USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1205 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: B 28 THR OG1 : rot -80:sc= 1.52 USER MOD Set 1.2: B 30 SER OG : rot -58:sc= 0.433 USER MOD Set 2.1: B 27 HIS : no HE2:sc= 0.896 K(o=1.2,f=-6.9!) USER MOD Set 2.2: B 69 ASN : amide:sc= 0.261 K(o=1.2,f=-4.8!) USER MOD Set 3.1: B 18 LYS NZ :NH3+ 143:sc= 0.89 (180deg=-0.927) USER MOD Set 3.2: B 19 TYR OH : rot 180:sc= 0.222 USER MOD Set 4.1: A 17 HIS : no HE2:sc= 1.22 K(o=2.3,f=-9.2!) USER MOD Set 4.2: A 27 HIS : no HE2:sc= 1.08 K(o=2.3,f=-13!) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot -160:sc= 1.13 USER MOD Single : A 20 SER OG : rot 81:sc= 0.966 USER MOD Single : A 22 LYS NZ :NH3+ 148:sc= 1.36 (180deg=0.921) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -62:sc= 1.16 USER MOD Single : A 31 LYS NZ :NH3+ 175:sc=-0.00364 (180deg=-0.0358) USER MOD Single : A 32 LYS NZ :NH3+ -124:sc= 0.00371 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= -1.09 X(o=-1.1,f=-1.3) USER MOD Single : A 40 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0189) USER MOD Single : A 55 LYS NZ :NH3+ -173:sc=-0.00345 (180deg=-0.0758) USER MOD Single : A 57 MET CE :methyl 179:sc= 0 (180deg=-0.00161) USER MOD Single : A 63 ASN : amide:sc= 0.782 K(o=0.78,f=-0.051) USER MOD Single : A 64 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0577) USER MOD Single : A 66 GLN : amide:sc= -2.26! C(o=-2.3!,f=-2.3!) USER MOD Single : A 69 ASN : amide:sc=-0.000154 K(o=-0.00015,f=-1.7) USER MOD Single : A 71 GLN : amide:sc= 0.765 K(o=0.77,f=-0.057) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 72:sc= 0.941 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot -172:sc= 1.23 USER MOD Single : A 85 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : B 3 SER OG : rot 27:sc= 0.193 USER MOD Single : B 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 HIS : no HE2:sc= 0.953 K(o=0.95,f=-4.2!) USER MOD Single : B 20 SER OG : rot -54:sc=0.000508 USER MOD Single : B 22 LYS NZ :NH3+ -176:sc= 0.325 (180deg=0.317) USER MOD Single : B 26 LYS NZ :NH3+ -166:sc= 1.39 (180deg=1.05) USER MOD Single : B 31 LYS NZ :NH3+ 147:sc= 0.879 (180deg=0.249) USER MOD Single : B 32 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00831) USER MOD Single : B 35 LYS NZ :NH3+ -156:sc= -0.249 (180deg=-0.689) USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 63 ASN : amide:sc= 0 X(o=0,f=-0.0058) USER MOD Single : B 64 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0559) USER MOD Single : B 66 GLN : amide:sc= 0.69 K(o=0.69,f=-0.0023) USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 73 TYR OH : rot 180:sc= 0 USER MOD Single : B 75 THR OG1 : rot 72:sc= 1 USER MOD Single : B 82 MET CE :methyl -167:sc= -0.0549 (180deg=-0.275) USER MOD Single : B 84 TYR OH : rot 117:sc= 1.02 USER MOD Single : B 85 ASN : amide:sc= 0.944 K(o=0.94,f=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -14.172 10.229 4.206 1.00 0.00 N ATOM 31 CA SER A 3 -15.259 9.539 4.896 1.00 0.00 C ATOM 32 C SER A 3 -14.962 8.035 5.024 1.00 0.00 C ATOM 33 O SER A 3 -14.710 7.578 6.138 1.00 0.00 O ATOM 34 CB SER A 3 -16.636 9.825 4.265 1.00 0.00 C ATOM 35 OG SER A 3 -17.220 10.976 4.836 1.00 0.00 O ATOM 0 HA SER A 3 -15.315 9.944 5.907 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.526 9.963 3.189 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.293 8.968 4.411 1.00 0.00 H new ATOM 0 HG SER A 3 -18.092 11.141 4.420 1.00 0.00 H new ATOM 41 N PRO A 4 -14.946 7.245 3.935 1.00 0.00 N ATOM 42 CA PRO A 4 -14.894 5.786 4.020 1.00 0.00 C ATOM 43 C PRO A 4 -13.495 5.233 4.340 1.00 0.00 C ATOM 44 O PRO A 4 -13.098 4.201 3.804 1.00 0.00 O ATOM 45 CB PRO A 4 -15.406 5.310 2.653 1.00 0.00 C ATOM 46 CG PRO A 4 -14.901 6.403 1.714 1.00 0.00 C ATOM 47 CD PRO A 4 -15.138 7.657 2.551 1.00 0.00 C ATOM 0 HA PRO A 4 -15.499 5.419 4.849 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -15.007 4.331 2.388 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -16.493 5.227 2.633 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -13.849 6.272 1.460 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -15.455 6.426 0.775 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -14.441 8.449 2.277 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -16.143 8.049 2.394 1.00 0.00 H new ATOM 55 N LEU A 5 -12.745 5.871 5.241 1.00 0.00 N ATOM 56 CA LEU A 5 -11.413 5.412 5.610 1.00 0.00 C ATOM 57 C LEU A 5 -11.540 4.062 6.310 1.00 0.00 C ATOM 58 O LEU A 5 -11.027 3.051 5.835 1.00 0.00 O ATOM 59 CB LEU A 5 -10.715 6.441 6.510 1.00 0.00 C ATOM 60 CG LEU A 5 -10.100 7.621 5.741 1.00 0.00 C ATOM 61 CD1 LEU A 5 -11.145 8.508 5.051 1.00 0.00 C ATOM 62 CD2 LEU A 5 -9.295 8.472 6.725 1.00 0.00 C ATOM 0 H LEU A 5 -13.045 6.714 5.730 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.800 5.298 4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -11.435 6.826 7.232 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -9.930 5.941 7.078 1.00 0.00 H new ATOM 0 HG LEU A 5 -9.471 7.205 4.954 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -10.643 9.321 4.527 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.713 7.912 4.337 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.822 8.921 5.799 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -8.850 9.316 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.954 8.842 7.510 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.506 7.865 7.170 1.00 0.00 H new ATOM 74 N ASP A 6 -12.259 4.038 7.435 1.00 0.00 N ATOM 75 CA ASP A 6 -12.456 2.813 8.193 1.00 0.00 C ATOM 76 C ASP A 6 -13.121 1.739 7.338 1.00 0.00 C ATOM 77 O ASP A 6 -12.750 0.571 7.414 1.00 0.00 O ATOM 78 CB ASP A 6 -13.261 3.094 9.464 1.00 0.00 C ATOM 79 CG ASP A 6 -13.485 1.810 10.257 1.00 0.00 C ATOM 80 OD1 ASP A 6 -12.520 1.380 10.923 1.00 0.00 O ATOM 81 OD2 ASP A 6 -14.614 1.281 10.170 1.00 0.00 O ATOM 0 H ASP A 6 -12.713 4.858 7.837 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.479 2.432 8.490 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -12.733 3.821 10.081 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -14.222 3.537 9.201 1.00 0.00 H new ATOM 86 N GLN A 7 -14.077 2.139 6.496 1.00 0.00 N ATOM 87 CA GLN A 7 -14.688 1.235 5.536 1.00 0.00 C ATOM 88 C GLN A 7 -13.613 0.615 4.639 1.00 0.00 C ATOM 89 O GLN A 7 -13.608 -0.597 4.438 1.00 0.00 O ATOM 90 CB GLN A 7 -15.746 1.969 4.703 1.00 0.00 C ATOM 91 CG GLN A 7 -16.888 2.518 5.568 1.00 0.00 C ATOM 92 CD GLN A 7 -17.913 3.262 4.719 1.00 0.00 C ATOM 93 OE1 GLN A 7 -18.019 4.481 4.790 1.00 0.00 O ATOM 94 NE2 GLN A 7 -18.671 2.539 3.900 1.00 0.00 N ATOM 0 H GLN A 7 -14.442 3.091 6.465 1.00 0.00 H new ATOM 0 HA GLN A 7 -15.188 0.431 6.077 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -15.275 2.790 4.163 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -16.154 1.288 3.956 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -17.375 1.698 6.095 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -16.484 3.189 6.326 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -18.559 1.526 3.863 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -19.364 2.998 3.309 1.00 0.00 H new ATOM 103 N ALA A 8 -12.693 1.432 4.114 1.00 0.00 N ATOM 104 CA ALA A 8 -11.637 0.950 3.233 1.00 0.00 C ATOM 105 C ALA A 8 -10.751 -0.046 3.977 1.00 0.00 C ATOM 106 O ALA A 8 -10.536 -1.156 3.490 1.00 0.00 O ATOM 107 CB ALA A 8 -10.820 2.117 2.668 1.00 0.00 C ATOM 0 H ALA A 8 -12.664 2.436 4.289 1.00 0.00 H new ATOM 0 HA ALA A 8 -12.092 0.435 2.387 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -10.038 1.731 2.014 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -11.475 2.778 2.100 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -10.365 2.673 3.488 1.00 0.00 H new ATOM 113 N ILE A 9 -10.259 0.338 5.161 1.00 0.00 N ATOM 114 CA ILE A 9 -9.444 -0.538 5.998 1.00 0.00 C ATOM 115 C ILE A 9 -10.174 -1.866 6.227 1.00 0.00 C ATOM 116 O ILE A 9 -9.626 -2.931 5.950 1.00 0.00 O ATOM 117 CB ILE A 9 -9.090 0.154 7.332 1.00 0.00 C ATOM 118 CG1 ILE A 9 -8.285 1.458 7.160 1.00 0.00 C ATOM 119 CG2 ILE A 9 -8.337 -0.801 8.270 1.00 0.00 C ATOM 120 CD1 ILE A 9 -6.939 1.295 6.451 1.00 0.00 C ATOM 0 H ILE A 9 -10.416 1.263 5.561 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.506 -0.750 5.485 1.00 0.00 H new ATOM 0 HB ILE A 9 -10.046 0.428 7.778 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.890 