1.00 0.00 H new ATOM 0 HA THR B 28 -8.038 11.365 10.692 1.00 0.00 H new ATOM 0 HB THR B 28 -8.849 14.189 11.159 1.00 0.00 H new ATOM 0 HG1 THR B 28 -6.867 12.488 12.229 1.00 0.00 H new ATOM 0 HG21 THR B 28 -9.871 13.360 13.273 1.00 0.00 H new ATOM 0 HG22 THR B 28 -10.646 12.678 11.823 1.00 0.00 H new ATOM 0 HG23 THR B 28 -9.505 11.693 12.769 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.298 11.147 9.614 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.535 10.828 8.905 1.00 0.00 C ATOM 1880 C LEU B 29 -12.648 10.687 9.937 1.00 0.00 C ATOM 1881 O LEU B 29 -12.379 10.216 11.041 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.422 9.460 8.215 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.516 9.412 6.983 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -10.312 7.947 6.577 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -11.168 10.142 5.810 1.00 0.00 C ATOM 0 H LEU B 29 -10.112 10.490 10.372 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.730 11.612 8.174 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -11.054 8.736 8.942 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -12.421 9.138 7.921 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.567 9.890 7.226 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -9.667 7.899 5.699 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -9.847 7.403 7.399 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -11.277 7.496 6.344 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -10.509 10.098 4.943 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -12.119 9.666 5.569 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -11.342 11.183 6.081 1.00 0.00 H new ATOM 1897 N SER B 30 -13.892 11.024 9.587 1.00 0.00 N ATOM 1898 CA SER B 30 -15.040 10.700 10.425 1.00 0.00 C ATOM 1899 C SER B 30 -15.525 9.274 10.145 1.00 0.00 C ATOM 1900 O SER B 30 -15.214 8.693 9.106 1.00 0.00 O ATOM 1901 CB SER B 30 -16.164 11.715 10.197 1.00 0.00 C ATOM 1902 OG SER B 30 -16.696 11.574 8.892 1.00 0.00 O ATOM 0 H SER B 30 -14.126 11.521 8.728 1.00 0.00 H new ATOM 0 HA SER B 30 -14.737 10.753 11.471 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.952 11.568 10.936 1.00 0.00 H new ATOM 0 HB3 SER B 30 -15.783 12.727 10.334 1.00 0.00 H new ATOM 0 HG SER B 30 -17.415 12.227 8.759 1.00 0.00 H new ATOM 1908 N LYS B 31 -16.324 8.726 11.064 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.946 7.415 10.966 1.00 0.00 C ATOM 1910 C LYS B 31 -17.576 7.148 9.598 1.00 0.00 C ATOM 1911 O LYS B 31 -17.306 6.141 8.940 1.00 0.00 O ATOM 1912 CB LYS B 31 -17.996 7.278 12.086 1.00 0.00 C ATOM 1913 CG LYS B 31 -18.856 8.520 12.384 1.00 0.00 C ATOM 1914 CD LYS B 31 -19.958 8.152 13.382 1.00 0.00 C ATOM 1915 CE LYS B 31 -20.815 9.381 13.707 1.00 0.00 C ATOM 1916 NZ LYS B 31 -21.894 9.044 14.652 1.00 0.00 N ATOM 0 H LYS B 31 -16.561 9.209 11.931 1.00 0.00 H new ATOM 0 HA LYS B 31 -16.164 6.665 11.084 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.664 6.456 11.828 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -17.480 6.993 13.003 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -18.234 9.317 12.791 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.297 8.899 11.462 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -20.585 7.363 12.967 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -19.513 7.758 14.296 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -20.187 10.163 14.133 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -21.244 9.781 12.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -22.457 9.895 14.853 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -22.506 8.314 14.234 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -21.481 8.685 15.536 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.457 8.049 9.177 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.244 7.837 7.974 1.00 0.00 C ATOM 1932 C LYS B 32 -18.384 8.105 6.740 1.00 0.00 C ATOM 1933 O LYS B 32 -18.534 7.420 5.729 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.540 8.653 8.045 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.383 8.509 6.769 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.780 9.128 6.920 1.00 0.00 C ATOM 1937 CE LYS B 32 -22.723 10.647 7.124 1.00 0.00 C ATOM 1938 NZ LYS B 32 -24.073 11.236 7.124 1.00 0.00 N ATOM 0 H LYS B 32 -18.642 8.932 9.653 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.560 6.797 7.893 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.126 8.328 8.905 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.298 9.704 8.203 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -20.864 8.987 5.938 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.481 7.453 6.519 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -23.372 8.905 6.033 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -23.289 8.668 7.767 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -22.226 10.871 8.068 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -22.126 11.101 6.333 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -24.003 12.264 7.264 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -24.537 11.041 6.214 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -24.634 10.819 7.894 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.448 9.055 6.825 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.480 9.247 5.758 1.00 0.00 C ATOM 1954 C GLU B 33 -15.664 7.963 5.567 1.00 0.00 C ATOM 1955 O GLU B 33 -15.436 7.536 4.437 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.598 10.463 6.059 1.00 0.00 C ATOM 1957 CG GLU B 33 -14.827 10.926 4.818 1.00 0.00 C ATOM 1958 CD GLU B 33 -15.749 11.581 3.793 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.049 12.779 3.980 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -16.166 10.865 2.858 1.00 0.00 O ATOM 0 H GLU B 33 -17.346 9.693 7.614 1.00 0.00 H new ATOM 0 HA GLU B 33 -16.995 9.452 4.819 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.218 11.280 6.428 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -14.894 10.214 6.853 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.051 11.632 5.114 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -14.324 10.073 4.363 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.253 7.322 6.667 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.582 6.033 6.599 1.00 0.00 C ATOM 1969 C LEU B 34 -15.491 5.009 5.918 1.00 0.00 C ATOM 1970 O LEU B 34 -15.062 4.326 4.989 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.109 5.604 7.997 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.489 4.198 8.090 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.534 3.073 8.021 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.374 4.002 7.053 1.00 0.00 C ATOM 0 H LEU B 34 -15.377 7.681 7.613 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.684 6.108 5.986 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.375 6.329 8.350 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.958 5.652 8.678 