2.170 6.600 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -8.111 1.893 8.144 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.101 -0.286 9.201 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.961 -1.669 8.483 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -7.413 -1.127 7.792 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.447 2.265 6.377 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.309 0.611 7.019 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.101 0.893 5.451 1.00 0.00 H new ATOM 132 N GLY A 10 -11.410 -1.793 6.728 1.00 0.00 N ATOM 133 CA GLY A 10 -12.237 -2.947 7.038 1.00 0.00 C ATOM 134 C GLY A 10 -12.385 -3.865 5.829 1.00 0.00 C ATOM 135 O GLY A 10 -12.081 -5.055 5.909 1.00 0.00 O ATOM 0 H GLY A 10 -11.868 -0.905 6.932 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -11.795 -3.501 7.866 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -13.221 -2.614 7.367 1.00 0.00 H new ATOM 139 N LEU A 11 -12.844 -3.310 4.703 1.00 0.00 N ATOM 140 CA LEU A 11 -13.025 -4.068 3.473 1.00 0.00 C ATOM 141 C LEU A 11 -11.699 -4.733 3.102 1.00 0.00 C ATOM 142 O LEU A 11 -11.655 -5.940 2.887 1.00 0.00 O ATOM 143 CB LEU A 11 -13.541 -3.150 2.349 1.00 0.00 C ATOM 144 CG LEU A 11 -14.325 -3.855 1.223 1.00 0.00 C ATOM 145 CD1 LEU A 11 -13.661 -5.132 0.695 1.00 0.00 C ATOM 146 CD2 LEU A 11 -15.760 -4.176 1.661 1.00 0.00 C ATOM 0 H LEU A 11 -13.098 -2.325 4.624 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.774 -4.846 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -14.182 -2.388 2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.690 -2.633 1.906 1.00 0.00 H new ATOM 0 HG LEU A 11 -14.332 -3.139 0.401 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -14.278 -5.564 -0.093 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -12.676 -4.891 0.295 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -13.556 -5.851 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -16.287 -4.672 0.846 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -15.737 -4.832 2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -16.277 -3.252 1.918 1.00 0.00 H new ATOM 158 N LEU A 12 -10.615 -3.955 3.048 1.00 0.00 N ATOM 159 CA LEU A 12 -9.304 -4.434 2.639 1.00 0.00 C ATOM 160 C LEU A 12 -8.846 -5.609 3.508 1.00 0.00 C ATOM 161 O LEU A 12 -8.533 -6.686 2.994 1.00 0.00 O ATOM 162 CB LEU A 12 -8.305 -3.271 2.689 1.00 0.00 C ATOM 163 CG LEU A 12 -6.905 -3.647 2.182 1.00 0.00 C ATOM 164 CD1 LEU A 12 -6.902 -3.839 0.660 1.00 0.00 C ATOM 165 CD2 LEU A 12 -5.932 -2.533 2.574 1.00 0.00 C ATOM 0 H LEU A 12 -10.629 -2.964 3.291 1.00 0.00 H new ATOM 0 HA LEU A 12 -9.361 -4.806 1.616 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.690 -2.445 2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.227 -2.912 3.715 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.600 -4.591 2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.898 -4.105 0.329 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.595 -4.637 0.393 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.211 -2.913 0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -4.931 -2.783 2.222 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -6.252 -1.594 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -5.919 -2.427 3.659 1.00 0.00 H new ATOM 177 N ILE A 13 -8.776 -5.412 4.828 1.00 0.00 N ATOM 178 CA ILE A 13 -8.283 -6.461 5.708 1.00 0.00 C ATOM 179 C ILE A 13 -9.221 -7.671 5.649 1.00 0.00 C ATOM 180 O ILE A 13 -8.754 -8.805 5.572 1.00 0.00 O ATOM 181 CB ILE A 13 -8.011 -5.931 7.132 1.00 0.00 C ATOM 182 CG1 ILE A 13 -7.146 -6.896 7.961 1.00 0.00 C ATOM 183 CG2 ILE A 13 -9.298 -5.651 7.918 1.00 0.00 C ATOM 184 CD1 ILE A 13 -5.701 -7.023 7.463 1.00 0.00 C ATOM 0 H ILE A 13 -9.050 -4.550 5.299 1.00 0.00 H new ATOM 0 HA ILE A 13 -7.310 -6.806 5.357 1.00 0.00 H new ATOM 0 HB ILE A 13 -7.473 -4.995 6.979 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -7.134 -6.558 8.997 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.610 -7.882 7.953 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -9.044 -5.281 8.911 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -9.890 -4.902 7.392 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -9.875 -6.571 8.010 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -5.157 -7.721 8.099 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.701 -7.392 6.437 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -5.217 -6.047 7.498 1.00 0.00 H new ATOM 196 N GLY A 14 -10.537 -7.433 5.625 1.00 0.00 N ATOM 197 CA GLY A 14 -11.537 -8.481 5.511 1.00 0.00 C ATOM 198 C GLY A 14 -11.325 -9.326 4.256 1.00 0.00 C ATOM 199 O GLY A 14 -11.205 -10.548 4.335 1.00 0.00 O ATOM 0 H GLY A 14 -10.934 -6.495 5.685 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.496 -9.121 6.392 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.531 -8.035 5.486 1.00 0.00 H new ATOM 203 N ILE A 15 -11.283 -8.696 3.081 1.00 0.00 N ATOM 204 CA ILE A 15 -11.153 -9.428 1.832 1.00 0.00 C ATOM 205 C ILE A 15 -9.780 -10.097 1.741 1.00 0.00 C ATOM 206 O ILE A 15 -9.683 -11.201 1.216 1.00 0.00 O ATOM 207 CB ILE A 15 -11.519 -8.563 0.613 1.00 0.00 C ATOM 208 CG1 ILE A 15 -11.823 -9.476 -0.586 1.00 0.00 C ATOM 209 CG2 ILE A 15 -10.427 -7.544 0.260 1.00 0.00 C ATOM 210 CD1 ILE A 15 -12.419 -8.702 -1.760 1.00 0.00 C ATOM 0 H ILE A 15 -11.337 -7.683 2.974 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.885 -10.235 1.822 1.00 0.00 H new ATOM 0 HB ILE A 15 -12.405 -7.983 0.870 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -10.906 -9.971 -0.906 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -12.517 -10.259 -0.279 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -10.739 -6.962 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.265 -6.876 1.106 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -9.500 -8.069 0.030 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -12.618 -9.387 -2.584 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -13.350 -8.229 -1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -11.715 -7.937 -2.086 1.00 0.00 H new ATOM 222 N PHE A 16 -8.726 -9.477 2.283 1.00 0.00 N ATOM 223 CA PHE A 16 -7.429 -10.136 2.393 1.00 0.00 C ATOM 224 C PHE A 16 -7.537 -11.424 3.209 1.00 0.00 C ATOM 225 O PHE A 16 -7.140 -12.500 2.749 1.00 0.00 O ATOM 226 CB PHE A 16 -6.397 -9.184 3.010 1.00 0.00 C ATOM 227 CG PHE A 16 -5.090 -9.863 3.369 1.00 0.00 C ATOM 228 CD1 PHE A 16 -4.276 -10.381 2.346 1.00 0.00 C ATOM 229 CD2 PHE A 16 -4.810 -10.184 4.713 1.00 0.00 C ATOM 230 CE1 PHE A 16 -3.174 -11.193 2.664 1.00 0.00 C ATOM 231 CE2 PHE A 16 -3.694 -10.976 5.032 1.00 0.00 C ATOM 232 CZ PHE A 16 -2.868 -11.470 4.008 1.00 0.00 C ATOM 0 H PHE A 16 -8.749 -8.525 2.649 1.00 0.00 H new ATOM 0 HA PHE A 16 -7.095 -10.404 1.391 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -6.196 -8.374 2.309 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -6.821 -8.732 3.907 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.498 -10.154 1.314 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.455 -9.820 5.499 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.562 -11.605 1.875 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -3.471 -11.205 6.064 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.999 -12.062 4.253 1.00 0.00 H new ATOM 242 N HIS A 17 -8.087 -11.300 4.419 1.00 0.00 N ATOM 243 CA HIS A 17 -8.376 -12.422 5.291 1.00 0.00 C ATOM 244 C HIS A 17 -9.156 -13.491 4.530 1.00 0.00 C ATOM 245 O HIS A 17 -8.835 -14.672 4.628 1.00 0.00 O ATOM 246 CB HIS A 17 -9.127 -11.929 6.542 1.00 0.00 C ATOM 247 CG HIS A 17 -10.002 -12.970 7.192 1.00 0.00 C ATOM 248 ND1 HIS A 17 -9.577 -14.153 7.748 1.00 0.00 N ATOM 249 CD2 HIS A 17 -11.372 -12.979 7.204 1.00 0.00 C ATOM 250 CE1 HIS A 17 -10.668 -14.853 8.100 1.00 0.00 C ATOM 251 NE2 HIS A 17 -11.787 -14.178 7.790 1.00 0.00 N ATOM 0 H HIS A 17 -8.345 -10.398 4.820 1.00 0.00 H new ATOM 0 HA HIS A 17 -7.445 -12.880 5.626 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -8.399 -11.576 7.272 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -9.744 -11.073 6.267 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -8.608 -14.446 7.871 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -12.017 -12.198 6.828 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -10.648 -15.826 8.568 1.00 0.00 H new ATOM 259 N LYS A 18 -10.169 -13.080 3.767 1.00 0.00 N ATOM 260 CA LYS A 18 -11.040 -14.013 3.071 1.00 0.00 C ATOM 261 C LYS A 18 -10.252 -14.746 1.986 1.00 0.00 C ATOM 262 O LYS A 18 -10.236 -15.975 1.945 1.00 0.00 O ATOM 263 CB LYS A 18 -12.254 -13.264 2.505 1.00 0.00 C ATOM 264 CG LYS A 18 -13.314 -14.231 1.966 1.00 0.00 C ATOM 265 CD LYS A 18 -14.524 -13.445 1.446 1.00 0.00 C ATOM 266 CE LYS A 18 -15.594 -14.403 0.914 1.00 0.00 C ATOM 267 NZ LYS A 18 -16.770 -13.670 0.415 1.00 0.00 N ATOM 0 H LYS A 18 -10.404 -12.099 3.618 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.415 -14.765 3.765 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.693 -12.640 3.284 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.930 -12.596 1.706 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.892 -14.837 1.164 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.626 -14.917 2.753 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -14.940 -12.833 2.247 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -14.211 -12.764 0.655 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -15.175 -15.010 0.112 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -15.899 -15.087 1.