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.037 4.130 9.080 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -14.034 2.107 8.092 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.238 3.179 8.847 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.073 3.134 7.075 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -11.960 2.998 7.149 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.782 4.132 6.051 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.587 4.737 7.222 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.752 4.883 6.345 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.655 3.968 5.656 1.00 0.00 C ATOM 1988 C LYS B 35 -17.641 4.247 4.146 1.00 0.00 C ATOM 1989 O LYS B 35 -17.472 3.317 3.358 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.068 4.015 6.252 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.026 3.121 5.448 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.446 3.076 6.017 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.542 2.251 7.302 1.00 0.00 C ATOM 1994 NZ LYS B 35 -22.951 2.149 7.725 1.00 0.00 N ATOM 0 H LYS B 35 -17.156 5.385 7.136 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.300 2.948 5.805 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.041 3.686 7.291 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.434 5.042 6.252 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.067 3.480 4.420 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.624 2.108 5.417 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.785 4.092 6.217 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -22.119 2.656 5.270 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.129 1.256 7.138 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -20.949 2.716 8.089 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -23.026 2.373 8.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -23.527 2.820 7.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -23.295 1.182 7.558 1.00 0.00 H new ATOM 2008 N GLU B 36 -17.796 5.513 3.751 1.00 0.00 N ATOM 2009 CA GLU B 36 -17.788 5.930 2.354 1.00 0.00 C ATOM 2010 C GLU B 36 -16.503 5.476 1.648 1.00 0.00 C ATOM 2011 O GLU B 36 -16.561 4.896 0.562 1.00 0.00 O ATOM 2012 CB GLU B 36 -17.979 7.453 2.269 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.498 7.894 0.892 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.932 7.429 0.647 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.835 8.026 1.269 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -20.093 6.477 -0.147 1.00 0.00 O ATOM 0 H GLU B 36 -17.932 6.285 4.404 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.618 5.450 1.835 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -18.680 7.774 3.040 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.030 7.949 2.474 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.451 8.980 0.818 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -17.849 7.493 0.114 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.350 5.719 2.283 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.048 5.244 1.830 1.00 0.00 C ATOM 2025 C LEU B 37 -14.153 3.760 1.498 1.00 0.00 C ATOM 2026 O LEU B 37 -13.858 3.343 0.381 1.00 0.00 O ATOM 2027 CB LEU B 37 -12.984 5.586 2.895 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.527 5.196 2.604 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.612 6.037 3.499 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.224 3.721 2.909 1.00 0.00 C ATOM 0 H LEU B 37 -15.301 6.264 3.144 1.00 0.00 H new ATOM 0 HA LEU B 37 -13.729 5.743 0.915 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.015 6.662 3.065 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.279 5.107 3.829 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.359 5.368 1.541 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.572 5.773 3.306 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.764 7.095 3.284 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.847 5.842 4.545 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.179 3.510 2.682 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.414 3.521 3.963 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -11.864 3.084 2.298 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.634 2.955 2.443 1.00 0.00 N ATOM 2043 CA ILE B 38 -14.747 1.519 2.239 1.00 0.00 C ATOM 2044 C ILE B 38 -15.754 1.171 1.137 1.00 0.00 C ATOM 2045 O ILE B 38 -15.530 0.223 0.380 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.033 0.822 3.576 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -13.821 1.074 4.489 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.252 -0.680 3.359 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -13.981 0.433 5.859 1.00 0.00 C ATOM 0 H ILE B 38 -14.951 3.277 3.357 1.00 0.00 H new ATOM 0 HA ILE B 38 -13.793 1.138 1.875 1.00 0.00 H new ATOM 0 HB ILE B 38 -15.940 1.217 4.033 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -12.923 0.683 4.011 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -13.677 2.148 4.608 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.454 -1.160 4.316 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.100 -0.831 2.691 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.358 -1.118 2.915 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.098 0.641 6.463 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -14.863 0.843 6.352 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.097 -0.645 5.745 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.857 1.914 1.019 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.821 1.641 -0.038 1.00 0.00 C ATOM 2063 C GLN B 39 -17.156 1.820 -1.402 1.00 0.00 C ATOM 2064 O GLN B 39 -17.336 0.985 -2.286 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.092 2.495 0.083 1.00 0.00 C ATOM 2066 CG GLN B 39 -19.853 2.371 1.413 1.00 0.00 C ATOM 2067 CD GLN B 39 -19.733 1.001 2.075 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -20.458 0.076 1.732 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -18.822 0.858 3.032 1.00 0.00 N ATOM 0 H GLN B 39 -17.098 2.693 1.631 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.145 0.606 0.068 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -18.821 3.540 -0.063 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -19.768 2.225 -0.728 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.483 3.129 2.103 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -20.907 2.587 1.238 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -18.232 1.647 3.297 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -18.713 -0.041 3.502 1.00 0.00 H new ATOM 2078 N LYS B 40 -16.362 2.880 -1.576 1.00 0.00 N ATOM 2079 CA LYS B 40 -15.650 3.081 -2.831 1.00 0.00 C ATOM 2080 C LYS B 40 -14.566 2.009 -2.994 1.00 0.00 C ATOM 2081 O LYS B 40 -14.511 1.318 -4.007 1.00 0.00 O ATOM 2082 CB LYS B 40 -15.091 4.511 -2.881 1.00 0.00 C ATOM 2083 CG LYS B 40 -14.930 5.092 -4.297 1.00 0.00 C ATOM 2084 CD LYS B 40 -13.929 4.344 -5.192 1.00 0.00 C ATOM 2085 CE LYS B 40 -14.621 3.453 -6.232 1.00 0.00 C ATOM 2086 NZ LYS B 40 -15.257 4.247 -7.299 1.00 0.00 N ATOM 0 H LYS B 40 -16.200 3.600 -0.872 1.00 0.00 H new ATOM 0 HA LYS B 40 -16.330 2.971 -3.676 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -15.750 5.164 -2.308 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -14.120 4.524 -2.386 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -15.904 5.092 -4.787 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -14.615 6.132 -4.214 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -13.293 5.067 -5.703 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -13.278 3.731 -4.569 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -13.891 2.773 -6.671 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -15.374 2.837 -5.