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -17.476 -14.346 0.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -17.183 -13.110 1.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -16.482 -13.036 -0.357 1.00 0.00 H new ATOM 281 N TYR A 19 -9.608 -13.989 1.094 1.00 0.00 N ATOM 282 CA TYR A 19 -8.917 -14.539 -0.058 1.00 0.00 C ATOM 283 C TYR A 19 -7.787 -15.463 0.384 1.00 0.00 C ATOM 284 O TYR A 19 -7.591 -16.521 -0.208 1.00 0.00 O ATOM 285 CB TYR A 19 -8.423 -13.423 -0.987 1.00 0.00 C ATOM 286 CG TYR A 19 -8.080 -13.926 -2.376 1.00 0.00 C ATOM 287 CD1 TYR A 19 -9.116 -14.203 -3.288 1.00 0.00 C ATOM 288 CD2 TYR A 19 -6.747 -14.210 -2.731 1.00 0.00 C ATOM 289 CE1 TYR A 19 -8.825 -14.790 -4.531 1.00 0.00 C ATOM 290 CE2 TYR A 19 -6.455 -14.731 -4.004 1.00 0.00 C ATOM 291 CZ TYR A 19 -7.498 -15.084 -4.873 1.00 0.00 C ATOM 292 OH TYR A 19 -7.237 -15.787 -6.006 1.00 0.00 O ATOM 0 H TYR A 19 -9.555 -12.972 1.158 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.622 -15.140 -0.632 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -9.191 -12.653 -1.063 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -7.543 -12.953 -0.548 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -10.137 -13.964 -3.032 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.950 -14.028 -2.026 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -9.624 -15.015 -5.223 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -5.428 -14.859 -4.313 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.338 -16.173 -5.951 1.00 0.00 H new ATOM 302 N SER A 20 -7.059 -15.080 1.438 1.00 0.00 N ATOM 303 CA SER A 20 -6.102 -15.977 2.058 1.00 0.00 C ATOM 304 C SER A 20 -6.831 -17.197 2.641 1.00 0.00 C ATOM 305 O SER A 20 -6.659 -18.317 2.163 1.00 0.00 O ATOM 306 CB SER A 20 -5.290 -15.221 3.118 1.00 0.00 C ATOM 307 OG SER A 20 -4.784 -14.013 2.582 1.00 0.00 O ATOM 0 H SER A 20 -7.120 -14.159 1.871 1.00 0.00 H new ATOM 0 HA SER A 20 -5.399 -16.345 1.311 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.918 -15.008 3.983 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.467 -15.844 3.468 1.00 0.00 H new ATOM 0 HG SER A 20 -5.483 -13.327 2.605 1.00 0.00 H new ATOM 313 N GLY A 21 -7.664 -16.968 3.661 1.00 0.00 N ATOM 314 CA GLY A 21 -8.317 -17.984 4.477 1.00 0.00 C ATOM 315 C GLY A 21 -9.042 -19.053 3.663 1.00 0.00 C ATOM 316 O GLY A 21 -9.061 -20.215 4.063 1.00 0.00 O ATOM 0 H GLY A 21 -7.910 -16.021 3.950 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.570 -18.465 5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.032 -17.499 5.142 1.00 0.00 H new ATOM 320 N LYS A 22 -9.619 -18.668 2.520 1.00 0.00 N ATOM 321 CA LYS A 22 -10.212 -19.563 1.532 1.00 0.00 C ATOM 322 C LYS A 22 -9.390 -20.842 1.317 1.00 0.00 C ATOM 323 O LYS A 22 -9.973 -21.904 1.104 1.00 0.00 O ATOM 324 CB LYS A 22 -10.406 -18.774 0.224 1.00 0.00 C ATOM 325 CG LYS A 22 -10.553 -19.651 -1.031 1.00 0.00 C ATOM 326 CD LYS A 22 -11.039 -18.873 -2.263 1.00 0.00 C ATOM 327 CE LYS A 22 -10.283 -17.562 -2.525 1.00 0.00 C ATOM 328 NZ LYS A 22 -8.821 -17.743 -2.577 1.00 0.00 N ATOM 0 H LYS A 22 -9.686 -17.686 2.251 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.177 -19.909 1.902 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.292 -18.147 0.320 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.556 -18.105 0.088 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.592 -20.113 -1.258 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.253 -20.459 -0.821 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.947 -19.513 -3.141 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -12.099 -18.649 -2.141 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.625 -17.134 -3.467 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.528 -16.845 -1.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -8.410 -17.058 -3.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.418 -17.591 -1.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.602 -18.709 -2.895 1.00 0.00 H new ATOM 342 N GLU A 23 -8.055 -20.746 1.312 1.00 0.00 N ATOM 343 CA GLU A 23 -7.194 -21.878 0.979 1.00 0.00 C ATOM 344 C GLU A 23 -5.824 -21.764 1.661 1.00 0.00 C ATOM 345 O GLU A 23 -5.270 -22.752 2.145 1.00 0.00 O ATOM 346 CB GLU A 23 -7.102 -21.968 -0.553 1.00 0.00 C ATOM 347 CG GLU A 23 -6.237 -23.137 -1.035 1.00 0.00 C ATOM 348 CD GLU A 23 -6.242 -23.255 -2.557 1.00 0.00 C ATOM 349 OE1 GLU A 23 -6.264 -22.195 -3.219 1.00 0.00 O ATOM 350 OE2 GLU A 23 -6.201 -24.410 -3.034 1.00 0.00 O ATOM 0 H GLU A 23 -7.549 -19.889 1.537 1.00 0.00 H new ATOM 0 HA GLU A 23 -7.620 -22.806 1.359 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -8.105 -22.072 -0.966 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.692 -21.036 -0.942 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.214 -23.001 -0.684 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -6.604 -24.065 -0.597 1.00 0.00 H new ATOM 357 N GLY A 24 -5.270 -20.555 1.718 1.00 0.00 N ATOM 358 CA GLY A 24 -4.046 -20.272 2.434 1.00 0.00 C ATOM 359 C GLY A 24 -4.301 -20.331 3.932 1.00 0.00 C ATOM 360 O GLY A 24 -4.499 -19.295 4.563 1.00 0.00 O ATOM 0 H GLY A 24 -5.671 -19.738 1.258 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.277 -20.994 2.158 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.672 -19.286 2.158 1.00 0.00 H new ATOM 364 N ASP A 25 -4.250 -21.532 4.514 1.00 0.00 N ATOM 365 CA ASP A 25 -4.281 -21.736 5.964 1.00 0.00 C ATOM 366 C ASP A 25 -3.232 -20.871 6.681 1.00 0.00 C ATOM 367 O ASP A 25 -3.489 -20.330 7.754 1.00 0.00 O ATOM 368 CB ASP A 25 -4.063 -23.220 6.276 1.00 0.00 C ATOM 369 CG ASP A 25 -4.039 -23.466 7.782 1.00 0.00 C ATOM 370 OD1 ASP A 25 -5.142 -23.514 8.367 1.00 0.00 O ATOM 371 OD2 ASP A 25 -2.917 -23.598 8.316 1.00 0.00 O ATOM 0 H ASP A 25 -4.185 -22.401 3.984 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.259 -21.428 6.334 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.857 -23.811 5.820 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.124 -23.554 5.835 1.00 0.00 H new ATOM 376 N LYS A 26 -2.059 -20.712 6.056 1.00 0.00 N ATOM 377 CA LYS A 26 -0.982 -19.829 6.500 1.00 0.00 C ATOM 378 C LYS A 26 -1.438 -18.364 6.638 1.00 0.00 C ATOM 379 O LYS A 26 -0.758 -17.556 7.261 1.00 0.00 O ATOM 380 CB LYS A 26 0.188 -19.980 5.512 1.00 0.00 C ATOM 381 CG LYS A 26 1.420 -19.106 5.791 1.00 0.00 C ATOM 382 CD LYS A 26 1.990 -19.304 7.202 1.00 0.00 C ATOM 383 CE LYS A 26 3.276 -18.489 7.365 1.00 0.00 C ATOM 384 NZ LYS A 26 3.741 -18.498 8.763 1.00 0.00 N ATOM 0 H LYS A 26 -1.829 -21.213 5.198 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.663 -20.120 7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 26 0.501 -21.024 5.507 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.176 -19.751 4.510 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.194 -19.334 5.058 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.153 -18.058 5.657 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.256 -18.994 7.946 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.194 -20.360 7.376 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.053 -18.898 6.718 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.102 -17.462 7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.614 -17.938 8.