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -15.534 3.619 -8.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -16.101 4.723 -6.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -14.585 4.959 -7.649 1.00 0.00 H new ATOM 2100 N GLU B 41 -13.690 1.877 -1.999 1.00 0.00 N ATOM 2101 CA GLU B 41 -12.522 1.016 -2.078 1.00 0.00 C ATOM 2102 C GLU B 41 -12.900 -0.454 -2.216 1.00 0.00 C ATOM 2103 O GLU B 41 -12.436 -1.116 -3.138 1.00 0.00 O ATOM 2104 CB GLU B 41 -11.634 1.229 -0.846 1.00 0.00 C ATOM 2105 CG GLU B 41 -10.614 2.351 -1.060 1.00 0.00 C ATOM 2106 CD GLU B 41 -11.200 3.669 -1.566 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -11.313 3.805 -2.803 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -11.485 4.535 -0.714 1.00 0.00 O ATOM 0 H GLU B 41 -13.776 2.371 -1.111 1.00 0.00 H new ATOM 0 HA GLU B 41 -11.968 1.289 -2.976 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.259 1.467 0.015 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.110 0.302 -0.613 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -10.099 2.538 -0.118 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -9.863 2.008 -1.771 1.00 0.00 H new ATOM 2115 N LEU B 42 -13.673 -0.984 -1.271 1.00 0.00 N ATOM 2116 CA LEU B 42 -13.952 -2.413 -1.194 1.00 0.00 C ATOM 2117 C LEU B 42 -15.264 -2.742 -1.899 1.00 0.00 C ATOM 2118 O LEU B 42 -15.331 -3.735 -2.620 1.00 0.00 O ATOM 2119 CB LEU B 42 -13.941 -2.907 0.260 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.623 -2.628 1.013 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.630 -3.400 2.339 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -11.375 -3.047 0.224 1.00 0.00 C ATOM 0 H LEU B 42 -14.122 -0.434 -0.539 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.156 -2.946 -1.714 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.762 -2.433 0.799 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -14.131 -3.980 0.269 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.572 -1.550 1.168 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.702 -3.208 2.877 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -13.475 -3.074 2.945 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.718 -4.468 2.138 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.483 -2.824 0.809 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -11.416 -4.117 0.019 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -11.338 -2.498 -0.717 1.00 0.00 H new ATOM 2243 N ASP B 50 -22.990 -4.674 5.905 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.988 -3.360 6.551 1.00 0.00 C ATOM 2245 C ASP B 50 -22.758 -3.451 8.061 1.00 0.00 C ATOM 2246 O ASP B 50 -21.996 -2.662 8.607 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.272 -2.584 6.248 1.00 0.00 C ATOM 2248 CG ASP B 50 -24.249 -1.213 6.918 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -23.651 -0.296 6.315 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -24.821 -1.108 8.024 1.00 0.00 O ATOM 0 HA ASP B 50 -22.147 -2.812 6.127 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.384 -2.465 5.170 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -25.135 -3.150 6.598 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.379 -4.426 8.731 1.00 0.00 N ATOM 2256 CA ALA B 51 -23.144 -4.686 10.150 1.00 0.00 C ATOM 2257 C ALA B 51 -21.646 -4.842 10.442 1.00 0.00 C ATOM 2258 O ALA B 51 -21.104 -4.232 11.367 1.00 0.00 O ATOM 2259 CB ALA B 51 -23.911 -5.943 10.568 1.00 0.00 C ATOM 0 H ALA B 51 -24.058 -5.056 8.303 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.503 -3.835 10.729 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -23.738 -6.140 11.626 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -24.977 -5.793 10.397 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.565 -6.793 9.980 1.00 0.00 H new ATOM 2265 N GLU B 52 -20.963 -5.647 9.626 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.537 -5.872 9.760 1.00 0.00 C ATOM 2267 C GLU B 52 -18.794 -4.571 9.470 1.00 0.00 C ATOM 2268 O GLU B 52 -17.860 -4.229 10.191 1.00 0.00 O ATOM 2269 CB GLU B 52 -19.072 -7.007 8.834 1.00 0.00 C ATOM 2270 CG GLU B 52 -19.974 -8.251 8.900 1.00 0.00 C ATOM 2271 CD GLU B 52 -20.224 -8.714 10.332 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -19.236 -9.136 10.971 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -21.395 -8.629 10.761 1.00 0.00 O ATOM 0 H GLU B 52 -21.391 -6.159 8.855 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.313 -6.182 10.781 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -19.043 -6.641 7.808 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -18.054 -7.290 9.100 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -20.928 -8.030 8.421 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -19.513 -9.061 8.335 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.222 -3.833 8.438 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.655 -2.522 8.148 1.00 0.00 C ATOM 2282 C ILE B 53 -18.736 -1.625 9.381 1.00 0.00 C ATOM 2283 O ILE B 53 -17.730 -1.026 9.742 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.292 -1.847 6.917 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -19.229 -2.708 5.645 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.631 -0.483 6.661 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.805 -3.078 5.228 1.00 0.00 C ATOM 0 H ILE B 53 -19.958 -4.126 7.795 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.607 -2.676 7.893 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.348 -1.715 7.151 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.801 -3.622 5.806 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.710 -2.170 4.828 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -19.088 -0.015 5.789 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.770 0.158 7.532 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.565 -0.623 6.480 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.837 -3.685 4.324 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -17.235 -2.169 5.035 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.327 -3.643 6.028 1.00 0.00 H new ATOM 2299 N VAL B 54 -19.896 -1.508 10.036 1.00 0.00 N ATOM 2300 CA VAL B 54 -19.998 -0.630 11.197 1.00 0.00 C ATOM 