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.008 -18.086 9.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.930 -19.477 9.060 1.00 0.00 H new ATOM 398 N HIS A 27 -2.585 -18.013 6.055 1.00 0.00 N ATOM 399 CA HIS A 27 -3.215 -16.711 6.153 1.00 0.00 C ATOM 400 C HIS A 27 -2.346 -15.634 5.505 1.00 0.00 C ATOM 401 O HIS A 27 -2.199 -14.520 6.008 1.00 0.00 O ATOM 402 CB HIS A 27 -3.629 -16.426 7.598 1.00 0.00 C ATOM 403 CG HIS A 27 -4.760 -15.440 7.668 1.00 0.00 C ATOM 404 ND1 HIS A 27 -4.641 -14.073 7.621 1.00 0.00 N ATOM 405 CD2 HIS A 27 -6.093 -15.744 7.711 1.00 0.00 C ATOM 406 CE1 HIS A 27 -5.879 -13.560 7.670 1.00 0.00 C ATOM 407 NE2 HIS A 27 -6.798 -14.539 7.717 1.00 0.00 N ATOM 0 H HIS A 27 -3.118 -18.663 5.477 1.00 0.00 H new ATOM 0 HA HIS A 27 -4.142 -16.702 5.580 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -3.927 -17.356 8.081 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -2.774 -16.039 8.152 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -3.771 -13.545 7.560 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -6.522 -16.735 7.736 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -6.106 -12.504 7.671 1.00 0.00 H new ATOM 415 N THR A 28 -1.805 -15.996 4.343 1.00 0.00 N ATOM 416 CA THR A 28 -1.113 -15.156 3.394 1.00 0.00 C ATOM 417 C THR A 28 -1.605 -15.625 2.025 1.00 0.00 C ATOM 418 O THR A 28 -2.289 -16.649 1.933 1.00 0.00 O ATOM 419 CB THR A 28 0.408 -15.293 3.567 1.00 0.00 C ATOM 420 OG1 THR A 28 0.820 -16.632 3.382 1.00 0.00 O ATOM 421 CG2 THR A 28 0.844 -14.840 4.965 1.00 0.00 C ATOM 0 H THR A 28 -1.848 -16.964 4.025 1.00 0.00 H new ATOM 0 HA THR A 28 -1.318 -14.094 3.531 1.00 0.00 H new ATOM 0 HB THR A 28 0.874 -14.658 2.813 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.791 -16.694 3.495 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.924 -14.947 5.062 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.568 -13.796 5.112 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.350 -15.455 5.717 1.00 0.00 H new ATOM 429 N LEU A 29 -1.270 -14.896 0.964 1.00 0.00 N ATOM 430 CA LEU A 29 -1.732 -15.208 -0.376 1.00 0.00 C ATOM 431 C LEU A 29 -0.658 -16.103 -0.988 1.00 0.00 C ATOM 432 O LEU A 29 0.344 -15.625 -1.510 1.00 0.00 O ATOM 433 CB LEU A 29 -1.971 -13.887 -1.131 1.00 0.00 C ATOM 434 CG LEU A 29 -2.735 -14.027 -2.458 1.00 0.00 C ATOM 435 CD1 LEU A 29 -3.228 -12.642 -2.898 1.00 0.00 C ATOM 436 CD2 LEU A 29 -1.884 -14.619 -3.587 1.00 0.00 C ATOM 0 H LEU A 29 -0.670 -14.073 1.014 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.682 -15.741 -0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.524 -13.209 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.006 -13.421 -1.332 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.562 -14.714 -2.277 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.771 -12.731 -3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.889 -12.232 -2.135 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.374 -11.978 -3.034 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.483 -14.691 -4.495 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.024 -13.975 -3.770 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.539 -15.613 -3.300 1.00 0.00 H new ATOM 448 N SER A 30 -0.835 -17.419 -0.890 1.00 0.00 N ATOM 449 CA SER A 30 0.195 -18.368 -1.285 1.00 0.00 C ATOM 450 C SER A 30 0.013 -18.754 -2.748 1.00 0.00 C ATOM 451 O SER A 30 -0.995 -18.402 -3.363 1.00 0.00 O ATOM 452 CB SER A 30 0.174 -19.593 -0.358 1.00 0.00 C ATOM 453 OG SER A 30 -0.997 -20.365 -0.540 1.00 0.00 O ATOM 0 H SER A 30 -1.689 -17.851 -0.538 1.00 0.00 H new ATOM 0 HA SER A 30 1.176 -17.903 -1.186 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.051 -20.211 -0.551 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.237 -19.266 0.680 1.00 0.00 H new ATOM 0 HG SER A 30 -1.783 -19.827 -0.308 1.00 0.00 H new ATOM 459 N LYS A 31 0.996 -19.469 -3.304 1.00 0.00 N ATOM 460 CA LYS A 31 1.016 -19.880 -4.705 1.00 0.00 C ATOM 461 C LYS A 31 -0.341 -20.413 -5.183 1.00 0.00 C ATOM 462 O LYS A 31 -0.736 -20.164 -6.318 1.00 0.00 O ATOM 463 CB LYS A 31 2.130 -20.912 -4.921 1.00 0.00 C ATOM 464 CG LYS A 31 2.300 -21.271 -6.404 1.00 0.00 C ATOM 465 CD LYS A 31 3.619 -22.012 -6.669 1.00 0.00 C ATOM 466 CE LYS A 31 3.764 -23.319 -5.879 1.00 0.00 C ATOM 467 NZ LYS A 31 2.655 -24.251 -6.149 1.00 0.00 N ATOM 0 H LYS A 31 1.813 -19.782 -2.781 1.00 0.00 H new ATOM 0 HA LYS A 31 1.221 -18.997 -5.311 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.069 -20.518 -4.533 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.904 -21.814 -4.353 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.464 -21.893 -6.725 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.269 -20.361 -7.003 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.694 -22.232 -7.734 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.451 -21.354 -6.420 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.710 -23.796 -6.137 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.800 -23.096 -4.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.833 -25.153 -5.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.765 -23.841 -5.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.583 -24.418 -7.173 1.00 0.00 H new ATOM 481 N LYS A 32 -1.065 -21.137 -4.327 1.00 0.00 N ATOM 482 CA LYS A 32 -2.393 -21.637 -4.649 1.00 0.00 C ATOM 483 C LYS A 32 -3.369 -20.475 -4.900 1.00 0.00 C ATOM 484 O LYS A 32 -4.016 -20.406 -5.944 1.00 0.00 O ATOM 485 CB LYS A 32 -2.887 -22.532 -3.509 1.00 0.00 C ATOM 486 CG LYS A 32 -1.945 -23.697 -3.171 1.00 0.00 C ATOM 487 CD LYS A 32 -2.486 -24.517 -1.989 1.00 0.00 C ATOM 488 CE LYS A 32 -2.332 -23.781 -0.647 1.00 0.00 C ATOM 489 NZ LYS A 32 -2.921 -24.553 0.460 1.00 0.00 N ATOM 0 H LYS A 32 -0.743 -21.390 -3.393 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.342 -22.225 -5.566 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.026 -21.921 -2.617 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -3.864 -22.935 -3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.830 -24.341 -4.043 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.955 -23.310 -2.927 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.539 -24.742 -2.158 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -1.960 -25.470 -1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.275 -23.603 -0.447 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.813 -22.805 -0.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -3.628 -23.970 0.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -3.378 -25.407 0.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -2.173 -24.827 1.129 1.00 0.00 H new ATOM 503 N GLU A 33 -3.458 -19.532 -3.956 1.00 0.00 N ATOM 504 CA GLU A 33 -4.314 -18.357 -4.083 1.00 0.00 C ATOM 505 C GLU A 33 -3.875 -17.511 -5.280 1.00 0.00 C ATOM 506 O GLU A 33 -4.710 -16.946 -5.988 1.00 0.00 O ATOM 507 CB GLU A 33 -4.304 -17.531 -2.791 1.00 0.00 C ATOM 508 CG GLU A 33 -4.993 -18.239 -1.617 1.00 0.00 C ATOM 509 CD GLU A 33 -4.071 -19.231 -0.930 1.00 0.00 C ATOM 510 OE1 GLU A 33 -3.148 -18.753 -0.238 1.00 0.00 O ATOM 511 OE2 GLU A 33 -4.278 -20.447 -1.115 1.00 0.00 O ATOM 0 H GLU A 33 -2.935 -19.566 -3.081 1.00 0.00 H new ATOM 0 HA GLU A 33 -5.338 -18.690 -4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.273 -17.308 -2.518 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.799 -16.577 -2.973 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -5.330 -17.497 -0.894 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.881 -18.759 -1.978 1.00 0.00 H new ATOM 518 N LEU A 34 -2.563 -17.420 -5.511 1.00 0.00 N ATOM 519 CA LEU A 34 -2.013 -16.735 -6.669 1.00 0.00 C ATOM 520 C LEU A 34 -2.483 -17.417 -7.957 1.00 0.00 C ATOM 521 O LEU A 34 -2.949 -16.745 -8.873 1.00 0.00 O ATOM 522 CB LEU A 34 -0.484 -16.680 -6.557 1.00 0.00 C ATOM 523 CG LEU A 34 0.192 -15.828 -7.642 1.00 0.00 C ATOM 524 CD1 LEU A 34 -0.201 -14.349 -7.551 1.00 0.00 C ATOM 525 CD2 LEU A 34 1.709 -15.952 -7.479 1.00 0.00 C ATOM 0 H LEU A 34 -1.856 -17.822 -4.895 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.376 -15.708 -6.702 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.216 -16.283 -5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.090 -17.695 -6.608 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.136 -16.195 -8.614 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.303 -13.789 -8.339 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.280 -14.251 -7.670 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.094 -13.953 -6.579 1.00 0.00 H new ATOM 0 HD21 LEU A 34 2.207 -15.353 -8.242 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.999 -15.595 -6.491 1.00 0.00 H new ATOM 0 HD23 LEU A 34 2.003 -16.996 -7.589 1.00 0.00 H new ATOM 537 N LYS A 35 -2.406 -18.749 -8.026 1.00 0.00 N ATOM 538 CA LYS A 35 -2.915 -19.515 -9.155 1.00 0.00 C ATOM 539 C LYS A 35 -4.400 -19.209 -9.365 1.00 0.00 C ATOM 540 O LYS A 35 -4.813 -18.908 -10.484 1.00 0.00 O ATOM 541 CB LYS A 35 -2.647 -21.013 -8.950 1.00 0.00 C ATOM 542 CG LYS A 35 -3.004 -21.834 -10.195 1.00 0.00 C ATOM 543 CD LYS A 35 -2.722 -23.318 -9.943 1.00 0.00 C ATOM 544 CE LYS A 35 -3.098 -24.151 -11.173 1.00 0.00 C ATOM 545 NZ LYS A 35 -2.849 -25.586 -10.947 1.00 0.00 N ATOM 0 H LYS A 35 -1.986 -19.324 -7.295 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.390 -19.221 -10.064 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -1.596 -21.163 -8.705 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.227 -21.372 -8.100 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -4.056 -21.693 -10.445 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -2.424 -21.485 -11.049 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.667 -23.459 -9.709 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.289 -23.660 -9.077 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -4.150 -23.996 -11.412 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.522 -23.811 -12.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -3.114 -26.122 -11.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -1.840 -25.735 -10.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -3.417 -25.914 -10.140 1.00 0.00 H new ATOM 559 N GLU A 36 -5.202 -19.255 -8.296 1.00 0.00 N ATOM 560 CA GLU A 36 -6.605 -18.862 -8.371 1.00 0.00 C ATOM 561 C GLU A 36 -6.746 -17.435 -8.921 1.00 0.00 C ATOM 562 O GLU A 36 -7.613 -17.180 -9.754 1.00 0.00 O ATOM 563 CB GLU A 36 -7.288 -18.995 -7.004 1.00 0.00 C ATOM 564 CG GLU A 36 -7.408 -20.454 -6.544 1.00 0.00 C ATOM 565 CD GLU A 36 -8.126 -20.564 -5.200 1.00 0.00 C ATOM 566 OE1 GLU A 36 -7.790 -19.756 -4.306 1.00 0.00 O ATOM 567 OE2 GLU A 36 -9.014 -21.438 -5.095 1.00 0.00 O ATOM 0 H GLU A 36 -4.900 -19.561 -7.371 1.00 0.00 H new ATOM 0 HA GLU A 36 -7.107 -19.539 -9.062 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -6.723 -18.430 -6.263 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.282 -18.551 -7.054 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.950 -21.029 -7.295 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -6.414 -20.893 -6.463 1.00 0.00 H new ATOM 574 N LEU A 37 -5.900 -16.503 -8.473 1.00 0.00 N ATOM 575 CA LEU A 37 -5.977 -15.114 -8.909 1.00 0.00 C ATOM 576 C LEU A 37 -5.705 -15.033 -10.413 1.00 0.00 C ATOM 577 O LEU A 37 -6.459 -14.402 -11.152 1.00 0.00 O ATOM 578 CB LEU A 37 -5.005 -14.238 -8.103 1.00 0.00 C ATOM 579 CG LEU A 37 -5.135 -12.737 -8.416 1.00 0.00 C ATOM 580 CD1 LEU A 37 -6.486 -12.165 -7.967 1.00 0.00 C ATOM 581 CD2 LEU A 37 -4.008 -11.975 -7.711 1.00 0.00 C ATOM 0 H LEU A 37 -5.152 -16.691 -7.806 1.00 0.00 H new ATOM 0 HA LEU A 37 -6.980 -14.731 -8.724 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.181 -14.397 -7.039 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -3.983 -14.558 -8.308 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.067 -12.618 -9.497 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.530 -11.103 -8.209 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -7.292 -12.688 -8.482 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.597 -12.296 -6.891 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.096 -10.911 -7.930 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.081 -12.131 -6.635 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.044 -12.340 -8.066 1.00 0.00 H new ATOM 593 N ILE A 38 -4.634 -15.688 -10.870 1.00 0.00 N ATOM 594 CA ILE A 38 -4.293 -15.790 -12.284 1.00 0.00 C ATOM 595 C ILE A 38 -5.487 -16.361 -13.051 1.00 0.00 C ATOM 596 O ILE A 38 -5.913 -15.778 -14.045 1.00 0.00 O ATOM 597 CB ILE A 38 -3.008 -16.625 -12.467 1.00 0.00 C ATOM 598 CG1 ILE A 38 -1.800 -15.858 -11.900 1.00 0.00 C ATOM 599 CG2 ILE A 38 -2.767 -16.947 -13.952 1.00 0.00 C ATOM 600 CD1 ILE A 38 -0.573 -16.746 -11.670 1.00 0.00 C ATOM 0 H ILE A 38 -3.974 -16.167 -10.257 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.080 -14.802 -12.693 1.00 0.00 H new ATOM 0 HB ILE A 38 -3.131 -17.563 -11.926 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.534 -15.054 -12.586 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -2.084 -15.392 -10.957 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.855 -17.536 -14.053 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.611 -17.515 -14.343 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.663 -16.018 -14.513 1.00 0.00 H new ATOM 0 HD11 ILE A 38 0.242 -16.143 -11.270 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -0.823 -17.535 -10.961 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.264 -17.192 -12.615 1.00 0.00 H new ATOM 612 N GLN A 39 -6.039 -17.487 -12.590 1.00 0.00 N ATOM 613 CA GLN A 39 -7.203 -18.117 -13.200 1.00 0.00 C ATOM 614 C GLN A 39 -8.343 -17.096 -13.327 1.00 0.00 C ATOM 615 O GLN A 39 -8.938 -16.946 -14.395 1.00 0.00 O ATOM 616 CB GLN A 39 -7.595 -19.362 -12.382 1.00 0.00 C ATOM 617 CG GLN A 39 -8.523 -20.338 -13.124 1.00 0.00 C ATOM 618 CD GLN A 39 -9.887 -19.734 -13.434 1.00 0.00 C ATOM 619 OE1 GLN A 39 -10.525 -19.151 -12.564 1.00 0.00 O ATOM 620 NE2 GLN A 39 -10.326 -19.823 -14.686 1.00 0.00 N ATOM 0 H GLN A 39 -5.684 -17.988 -11.775 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.972 -18.454 -14.211 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -6.688 -19.892 -12.090 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.085 -19.040 -11.463 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -8.048 -20.648 -14.055 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -8.657 -21.236 -12.520 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.772 -20.315 -15.387 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -11.217 -19.399 -14.945 1.00 0.00 H new ATOM 629 N LYS A 40 -8.647 -16.377 -12.247 1.00 0.00 N ATOM 630 CA LYS A 40 -9.721 -15.400 -12.249 1.00 0.00 C ATOM 631 C LYS A 40 -9.448 -14.304 -13.279 1.00 0.00 C ATOM 632 O LYS A 40 -10.281 -14.052 -14.149 1.00 0.00 O ATOM 633 CB LYS A 40 -9.925 -14.851 -10.830 1.00 0.00 C ATOM 634 CG LYS A 40 -11.110 -13.881 -10.703 1.00 0.00 C ATOM 635 CD LYS A 40 -12.456 -14.454 -11.179 1.00 0.00 C ATOM 636 CE LYS A 40 -12.820 -15.800 -10.535 1.00 0.00 C ATOM 637 NZ LYS A 40 -12.832 -15.723 -9.064 1.00 0.00 N ATOM 0 H LYS A 40 -8.157 -16.458 -11.356 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.654 -15.877 -12.548 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -10.077 -15.686 -10.146 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.015 -14.341 -10.514 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.206 -13.579 -9.660 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.889 -12.981 -11.276 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -13.244 -13.733 -10.962 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -12.426 -14.576 -12.262 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.801 -16.118 -10.889 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -12.105 -16.559 -10.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -13.180 -16.621 -8.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.868 -15.545 -8.