2301 C VAL B 54 -19.185 -1.140 12.388 1.00 0.00 C ATOM 2302 O VAL B 54 -18.597 -0.327 13.097 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.429 -0.197 11.552 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -21.947 0.753 10.465 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.402 -1.352 11.784 1.00 0.00 C ATOM 0 H VAL B 54 -20.755 -1.998 9.787 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.527 0.304 10.891 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.376 0.314 12.514 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -22.962 1.066 10.709 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.301 1.629 10.410 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -21.946 0.240 9.503 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.387 -0.954 12.029 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.470 -1.958 10.880 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -22.044 -1.969 12.608 1.00 0.00 H new ATOM 2315 N LYS B 55 -19.092 -2.455 12.608 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.177 -2.981 13.622 1.00 0.00 C ATOM 2317 C LYS B 55 -16.734 -2.561 13.304 1.00 0.00 C ATOM 2318 O LYS B 55 -16.056 -1.940 14.122 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.339 -4.505 13.734 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.288 -5.191 14.622 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.169 -4.567 16.019 1.00 0.00 C ATOM 2322 CE LYS B 55 -16.188 -5.373 16.876 1.00 0.00 C ATOM 2323 NZ LYS B 55 -15.831 -4.648 18.107 1.00 0.00 N ATOM 0 H LYS B 55 -19.629 -3.163 12.107 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.423 -2.558 14.596 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.331 -4.725 14.130 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -18.291 -4.938 12.735 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -17.542 -6.246 14.724 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.318 -5.143 14.127 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -16.828 -3.535 15.937 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -18.147 -4.542 16.499 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -16.632 -6.334 17.134 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -15.286 -5.582 16.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -15.474 -5.321 18.815 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -15.094 -3.945 17.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -16.672 -4.165 18.482 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.269 -2.881 12.099 1.00 0.00 N ATOM 2338 CA LEU B 56 -14.951 -2.505 11.607 1.00 0.00 C ATOM 2339 C LEU B 56 -14.715 -0.997 11.770 1.00 0.00 C ATOM 2340 O LEU B 56 -13.673 -0.565 12.263 1.00 0.00 O ATOM 2341 CB LEU B 56 -14.850 -2.998 10.156 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.684 -2.408 9.358 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -13.091 -3.477 8.432 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.172 -1.244 8.493 1.00 0.00 C ATOM 0 H LEU B 56 -16.812 -3.421 11.425 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.156 -2.973 12.188 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.756 -4.084 10.162 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.781 -2.762 9.641 1.00 0.00 H new ATOM 0 HG LEU B 56 -12.930 -2.058 10.063 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.262 -3.050 7.867 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.730 -4.315 9.028 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -13.858 -3.826 7.741 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.334 -0.833 7.930 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.934 -1.600 7.800 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.596 -0.469 9.132 1.00 0.00 H new ATOM 2356 N MET B 57 -15.699 -0.193 11.375 1.00 0.00 N ATOM 2357 CA MET B 57 -15.654 1.254 11.455 1.00 0.00 C ATOM 2358 C MET B 57 -15.560 1.686 12.914 1.00 0.00 C ATOM 2359 O MET B 57 -14.793 2.591 13.221 1.00 0.00 O ATOM 2360 CB MET B 57 -16.869 1.838 10.728 1.00 0.00 C ATOM 2361 CG MET B 57 -17.017 3.356 10.869 1.00 0.00 C ATOM 2362 SD MET B 57 -17.722 3.945 12.428 1.00 0.00 S ATOM 2363 CE MET B 57 -19.407 3.299 12.358 1.00 0.00 C ATOM 0 H MET B 57 -16.571 -0.546 10.980 1.00 0.00 H new ATOM 0 HA MET B 57 -14.765 1.642 10.957 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.799 1.588 9.669 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.771 1.360 11.110 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.034 3.810 10.744 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.641 3.717 10.052 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.020 3.800 13.107 1.00 0.00 H new ATOM 0 HE2 MET B 57 -19.825 3.479 11.367 1.00 0.00 H new ATOM 0 HE3 MET B 57 -19.394 2.227 12.557 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.308 1.044 13.815 1.00 0.00 N ATOM 2374 CA ASP B 58 -16.206 1.311 15.240 1.00 0.00 C ATOM 2375 C ASP B 58 -14.775 1.045 15.708 1.00 0.00 C ATOM 2376 O ASP B 58 -14.166 1.869 16.384 1.00 0.00 O ATOM 2377 CB ASP B 58 -17.225 0.485 16.031 1.00 0.00 C ATOM 2378 CG ASP B 58 -17.111 0.771 17.525 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.765 1.739 17.970 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.378 0.011 18.194 1.00 0.00 O ATOM 0 H ASP B 58 -16.995 0.330 13.573 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.440 2.359 15.425 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.233 0.717 15.688 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -17.062 -0.577 15.846 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.214 -0.104 15.325 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.847 -0.447 15.699 1.00 0.00 C ATOM 2387 C ASP B 59 -11.869 0.627 15.210 1.00 0.00 C ATOM 2388 O ASP B 59 -11.042 1.107 15.981 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.466 -1.839 15.173 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.403 -2.947 15.648 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.799 -2.905 16.834 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -13.696 -3.836 14.817 1.00 0.00 O ATOM 0 H ASP B 59 -14.686 -0.808 14.758 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.786 -0.482 16.787 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.463 -1.819 14.083 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.450 -2.073 15.490 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.974 1.020 13.936 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.185 2.112 13.372 1.00 0.00 C ATOM 2399 C LEU B 60 -11.381 3.413 14.168 1.00 0.00 C ATOM 2400 O LEU B 60 -10.408 4.050 14.569 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.560 2.311 11.888 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.836 1.362 10.915 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.655 1.143 9.640 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.496 1.954 10.463 1.00 0.00 C ATOM 0 H LEU B 60 -12.611 0.586 13.268 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.129 1.849 13.439 