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -13.457 -14.948 -8.762 1.00 0.00 H new ATOM 651 N GLU A 41 -8.276 -13.673 -13.215 1.00 0.00 N ATOM 652 CA GLU A 41 -7.895 -12.647 -14.175 1.00 0.00 C ATOM 653 C GLU A 41 -7.932 -13.188 -15.610 1.00 0.00 C ATOM 654 O GLU A 41 -8.321 -12.473 -16.530 1.00 0.00 O ATOM 655 CB GLU A 41 -6.523 -12.067 -13.817 1.00 0.00 C ATOM 656 CG GLU A 41 -6.596 -11.263 -12.507 1.00 0.00 C ATOM 657 CD GLU A 41 -5.259 -10.639 -12.119 1.00 0.00 C ATOM 658 OE1 GLU A 41 -4.407 -10.494 -13.021 1.00 0.00 O ATOM 659 OE2 GLU A 41 -5.114 -10.309 -10.921 1.00 0.00 O ATOM 0 H GLU A 41 -7.572 -13.859 -12.501 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.623 -11.837 -14.124 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.797 -12.874 -13.714 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -6.173 -11.424 -14.625 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.342 -10.475 -12.611 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.933 -11.917 -11.703 1.00 0.00 H new ATOM 816 N GLU A 52 0.541 -4.678 -17.967 1.00 0.00 N ATOM 817 CA GLU A 52 0.159 -4.401 -16.598 1.00 0.00 C ATOM 818 C GLU A 52 -0.081 -5.701 -15.836 1.00 0.00 C ATOM 819 O GLU A 52 0.321 -5.779 -14.680 1.00 0.00 O ATOM 820 CB GLU A 52 -1.081 -3.505 -16.537 1.00 0.00 C ATOM 821 CG GLU A 52 -0.900 -2.197 -17.319 1.00 0.00 C ATOM 822 CD GLU A 52 -2.098 -1.272 -17.140 1.00 0.00 C ATOM 823 OE1 GLU A 52 -3.216 -1.814 -16.996 1.00 0.00 O ATOM 824 OE2 GLU A 52 -1.877 -0.043 -17.154 1.00 0.00 O ATOM 0 HA GLU A 52 0.981 -3.866 -16.123 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -1.938 -4.048 -16.937 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -1.307 -3.274 -15.496 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.005 -1.692 -16.982 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.765 -2.420 -18.377 1.00 0.00 H new ATOM 831 N ILE A 53 -0.721 -6.719 -16.437 1.00 0.00 N ATOM 832 CA ILE A 53 -0.926 -7.966 -15.690 1.00 0.00 C ATOM 833 C ILE A 53 0.422 -8.555 -15.250 1.00 0.00 C ATOM 834 O ILE A 53 0.584 -8.940 -14.095 1.00 0.00 O ATOM 835 CB ILE A 53 -1.780 -8.986 -16.467 1.00 0.00 C ATOM 836 CG1 ILE A 53 -3.148 -8.427 -16.903 1.00 0.00 C ATOM 837 CG2 ILE A 53 -1.981 -10.263 -15.635 1.00 0.00 C ATOM 838 CD1 ILE A 53 -4.029 -7.907 -15.760 1.00 0.00 C ATOM 0 H ILE A 53 -1.088 -6.707 -17.389 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.497 -7.724 -14.794 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.226 -9.218 -17.377 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -2.983 -7.616 -17.612 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -3.691 -9.209 -17.433 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.586 -10.973 -16.199 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -1.011 -10.709 -15.413 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.488 -10.014 -14.703 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.970 -7.535 -16.166 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -4.232 -8.717 -15.059 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -3.513 -7.099 -15.241 1.00 0.00 H new ATOM 850 N VAL A 54 1.403 -8.601 -16.153 1.00 0.00 N ATOM 851 CA VAL A 54 2.752 -9.057 -15.861 1.00 0.00 C ATOM 852 C VAL A 54 3.342 -8.216 -14.730 1.00 0.00 C ATOM 853 O VAL A 54 3.826 -8.773 -13.747 1.00 0.00 O ATOM 854 CB VAL A 54 3.614 -9.029 -17.139 1.00 0.00 C ATOM 855 CG1 VAL A 54 5.093 -9.306 -16.833 1.00 0.00 C ATOM 856 CG2 VAL A 54 3.124 -10.092 -18.132 1.00 0.00 C ATOM 0 H VAL A 54 1.274 -8.316 -17.124 1.00 0.00 H new ATOM 0 HA VAL A 54 2.732 -10.092 -15.521 1.00 0.00 H new ATOM 0 HB VAL A 54 3.519 -8.031 -17.566 1.00 0.00 H new ATOM 0 HG11 VAL A 54 5.668 -9.278 -17.759 1.00 0.00 H new ATOM 0 HG12 VAL A 54 5.471 -8.547 -16.148 1.00 0.00 H new ATOM 0 HG13 VAL A 54 5.192 -10.290 -16.375 1.00 0.00 H new ATOM 0 HG21 VAL A 54 3.741 -10.062 -19.030 1.00 0.00 H new ATOM 0 HG22 VAL A 54 3.197 -11.079 -17.674 1.00 0.00 H new ATOM 0 HG23 VAL A 54 2.086 -9.891 -18.397 1.00 0.00 H new ATOM 866 N LYS A 55 3.298 -6.883 -14.840 1.00 0.00 N ATOM 867 CA LYS A 55 3.815 -6.024 -13.780 1.00 0.00 C ATOM 868 C LYS A 55 3.136 -6.325 -12.437 1.00 0.00 C ATOM 869 O LYS A 55 3.799 -6.406 -11.408 1.00 0.00 O ATOM 870 CB LYS A 55 3.669 -4.547 -14.168 1.00 0.00 C ATOM 871 CG LYS A 55 4.362 -3.645 -13.136 1.00 0.00 C ATOM 872 CD LYS A 55 4.289 -2.178 -13.574 1.00 0.00 C ATOM 873 CE LYS A 55 4.995 -1.248 -12.579 1.00 0.00 C ATOM 874 NZ LYS A 55 4.351 -1.260 -11.254 1.00 0.00 N ATOM 0 H LYS A 55 2.914 -6.385 -15.643 1.00 0.00 H new ATOM 0 HA LYS A 55 4.877 -6.236 -13.656 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.103 -4.380 -15.154 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.613 -4.286 -14.236 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.887 -3.764 -12.162 1.00 0.00 H new ATOM 0 HG3 LYS A 55 5.403 -3.946 -13.022 1.00 0.00 H new ATOM 0 HD2 LYS A 55 4.745 -2.070 -14.558 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.245 -1.880 -13.672 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.037 -1.551 -12.477 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.995 -0.231 -12.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.785 -0.533 -10.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.336 -1.062 -11.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.477 -2.194 -10.815 1.00 0.00 H new ATOM 888 N LEU A 56 1.812 -6.475 -12.437 1.00 0.00 N ATOM 889 CA LEU A 56 1.013 -6.734 -11.248 1.00 0.00 C ATOM 890 C LEU A 56 1.429 -8.066 -10.611 1.00 0.00 C ATOM 891 O LEU A 56 1.687 -8.146 -9.408 1.00 0.00 O ATOM 892 CB LEU A 56 -0.464 -6.723 -11.668 1.00 0.00 C ATOM 893 CG LEU A 56 -1.474 -6.785 -10.517 1.00 0.00 C ATOM 894 CD1 LEU A 56 -1.448 -5.491 -9.693 1.00 0.00 C ATOM 895 CD2 LEU A 56 -2.865 -6.990 -11.130 1.00 0.00 C ATOM 0 H LEU A 56 1.254 -6.418 -13.289 1.00 0.00 H new ATOM 0 HA LEU A 56 1.172 -5.967 -10.490 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -0.653 -5.819 -12.247 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.642 -7.569 -12.331 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.221 -7.606 -9.846 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.174 -5.561 -8.883 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.452 -5.345 -9.276 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.700 -4.646 -10.334 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.609 -7.039 -10.335 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.097 -6.157 -11.794 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -2.879 -7.920 -11.698 1.00 0.00 H new ATOM 907 N MET A 57 1.512 -9.116 -11.430 1.00 0.00 N ATOM 908 CA MET A 57 1.938 -10.434 -10.988 1.00 0.00 C ATOM 909 C MET A 57 3.373 -10.391 -10.470 1.00 0.00 C ATOM 910 O MET A 57 3.667 -10.999 -9.446 1.00 0.00 O ATOM 911 CB MET A 57 1.746 -11.455 -12.117 1.00 0.00 C ATOM 912 CG MET A 57 0.252 -11.720 -12.342 1.00 0.00 C ATOM 913 SD MET A 57 -0.571 -12.614 -10.996 1.00 0.00 S ATOM 914 CE MET A 57 -2.293 -12.378 -11.473 1.00 0.00 C ATOM 0 H MET A 57 1.283 -9.070 -12.423 1.00 0.00 H new ATOM 0 HA MET A 57 1.315 -10.755 -10.153 1.00 0.00 H new ATOM 0 HB2 MET A 57 2.199 -11.082 -13.036 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.254 -12.386 -11.866 1.00 0.00 H new ATOM 0 HG2 MET A 57 -0.254 -10.766 -12.489 1.00 0.00 H new ATOM 0 HG3 MET A 57 0.133 -12.289 -13.264 1.00 0.00 H new ATOM 0 HE1 MET A 57 -2.941 -12.883 -10.757 1.00 0.00 H new ATOM 0 HE2 MET A 57 -2.525 -11.313 -11.484 1.00 0.00 H new ATOM 0 HE3 MET A 57 -2.456 -12.795 -12.467 1.00 0.00 H new ATOM 924 N ASP A 58 4.264 -9.649 -11.134 1.00 0.00 N ATOM 925 CA ASP A 58 5.611 -9.428 -10.627 1.00 0.00 C ATOM 926 C ASP A 58 5.554 -8.744 -9.260 1.00 0.00 C ATOM 927 O ASP A 58 6.233 -9.171 -8.334 1.00 0.00 O ATOM 928 CB ASP A 58 6.446 -8.612 -11.618 1.00 0.00 C ATOM 929 CG ASP A 58 7.885 -8.472 -11.129 1.00 0.00 C ATOM 930 OD1 ASP A 58 8.112 -7.617 -10.243 1.00 0.00 O ATOM 931 OD2 ASP A 58 8.738 -9.226 -11.645 1.00 0.00 O ATOM 0 H ASP A 58 4.071 -9.192 -12.025 1.00 0.00 H new ATOM 0 HA ASP A 58 6.098 -10.396 -10.508 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.435 -9.096 -12.595 1.00 0.00 H new ATOM 0 HB3 ASP A 58 6.003 -7.624 -11.746 1.00 0.00 H new ATOM 936 N ASP A 59 4.754 -7.682 -9.125 1.00 0.00 N ATOM 937 CA ASP A 59 4.605 -6.953 -7.871 1.00 0.00 C ATOM 938 C ASP A 59 4.218 -7.901 -6.733 1.00 0.00 C ATOM 939 O ASP A 59 4.846 -7.883 -5.675 1.00 0.00 O ATOM 940 CB ASP A 59 3.595 -5.812 -8.023 1.00 0.00 C ATOM 941 CG ASP A 59 3.619 -4.910 -6.795 1.00 0.00 C ATOM 942 OD1 ASP A 59 2.971 -5.288 -5.796 1.00 0.00 O ATOM 943 OD2 ASP A 59 4.286 -3.858 -6.881 1.00 0.00 O ATOM 0 H ASP A 59 4.191 -7.306 -9.888 1.00 0.00 H new ATOM 0 HA ASP A 59 5.567 -6.509 -7.615 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.828 -5.229 -8.914 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.594 -6.221 -8.162 1.00 0.00 H new ATOM 948 N LEU A 60 3.210 -8.750 -6.964 1.00 0.00 N ATOM 949 CA LEU A 60 2.860 -9.817 -6.030 1.00 0.00 C ATOM 950 C LEU A 60 4.073 -10.720 -5.774 1.00 0.00 C ATOM 951 O LEU A 60 4.501 -10.895 -4.633 1.00 0.00 O ATOM 952 CB LEU A 60 1.679 -10.637 -6.577 1.00 0.00 C ATOM 953 CG LEU A 60 0.338 -9.892 -6.508 1.00 0.00 C ATOM 954 CD1 LEU A 60 -0.669 -10.539 -7.464 1.00 0.00 C ATOM 955 CD2 LEU A 60 -0.249 -9.928 -5.089 1.00 0.00 C ATOM 0 H LEU A 60 2.621 -8.715 -7.796 1.00 0.00 H new ATOM 0 HA LEU A 60 2.559 -9.369 -5.083 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.883 -10.908 -7.613 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.600 -11.567 -6.014 1.00 0.00 H new ATOM 0 HG LEU A 60 0.523 -8.856 -6.792 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.618 -10.005 -7.409 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.285 -10.493 -8.483 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.822 -11.580 -7.181 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.198 -9.392 -5.074 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.412 -10.963 -4.789 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.446 -9.455 -4.396 1.00 0.00 H new ATOM 967 N ASP A 61 4.627 -11.308 -6.836 1.00 0.00 N ATOM 968 CA ASP A 61 5.750 -12.230 -6.761 1.00 0.00 C ATOM 969 C ASP A 61 7.057 -11.483 -6.484 1.00 0.00 C ATOM 970 O ASP A 61 7.964 -11.450 -7.316 1.00 0.00 O ATOM 971 CB ASP A 61 5.833 -13.064 -8.048 1.00 0.00 C ATOM 972 CG ASP A 61 6.993 -14.061 -8.037 1.00 0.00 C ATOM 973 OD1 ASP A 61 7.569 -14.284 -6.946 1.00 0.00 O ATOM 974 OD2 ASP A 61 7.282 -14.599 -9.127 1.00 0.00 O ATOM 0 H ASP A 61 4.298 -11.150 -7.788 1.00 0.00 H new ATOM 0 HA ASP A 61 5.590 -12.912 -5.926 1.00 0.00 H new ATOM 0 HB2 ASP A 61 4.897 -13.605 -8.185 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.943 -12.395 -8.902 1.00 0.00 H new ATOM 979 N ARG A 62 7.203 -10.966 -5.264 1.00 0.00 N ATOM 980 CA ARG A 62 8.463 -10.423 -4.776 1.00 0.00 C ATOM 981 C ARG A 62 9.392 -11.584 -4.403 1.00 0.00 C ATOM 982 O ARG A 62 9.798 -11.724 -3.249 1.00 0.00 O ATOM 983 CB ARG A 62 8.157 -9.476 -3.604 1.00 0.00 C ATOM 984 CG ARG A 62 9.282 -8.477 -3.291 1.00 0.00 C ATOM 985 CD ARG A 62 9.175 -7.156 -4.073 1.00 0.00 C ATOM 986 NE ARG A 62 9.650 -7.260 -5.462 1.00 0.00 N ATOM 987 CZ ARG A 62 8.896 -7.509 -6.545 1.00 0.00 C ATOM 988 NH1 ARG A 62 7.593 -7.772 -6.433 1.00 0.00 N ATOM 989 NH2 ARG A 62 9.462 -7.524 -7.755 1.00 0.00 N ATOM 0 H ARG A 62 6.443 -10.914 -4.585 1.00 0.00 H new ATOM 0 HA ARG A 62 8.983 -9.840 -5.536 1.00 0.00 H new ATOM 0 HB2 ARG A 62 7.246 -8.921 -3.828 1.00 0.00 H new ATOM 0 HB3 ARG A 62 7.957 -10.071 -2.713 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.274 -8.258 -2.223 1.00 0.00 H new ATOM 0 HG3 ARG A 62 10.242 -8.943 -3.514 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.136 -6.827 -4.076 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.751 -6.388 -3.556 1.00 0.00 H new ATOM 0 HE ARG A 62 10.650 -7.130 -5.617 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.153 -7.786 -5.513 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.037 -7.959 -7.267 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.462 -7.347 -7.853 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.894 -7.713 -8.581 1.00 0.00 H new ATOM 1003 N ASN A 63 9.676 -12.471 -5.366 1.00 0.00 N ATOM 1004 CA ASN A 63 10.355 -13.763 -5.215 1.00 0.00 C ATOM 1005 C ASN A 63 9.535 -14.788 -4.414 1.00 0.00 C ATOM 1006 O ASN A 63 9.490 -15.970 -4.761 1.00 0.00 O ATOM 1007 CB ASN A 63 11.816 -13.614 -4.746 1.00 0.00 C ATOM 1008 CG ASN A 63 12.083 -14.158 -3.343 1.00 0.00 C ATOM 1009 OD1 ASN A 63 12.604 -15.255 -3.181 1.00 0.00 O ATOM 1010 ND2 ASN A 63 11.746 -13.392 -2.313 1.00 0.00 N ATOM 0 H ASN A 63 9.420 -12.292 -6.337 1.00 0.00 H new ATOM 0 HA ASN A 63 10.422 -14.193 -6.214 1.00 0.00 H new ATOM 0 HB2 ASN A 63 12.467 -14.129 -5.453 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.088 -12.559 -4.772 1.00 0.00 H new ATOM 0 HD21 ASN A 63 11.920 -13.713 -1.360 1.00 0.00 H new ATOM 0 HD22 ASN A 63 11.313 -12.482 -2.474 1.00 0.00 H new ATOM 1017 N LYS A 64 8.842 -14.347 -3.362 1.00 0.00 N ATOM 1018 CA LYS A 64 7.969 -15.183 -2.557 1.00 0.00 C ATOM 1019 C LYS A 64 6.651 -15.504 -3.276 1.00 0.00 C ATOM 1020 O LYS A 64 5.586 -15.413 -2.671 1.00 0.00 O ATOM 1021 CB LYS A 64 7.719 -14.515 -1.199 1.00 0.00 C ATOM 1022 CG LYS A 64 9.018 -14.210 -0.447 1.00 0.00 C ATOM 1023 CD LYS A 64 8.699 -13.856 1.010 1.00 0.00 C ATOM 1024 CE LYS A 64 9.964 -13.480 1.792 1.00 0.00 C ATOM 1025 NZ LYS A 64 10.904 -14.610 1.896 1.00 0.00 N ATOM 0 H LYS A 64 8.877 -13.378 -3.045 1.00 0.00 H new ATOM 0 HA LYS A 64 8.469 -16.138 -2.394 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.164 -13.589 -1.350 1.00 0.00 H new ATOM 0 HB3 LYS A 64 7.093 -15.165 -0.588 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.683 -15.073 -0.485 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.542 -13.383 -0.926 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.994 -13.025 1.037 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.211 -14.703 1.492 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.458 -12.641 1.301 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.687 -13.146 2.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.679 -14.359 2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.404 -15.445 2.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.294 -14.825 0.956 1.00 0.00 H new ATOM 1039 N ASP A 65 6.708 -15.961 -4.534 1.00 0.00 N ATOM 1040 CA ASP A 65 5.559 -16.513 -5.258 1.00 0.00 C ATOM 1041 C ASP A 65 4.830 -17.533 -4.378 1.00 0.00 C ATOM 1042 O ASP A 65 3.607 -17.636 -4.365 1.00 0.00 O ATOM 1043 CB ASP A 65 6.059 -17.222 -6.525 1.00 0.00 C ATOM 1044 CG ASP A 65 4.908 -17.620 -7.438 1.00 0.00 C ATOM 1045 OD1 ASP A 65 4.388 -18.739 -7.246 1.00 0.00 O ATOM 1046 OD2 ASP A 65 4.579 -16.796 -8.317 1.00 0.00 O ATOM 0 H ASP A 65 7.567 -15.957 -5.084 1.00 0.00 H new ATOM 0 HA ASP A 65 4.877 -15.704 -5.520 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.741 -16.565 -7.065 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.626 -18.110 -6.246 1.00 0.00 H new ATOM 1051 N GLN A 66 5.647 -18.284 -3.641 1.00 0.00 N ATOM 1052 CA GLN A 66 5.273 -19.312 -2.697 1.00 0.00 C ATOM 1053 C GLN A 66 4.291 -18.767 -1.656 1.00 0.00 C ATOM 1054 O GLN A 66 3.247 -19.375 -1.411 1.00 0.00 O ATOM 1055 CB GLN A 66 6.539 -19.908 -2.057 1.00 0.00 C ATOM 1056 CG GLN A 66 7.506 -20.599 -3.040 1.00 0.00 C ATOM 1057 CD GLN A 66 8.211 -19.651 -4.015 1.00 0.00 C ATOM 1058 OE1 GLN A 66 8.216 -19.883 -5.217 1.00 0.00 O ATOM 1059 NE2 GLN A 66 8.758 -18.542 -3.515 1.00 0.00 N ATOM 0 H GLN A 66 6.659 -18.174 -3.699 1.00 0.00 H new ATOM 0 HA GLN A 66 4.753 -20.115 -3.219 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.077 -19.112 -1.542 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.238 -20.631 -1.299 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.261 -21.138 -2.468 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.951 -21.342 -3.613 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.740 -18.373 -2.509 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.194 -17.863 -4.138 1.00 0.00 H new ATOM 1068 N GLU A 67 4.635 -17.619 -1.067 1.00 0.00 N ATOM 1069 CA GLU A 67 3.892 -16.944 -0.009 1.00 0.00 C ATOM 1070 C GLU A 67 3.935 -15.421 -0.183 1.00 0.00 C ATOM 1071 O GLU A 67 4.856 -14.754 0.284 1.00 0.00 O ATOM 1072 CB GLU A 67 4.322 -17.423 1.394 1.00 0.00 C ATOM 1073 CG GLU A 67 5.796 -17.245 1.804 1.00 0.00 C ATOM 1074 CD GLU A 67 6.757 -18.126 1.017 1.00 0.00 C ATOM 1075 OE1 GLU A 67 6.584 -19.361 1.093 1.00 0.00 O ATOM 1076 OE2 GLU A 67 7.652 -17.552 0.357 1.00 0.00 O ATOM 0 H GLU A 67 5.481 -17.113 -1.330 1.00 0.00 H new ATOM 0 HA GLU A 67 2.843 -17.227 -0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.707 -16.901 2.127 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.080 -18.483 1.472 1.00 0.00 H new ATOM 0 HG2 GLU A 67 6.079 -16.201 1.668 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.899 -17.468 2.866 1.00 0.00 H new ATOM 1083 N VAL A 68 2.893 -14.846 -0.787 1.00 0.00 N ATOM 1084 CA VAL A 68 2.802 -13.412 -0.987 1.00 0.00 C ATOM 1085 C VAL A 68 2.090 -12.888 0.261 1.00 0.00 C ATOM 1086 O VAL A 68 0.918 -13.170 0.517 1.00 0.00 O ATOM 1087 CB VAL A 68 2.071 -13.090 -2.303 1.00 0.00 C ATOM 1088 CG1 VAL A 68 2.030 -11.579 -2.537 1.00 0.00 C ATOM 1089 CG2 VAL A 68 2.769 -13.761 -3.496 1.00 0.00 C ATOM 0 H VAL A 68 2.094 -15.367 -1.148 1.00 0.00 H new ATOM 0 