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.636 2.174 11.776 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.338 3.340 11.605 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.693 0.426 11.455 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.117 0.469 8.973 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.620 0.706 9.898 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.812 2.099 9.140 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.006 1.263 9.777 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.670 2.905 9.959 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.858 2.116 11.332 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.632 3.835 14.366 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.970 5.151 14.896 1.00 0.00 C ATOM 2418 C ASP B 61 -12.753 5.275 16.402 1.00 0.00 C ATOM 2419 O ASP B 61 -12.588 6.392 16.889 1.00 0.00 O ATOM 2420 CB ASP B 61 -14.362 5.612 14.427 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.565 5.117 15.235 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.376 4.365 16.209 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.685 5.523 14.862 1.00 0.00 O ATOM 0 H ASP B 61 -13.449 3.260 14.158 1.00 0.00 H new ATOM 0 HA ASP B 61 -12.256 5.854 14.467 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -14.377 6.702 14.430 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.494 5.294 13.393 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.711 4.145 17.122 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.427 4.094 18.552 1.00 0.00 C ATOM 2430 C ARG B 62 -11.262 5.032 18.878 1.00 0.00 C ATOM 2431 O ARG B 62 -11.339 5.805 19.833 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.134 2.644 18.959 1.00 0.00 C ATOM 2433 CG ARG B 62 -11.943 2.498 20.472 1.00 0.00 C ATOM 2434 CD ARG B 62 -11.777 1.020 20.835 1.00 0.00 C ATOM 2435 NE ARG B 62 -11.575 0.852 22.281 1.00 0.00 N ATOM 2436 CZ ARG B 62 -11.432 -0.329 22.894 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -11.467 -1.465 22.188 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -11.254 -0.369 24.218 1.00 0.00 N ATOM 0 H ARG B 62 -12.878 3.226 16.713 1.00 0.00 H new ATOM 0 HA ARG B 62 -13.290 4.433 19.124 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.954 2.004 18.634 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -11.237 2.298 18.446 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -11.067 3.061 20.793 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -12.801 2.917 20.998 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -12.660 0.463 20.520 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -10.927 0.602 20.295 1.00 0.00 H new ATOM 0 HE ARG B 62 -11.541 1.693 22.857 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -11.603 -1.434 21.178 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -11.357 -2.362 22.660 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -11.228 0.498 24.755 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -11.144 -1.266 24.691 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.985 9.403 15.184 1.00 0.00 N ATOM 2518 CA GLU B 67 -13.012 9.790 14.172 1.00 0.00 C ATOM 2519 C GLU B 67 -11.845 8.793 14.141 1.00 0.00 C ATOM 2520 O GLU B 67 -11.338 8.385 15.185 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.499 11.209 14.466 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.353 12.317 13.829 1.00 0.00 C ATOM 2523 CD GLU B 67 -14.809 12.314 14.284 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -15.023 12.330 15.516 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -15.684 12.309 13.390 1.00 0.00 O ATOM 0 HA GLU B 67 -13.493 9.781 13.194 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -12.470 11.359 15.545 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.475 11.298 14.104 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.911 13.285 14.066 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.321 12.209 12.745 1.00 0.00 H new ATOM 2532 N VAL B 68 -11.392 8.438 12.936 1.00 0.00 N ATOM 2533 CA VAL B 68 -10.193 7.644 12.683 1.00 0.00 C ATOM 2534 C VAL B 68 -9.052 8.617 12.385 1.00 0.00 C ATOM 2535 O VAL B 68 -9.278 9.586 11.667 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.390 6.745 11.451 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -9.315 5.655 11.403 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.783 6.109 11.368 1.00 0.00 C ATOM 0 H VAL B 68 -11.872 8.708 12.077 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.979 7.017 13.549 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.295 7.400 10.585 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.471 5.029 10.525 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.330 6.118 11.349 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.379 5.042 12.302 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.847 5.489 10.474 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.954 5.492 12.250 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.539 6.893 11.321 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.836 8.374 12.880 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.670 9.205 12.599 1.00 0.00 C ATOM 2550 C ASN B 69 -5.676 8.420 11.741 1.00 0.00 C ATOM 2551 O ASN B 69 -5.594 7.196 11.849 1.00 0.00 O ATOM 2552 CB ASN B 69 -6.057 9.712 13.907 1.00 0.00 C ATOM 2553 CG ASN B 69 -4.824 10.573 13.672 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -4.930 11.780 13.493 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.643 9.966 13.685 1.00 0.00 N ATOM 0 H ASN B 69 -7.634 7.585 13.494 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.964 10.086 12.029 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -6.802 10.290 14.455 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.789 8.861 14.534 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.790 10.507 13.543 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -3.589 8.959 13.837 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.957 9.124 10.863 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.126 8.538 9.814 1.00 0.00 C ATOM 2564 C PHE B 70 -3.309 7.311 10.246 1.00 0.00 C ATOM 2565 O PHE B 70 -3.462 6.224 9.687 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.229 9.622 9.206 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.240 9.065 8.207 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.723 8.488 7.019 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.898 8.872 8.583 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.861 7.751 6.193 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.042 8.111 7.770 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.523 7.553 6.574 1.00 0.00 C ATOM 0 H PHE B 70 -4.938 10.144 10.864 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.812 8.151 9.060 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.851 10.371 8.717 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.687 10.130 10.004 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.759 8.612 6.742 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.526 9.309 9.498 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.226 7.336 5.265 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.985 7.955 8.064 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.136 6.971 5.947 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.410 7.468 11.220 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.495 6.385 11.563 1.00 0.00 C ATOM 2584 C GLN B 71 -2.272 5.156 12.048 1.00 0.00 C ATOM 2585 O GLN B 71 -1.919 4.020 11.732 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.455 6.875 12.577 1.00 0.00 C ATOM 2587 CG GLN B 71 0.688 5.860 12.729 1.00 0.00 C ATOM 2588 CD GLN B 71 1.830 6.414 13.575 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.093 5.932 14.670 1.00 0.00 O ATOM 2590 NE2 GLN B 71 2.520 7.435 13.076 1.00 0.00 N ATOM 0 H GLN B 71 -2.299 8.318 11.774 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.949 6.073 10.673 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.053 7.835 12.255 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -0.933 7.037 13.543 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.305 4.948 13.187 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.065 5.587 11.743 1.00 0.00 H new ATOM 0 HE21 GLN B 71 2.278 7.816 12.161 1.00 0.00 H new ATOM 0 HE22 GLN B 71 3.291 7.838 13.608 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.353 5.381 12.794 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.220 4.331 13.294 1.00 0.00 C ATOM 2601 C GLU B 72 -4.957 3.661 12.136 1.00 0.00 C ATOM 2602 O GLU B 72 -5.097 2.442 12.129 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.187 4.883 14.349 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.455 5.293 15.639 1.00 0.00 C ATOM 2605 CD GLU B 72 -3.656 6.596 15.552 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -3.841 7.345 14.565 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -2.848 6.819 16.477 1.00 0.00 O ATOM 0 H GLU B 72 -3.650 6.317 13.069 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.612 3.570 13.784 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.715 5.745 13.942 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.939 4.129 14.582 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.189 5.389 16.439 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.777 4.489 15.924 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.394 4.436 11.139 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.909 3.875 9.896 1.00 0.00 C ATOM 2616 C TYR B 73 -4.881 2.919 9.275 1.00 0.00 C ATOM 2617 O TYR B 73 -5.225 1.776 8.977 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.362 4.998 8.950 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.302 4.687 7.465 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -5.161 5.055 6.726 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -7.448 4.222 6.795 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -5.175 4.980 5.323 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -7.473 4.185 5.389 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.339 4.567 4.653 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.398 4.614 3.293 1.00 0.00 O ATOM 0 H TYR B 73 -5.399 5.455 11.173 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.796 3.275 10.100 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.388 5.266 9.203 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.746 5.877 9.141 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -4.274 5.396 7.239 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -8.308 3.894 7.360 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -4.291 5.240 4.760 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -8.366 3.862 4.874 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.706 5.221 2.956 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.624 3.348 9.107 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.594 2.462 8.556 1.00 0.00 C ATOM 2637 C ILE B 74 -2.451 1.203 9.423 1.00 0.00 C ATOM 2638 O ILE B 74 -2.495 0.086 8.912 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.236 3.171 8.391 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.283 4.415 7.485 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.201 2.166 7.859 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.541 4.111 6.007 1.00 0.00 C ATOM 0 H ILE B 74 -3.300 4.287 9.340 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.920 2.169 7.558 1.00 0.00 H new ATOM 0 HB ILE B 74 -0.951 3.536 9.378 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.063 5.084 7.847 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.338 4.950 7.574 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.762 2.663 7.741 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.099 1.341 8.564 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.531 1.780 6.894 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.558 5.043 5.442 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.748 3.469 5.624 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.501 3.605 5.902 1.00 0.00 H new ATOM 2654 N THR B 75 -2.287 1.385 10.736 1.00 0.00 N ATOM 2655 CA THR B 75 -2.170 0.291 11.697 1.00 0.00 C ATOM 2656 C THR B 75 -3.311 -0.712 11.495 1.00 0.00 C ATOM 2657 O THR B 75 -3.096 -1.918 11.366 1.00 0.00 O ATOM 2658 CB THR B 75 -2.184 0.863 13.125 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.175 1.843 13.266 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.959 -0.216 14.186 1.00 0.00 C ATOM 0 H THR B 75 -2.231 2.309 11.164 1.00 0.00 H new ATOM 0 HA THR B 75 -1.229 -0.236 11.540 1.00 0.00 H new ATOM 0 HB THR B 75 -3.171 1.299 13.278 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.472 2.680 12.852 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.978 0.238 15.177 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.747 -0.966 14.116 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.991 -0.691 14.023 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.540 -0.196 11.450 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.725 -1.005 11.264 1.00 0.00 C ATOM 2670 C PHE B 76 -5.683 -1.714 9.916 1.00 0.00 C ATOM 2671 O PHE B 76 -5.995 -2.893 9.856 1.00 0.00 O ATOM 2672 CB PHE B 76 -6.988 -0.159 11.406 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.248 -1.001 11.347 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.809 -1.340 10.100 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.772 -1.569 12.523 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.919 -2.196 10.036 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.856 -2.462 12.453 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.427 -2.778 11.209 1.00 0.00 C ATOM 0 H PHE B 76 -4.733 0.801 11.543 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.748 -1.767 12.043 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.957 0.381 12.352 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.014 0.588 10.613 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.384 -0.940 9.191 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.341 -1.319 13.481 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.383 -2.407 9.084 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.250 -2.905 13.356 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.256 -3.468 11.155 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.297 -1.038 8.830 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.124 -1.714 7.547 1.00 0.00 C ATOM 2690 C LEU B 77 -4.098 -2.847 7.670 1.00 0.00 C ATOM 2691 O LEU B 77 -4.298 -3.917 7.098 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.783 -0.719 6.428 1.00 0.00 C ATOM 2693 CG LEU B 77 -5.996 0.128 6.001 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.554 1.219 5.024 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.064 -0.708 5.285 1.00 0.00 C ATOM 0 H LEU B 77 -5.101 -0.037 8.815 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.073 -2.171 7.265 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.984 -0.059 6.765 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.403 -1.265 5.564 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.416 0.549 6.915 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.418 1.813 4.727 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.819 1.863 5.506 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.110 0.759 4.141 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.899 -0.067 5.003 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.634 -1.158 4.390 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.418 -1.494 5.952 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.037 -2.650 8.456 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.127 -3.725 8.832 1.00 0.00 C ATOM 2709 C GLY B 78 -2.894 -4.896 9.448 1.00 0.00 C ATOM 2710 O GLY B 78 -2.799 -6.032 8.983 1.00 0.00 O ATOM 0 H GLY B 78 -2.788 -1.741 8.847 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.578 -4.066 7.955 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.391 -3.352 9.544 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.685 -4.623 10.488 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.517 -5.645 11.112 1.00 0.00 C ATOM 2716 C ALA B 79 -5.452 -6.314 10.097 1.00 0.00 C ATOM 2717 O ALA B 79 -5.604 -7.530 10.101 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.296 -5.053 12.291 1.00 0.00 C ATOM 0 H ALA B 79 -3.764 -3.700 10.914 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.860 -6.426 11.496 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -5.912 -5.828 12.746 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -4.596 -4.665 13.031 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -5.934 -4.244 11.936 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.065 -5.534 9.206 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.981 -6.016 8.184 1.00 0.00 C ATOM 2726 C LEU B 80 -6.253 -6.992 7.262 1.00 0.00 C ATOM 2727 O LEU B 80 -6.745 -8.081 6.980 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.556 -4.826 7.399 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.872 -5.147 6.677 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -10.024 -5.393 7.660 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -9.249 -3.962 5.783 1.00 0.00 C ATOM 0 H LEU B 80 -5.931 -4.523 9.179 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.812 -6.545 8.651 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.720 -3.994 8.084 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.820 -4.495 6.666 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.718 -6.055 6.095 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -10.935 -5.616 7.105 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.777 -6.235 8.306 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.179 -4.502 8.269 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -10.183 -4.180 5.265 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.373 -3.069 6.396 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -8.459 -3.793 5.051 1.00 0.00 H new ATOM 2743 N ALA B 81 -5.054 -6.612 6.820 1.00 0.00 N ATOM 2744 CA ALA B 81 -4.195 -7.473 6.027 1.00 0.00 C ATOM 2745 C ALA B 81 -3.879 -8.760 6.791 1.00 0.00 C ATOM 2746 O ALA B 81 -3.913 -9.843 6.214 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.926 -6.715 5.640 1.00 0.00 C ATOM 0 H ALA B 81 -4.655 -5.692 7.006 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.710 -7.760 5.110 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.282 -7.363 5.045 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.192 -5.833 5.057 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.397 -6.407 6.542 1.00 0.00 H new ATOM 2753 N MET B 82 -3.592 -8.656 8.091 1.00 0.00 N ATOM 2754 CA MET B 82 -3.349 -9.832 8.915 1.00 0.00 C ATOM 2755 C MET B 82 -4.587 -10.734 8.988 1.00 0.00 C ATOM 2756 O MET B 82 -4.468 -11.955 8.880 1.00 0.00 O ATOM 2757 CB MET B 82 -2.815 -9.411 10.291 1.00 0.00 C ATOM 2758 CG MET B 82 -2.188 -10.591 11.040 1.00 0.00 C ATOM 2759 SD MET B 82 -1.322 -10.125 12.559 1.00 0.00 S ATOM 2760 CE MET B 82 -0.644 -11.728 13.042 1.00 0.00 C ATOM 0 H MET B 82 -3.523 -7.769 8.590 1.00 0.00 H new ATOM 0 HA MET B 82 -2.576 -10.442 8.448 1.00 0.00 H new ATOM 0 HB2 MET B 82 -2.073 -8.622 10.168 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.628 -8.993 10.885 1.00 0.00 H new ATOM 0 HG2 MET B 82 -2.971 -11.309 11.286 1.00 0.00 H new ATOM 0 HG3 MET B 82 -1.488 -11.098 10.376 1.00 0.00 H new ATOM 0 HE1 MET B 82 -0.077 -11.620 13.966 1.00 0.00 H new ATOM 0 HE2 MET B 82 -1.458 -12.436 13.197 1.00 0.00 H new ATOM 0 HE3 MET B 82 0.013 -12.097 12.254 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.770 -10.137 9.153 1.00 0.00 N ATOM 2771 CA ILE B 83 -7.045 -10.842 9.123 1.00 0.00 C ATOM 2772 C ILE B 83 -7.225 -11.521 7.762 1.00 0.00 C ATOM 2773 O ILE B 83 -7.659 -12.672 7.706 1.00 0.00 O ATOM 2774 CB ILE B 83 -8.198 -9.888 9.499 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -8.094 -9.532 10.996 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.568 -10.520 9.206 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -8.929 -8.305 11.379 1.00 0.00 C ATOM 0 H ILE B 83 -5.866 -9.134 9.313 1.00 0.00 H new ATOM 0 HA ILE B 83 -7.057 -11.633 9.873 1.00 0.00 H new ATOM 0 HB ILE B 83 -8.111 -8.986 8.893 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -8.419 -10.386 11.590 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -7.050 -9.347 11.248 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.358 -9.821 9.483 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.643 -10.750 8.143 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.677 -11.438 9.784 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -8.814 -8.105 12.444 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.588 -7.441 10.809 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -9.979 -8.495 11.156 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.846 -10.858 6.664 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.769 -11.473 5.340 1.00 0.00 C ATOM 2791 C TYR B 84 -5.574 -12.435 5.269 1.00 0.00 C ATOM 2792 O TYR B 84 -4.726 -12.323 4.385 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.642 -10.396 4.248 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.679 -9.287 4.199 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.984 -9.472 4.693 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.353 -8.096 3.523 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.957 -8.475 4.504 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.328 -7.102 3.328 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.635 -7.301 3.804 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.592 -6.353 3.595 1.00 0.00 O ATOM 0 H TYR B 84 -6.583 -9.873 6.672 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.687 -12.035 5.170 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.663 -9.929 4.355 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.651 -10.901 3.282 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -9.238 -10.381 5.218 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.350 -7.945 3.153 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.953 -8.612 4.898 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -8.073 -6.187 2.813 1.00 0.00 H new ATOM 0 HH TYR B 84 -10.206 -5.603 3.096 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.502 -13.414 6.175 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.318 -14.245 6.336 1.00 0.00 C ATOM 2812 C ASN B 85 -3.937 -14.956 5.040 1.00 0.00 C ATOM 2813 O ASN B 85 -2.757 -15.109 4.743 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.504 -15.257 7.468 1.00 0.00 C ATOM 2815 CG ASN B 85 -3.182 -15.975 7.705 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -3.010 -17.129 7.325 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -2.225 -15.273 8.300 1.00 0.00 N ATOM 0 H ASN B 85 -6.263 -13.648 6.813 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.497 -13.578 6.599 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.827 -14.751 8.378 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -5.282 -15.975 7.209 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -1.308 -15.691 8.455 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -2.407 -14.316 8.602 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.938 -15.356 4.250 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.742 -15.931 2.926 1.00 0.00 C ATOM 2826 C GLU B 86 -3.784 -15.084 2.077 1.00 0.00 C ATOM 2827 O GLU B 86 -2.950 -15.631 1.361 1.00 0.00 O ATOM 2828 CB GLU B 86 -6.096 -16.088 2.224 1.00 0.00 C ATOM 2829 CG GLU B 86 -7.026 -17.046 2.981 1.00 0.00 C ATOM 2830 CD GLU B 86 -8.343 -17.234 2.236 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -9.172 -16.301 2.313 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -8.490 -18.297 1.597 1.00 0.00 O ATOM 0 H GLU B 86 -5.919 -15.286 4.521 1.00 0.00 H new ATOM 0 HA GLU B 86 -4.284 -16.913 3.045 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.574 -15.112 2.135 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.939 -16.459 1.211 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -6.535 -18.011 3.107 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -7.222 -16.655 3.979 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.888 -13.753 2.161 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.944 -12.869 1.498 1.00 0.00 C ATOM 2841 C ALA B 87 -1.554 -13.064 2.102 1.00 0.00 C ATOM 2842 O ALA B 87 -0.597 -13.313 1.373 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.404 -11.411 1.602 1.00 0.00 C ATOM 0 H ALA B 87 -4.620 -13.271 2.684 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.898 -13.118 0.438 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.684 -10.765 1.099 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.380 -11.303 1.129 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.476 -11.126 2.652 1.00 0.00 H new ATOM 2849 N LEU B 88 -1.445 -12.981 3.435 1.00 0.00 N ATOM 2850 CA LEU B 88 -0.168 -13.153 4.120 1.00 0.00 C ATOM 2851 C LEU B 88 0.521 -14.458 3.737 1.00 0.00 C ATOM 2852 O LEU B 88 1.738 -14.468 3.603 1.00 0.00 O ATOM 2853 CB LEU B 88 -0.279 -13.092 5.648 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.804 -11.792 6.273 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -0.243 -11.721 7.701 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.390 -10.532 5.514 1.00 0.00 C ATOM 0 H LEU B 88 -2.232 -12.795 4.057 1.00 0.00 H new ATOM 0 HA LEU B 88 0.432 -12.307 3.786 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.929 -13.906 5.970 1.00 0.00 H new ATOM 0 HB3 LEU B 88 0.709 -13.289 6.064 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.893 -11.819 6.244 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.593 -10.809 8.184 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.584 -12.586 8.269 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.846 -11.718 7.664 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.798 -9.655 6.015 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.698 -10.463 5.490 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.774 -10.579 4.495 1.00 0.00 H new ATOM 2868 N LYS B 89 -0.225 -15.557 3.576 1.00 0.00 N ATOM 2869 CA LYS B 89 0.353 -16.824 3.136 1.00 0.00 C ATOM 2870 C LYS B 89 1.209 -16.637 1.876 1.00 0.00 C ATOM 2871 O LYS B 89 2.256 -17.272 1.753 1.00 0.00 O ATOM 2872 CB LYS B 89 -0.731 -17.885 2.898 1.00 0.00 C ATOM 2873 CG LYS B 89 -1.506 -18.248 4.170 1.00 0.00 C ATOM 2874 CD LYS B 89 -2.459 -19.415 3.881 1.00 0.00 C ATOM 2875 CE LYS B 89 -3.487 -19.617 5.002 1.00 0.00 C ATOM 2876 NZ LYS B 89 -2.851 -19.784 6.320 1.00 0.00 N ATOM 0 H LYS B 89 -1.230 -15.591 3.745 1.00 0.00 H new ATOM 0 HA LYS B 89 1.000 -17.179 3.938 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -1.430 -17.519 2.146 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -0.268 -18.785 2.493 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -0.812 -18.521 4.965 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -2.070 -17.384 4.523 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -2.980 -19.232 2.941 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -1.881 -20.330 3.752 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -4.161 -18.761 5.032 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -4.095 -20.494 4.781 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -3.384 -20.482 6.877 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -1.873 -20.116 6.194 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -2.846 -18.873 6.821 1.00 0.00 H new ATOM 2890 N GLY B 90 0.784 -15.764 0.957 1.00 0.00 N ATOM 2891 CA GLY B 90 1.558 -15.420 -0.223 1.00 0.00 C ATOM 2892 C GLY B 90 2.755 -14.551 0.161 1.00 0.00 C ATOM 2893 O GLY B 90 2.589 -13.312 0.151 1.00 0.00 O ATOM 2894 OXT GLY B 90 3.822 -15.139 0.449 1.00 0.00 O ATOM 0 H GLY B 90 -0.111 -15.278 1.018 1.00 0.00 H new ATOM 0 HA2 GLY B 90 1.903 -16.328 -0.717 1.00 0.00 H new ATOM 0 HA3 GLY B 90 0.928 -14.889 -0.937 1.00 0.00 H new