HA VAL A 68 3.773 -12.929 -1.097 1.00 0.00 H new ATOM 0 HB VAL A 68 1.055 -13.475 -2.219 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.510 -11.370 -3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.504 -11.097 -1.713 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.047 -11.192 -2.593 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.234 -13.519 -4.414 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.795 -13.400 -3.568 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.774 -14.842 -3.354 1.00 0.00 H new ATOM 1099 N ASN A 69 2.853 -12.175 1.089 1.00 0.00 N ATOM 1100 CA ASN A 69 2.450 -11.812 2.438 1.00 0.00 C ATOM 1101 C ASN A 69 1.784 -10.442 2.452 1.00 0.00 C ATOM 1102 O ASN A 69 1.806 -9.718 1.459 1.00 0.00 O ATOM 1103 CB ASN A 69 3.683 -11.848 3.353 1.00 0.00 C ATOM 1104 CG ASN A 69 4.322 -13.238 3.405 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.640 -14.253 3.291 1.00 0.00 O ATOM 1106 ND2 ASN A 69 5.639 -13.301 3.579 1.00 0.00 N ATOM 0 H ASN A 69 3.779 -11.831 0.834 1.00 0.00 H new ATOM 0 HA ASN A 69 1.715 -12.528 2.807 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.418 -11.125 2.999 1.00 0.00 H new ATOM 0 HB3 ASN A 69 3.396 -11.544 4.360 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.105 -14.207 3.620 1.00 0.00 H new ATOM 0 HD22 ASN A 69 6.183 -12.443 3.671 1.00 0.00 H new ATOM 1113 N PHE A 70 1.176 -10.088 3.587 1.00 0.00 N ATOM 1114 CA PHE A 70 0.331 -8.906 3.702 1.00 0.00 C ATOM 1115 C PHE A 70 1.005 -7.639 3.165 1.00 0.00 C ATOM 1116 O PHE A 70 0.395 -6.894 2.405 1.00 0.00 O ATOM 1117 CB PHE A 70 -0.135 -8.725 5.149 1.00 0.00 C ATOM 1118 CG PHE A 70 -1.092 -7.564 5.327 1.00 0.00 C ATOM 1119 CD1 PHE A 70 -2.343 -7.591 4.683 1.00 0.00 C ATOM 1120 CD2 PHE A 70 -0.714 -6.431 6.073 1.00 0.00 C ATOM 1121 CE1 PHE A 70 -3.228 -6.509 4.816 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -1.603 -5.352 6.212 1.00 0.00 C ATOM 1123 CZ PHE A 70 -2.863 -5.394 5.588 1.00 0.00 C ATOM 0 H PHE A 70 1.259 -10.619 4.454 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.543 -9.070 3.072 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.620 -9.642 5.485 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.735 -8.572 5.788 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.623 -8.446 4.085 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.260 -6.391 6.538 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.189 -6.534 4.325 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.319 -4.490 6.798 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.550 -4.569 5.703 1.00 0.00 H new ATOM 1133 N GLN A 71 2.272 -7.393 3.508 1.00 0.00 N ATOM 1134 CA GLN A 71 2.983 -6.228 2.989 1.00 0.00 C ATOM 1135 C GLN A 71 3.049 -6.248 1.453 1.00 0.00 C ATOM 1136 O GLN A 71 2.969 -5.201 0.804 1.00 0.00 O ATOM 1137 CB GLN A 71 4.379 -6.146 3.624 1.00 0.00 C ATOM 1138 CG GLN A 71 5.195 -4.924 3.168 1.00 0.00 C ATOM 1139 CD GLN A 71 4.499 -3.596 3.465 1.00 0.00 C ATOM 1140 OE1 GLN A 71 4.700 -3.005 4.520 1.00 0.00 O ATOM 1141 NE2 GLN A 71 3.672 -3.117 2.542 1.00 0.00 N ATOM 0 H GLN A 71 2.820 -7.980 4.137 1.00 0.00 H new ATOM 0 HA GLN A 71 2.431 -5.329 3.262 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.274 -6.118 4.709 1.00 0.00 H new ATOM 0 HB3 GLN A 71 4.933 -7.053 3.381 1.00 0.00 H new ATOM 0 HG2 GLN A 71 6.166 -4.937 3.663 1.00 0.00 H new ATOM 0 HG3 GLN A 71 5.382 -4.998 2.097 1.00 0.00 H new ATOM 0 HE21 GLN A 71 3.524 -3.631 1.673 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.185 -2.235 2.702 1.00 0.00 H new ATOM 1150 N GLU A 72 3.187 -7.433 0.859 1.00 0.00 N ATOM 1151 CA GLU A 72 3.214 -7.581 -0.585 1.00 0.00 C ATOM 1152 C GLU A 72 1.807 -7.368 -1.148 1.00 0.00 C ATOM 1153 O GLU A 72 1.652 -6.699 -2.164 1.00 0.00 O ATOM 1154 CB GLU A 72 3.799 -8.945 -0.970 1.00 0.00 C ATOM 1155 CG GLU A 72 5.106 -9.273 -0.230 1.00 0.00 C ATOM 1156 CD GLU A 72 6.107 -8.121 -0.270 1.00 0.00 C ATOM 1157 OE1 GLU A 72 6.570 -7.807 -1.386 1.00 0.00 O ATOM 1158 OE2 GLU A 72 6.380 -7.570 0.820 1.00 0.00 O ATOM 0 H GLU A 72 3.283 -8.311 1.369 1.00 0.00 H new ATOM 0 HA GLU A 72 3.864 -6.824 -1.024 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.064 -9.721 -0.758 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.982 -8.965 -2.044 1.00 0.00 H new ATOM 0 HG2 GLU A 72 4.880 -9.518 0.808 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.559 -10.159 -0.675 1.00 0.00 H new ATOM 1165 N TYR A 73 0.776 -7.882 -0.471 1.00 0.00 N ATOM 1166 CA TYR A 73 -0.614 -7.603 -0.823 1.00 0.00 C ATOM 1167 C TYR A 73 -0.876 -6.089 -0.834 1.00 0.00 C ATOM 1168 O TYR A 73 -1.456 -5.548 -1.774 1.00 0.00 O ATOM 1169 CB TYR A 73 -1.559 -8.334 0.135 1.00 0.00 C ATOM 1170 CG TYR A 73 -3.024 -8.143 -0.193 1.00 0.00 C ATOM 1171 CD1 TYR A 73 -3.606 -8.886 -1.237 1.00 0.00 C ATOM 1172 CD2 TYR A 73 -3.799 -7.210 0.523 1.00 0.00 C ATOM 1173 CE1 TYR A 73 -4.968 -8.726 -1.542 1.00 0.00 C ATOM 1174 CE2 TYR A 73 -5.163 -7.059 0.220 1.00 0.00 C ATOM 1175 CZ TYR A 73 -5.747 -7.816 -0.809 1.00 0.00 C ATOM 1176 OH TYR A 73 -7.075 -7.678 -1.075 1.00 0.00 O ATOM 0 H TYR A 73 0.883 -8.500 0.333 1.00 0.00 H new ATOM 0 HA TYR A 73 -0.806 -7.974 -1.830 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -1.328 -9.399 0.118 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -1.374 -7.984 1.151 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -3.004 -9.580 -1.805 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.347 -6.613 1.301 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -5.415 -9.302 -2.339 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -5.764 -6.358 0.780 1.00 0.00 H new ATOM 0 HH TYR A 73 -7.461 -7.007 -0.474 1.00 0.00 H new ATOM 1186 N ILE A 74 -0.419 -5.391 0.202 1.00 0.00 N ATOM 1187 CA ILE A 74 -0.479 -3.939 0.283 1.00 0.00 C ATOM 1188 C ILE A 74 0.229 -3.316 -0.927 1.00 0.00 C ATOM 1189 O ILE A 74 -0.346 -2.479 -1.621 1.00 0.00 O ATOM 1190 CB ILE A 74 0.115 -3.492 1.631 1.00 0.00 C ATOM 1191 CG1 ILE A 74 -0.801 -3.830 2.817 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.466 -2.007 1.639 1.00 0.00 C ATOM 1193 CD1 ILE A 74 -2.038 -2.931 2.931 1.00 0.00 C ATOM 0 H ILE A 74 0.009 -5.827 1.019 1.00 0.00 H new ATOM 0 HA ILE A 74 -1.511 -3.589 0.247 1.00 0.00 H new ATOM 0 HB ILE A 74 1.038 -4.060 1.752 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -1.126 -4.867 2.727 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -0.225 -3.755 3.739 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.882 -1.737 2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.201 -1.803 0.860 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.433 -1.420 1.453 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -2.631 -3.236 3.793 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -1.724 -1.894 3.054 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -2.639 -3.023 2.026 1.00 0.00 H new ATOM 1205 N THR A 75 1.467 -3.730 -1.208 1.00 0.00 N ATOM 1206 CA THR A 75 2.186 -3.232 -2.379 1.00 0.00 C ATOM 1207 C THR A 75 1.363 -3.463 -3.656 1.00 0.00 C ATOM 1208 O THR A 75 1.252 -2.571 -4.495 1.00 0.00 O ATOM 1209 CB THR A 75 3.585 -3.864 -2.463 1.00 0.00 C ATOM 1210 OG1 THR A 75 4.223 -3.806 -1.202 1.00 0.00 O ATOM 1211 CG2 THR A 75 4.470 -3.096 -3.449 1.00 0.00 C ATOM 0 H THR A 75 1.987 -4.403 -0.645 1.00 0.00 H new ATOM 0 HA THR A 75 2.326 -2.156 -2.278 1.00 0.00 H new ATOM 0 HB THR A 75 3.456 -4.896 -2.790 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.804 -4.450 -0.593 1.00 0.00 H new ATOM 0 HG21 THR A 75 5.455 -3.561 -3.492 1.00 0.00 H new ATOM 0 HG22 THR A 75 4.015 -3.117 -4.439 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.571 -2.062 -3.118 1.00 0.00 H new ATOM 1219 N PHE A 76 0.740 -4.638 -3.778 1.00 0.00 N ATOM 1220 CA PHE A 76 -0.175 -4.974 -4.861 1.00 0.00 C ATOM 1221 C PHE A 76 -1.350 -3.996 -4.918 1.00 0.00 C ATOM 1222 O PHE A 76 -1.704 -3.560 -6.012 1.00 0.00 O ATOM 1223 CB PHE A 76 -0.613 -6.442 -4.752 1.00 0.00 C ATOM 1224 CG PHE A 76 -1.965 -6.773 -5.359 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -3.133 -6.674 -4.576 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -2.059 -7.198 -6.696 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -4.387 -6.970 -5.137 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -3.307 -7.549 -7.238 1.00 0.00 C ATOM 1229 CZ PHE A 76 -4.475 -7.404 -6.471 1.00 0.00 C ATOM 0 H PHE A 76 0.864 -5.397 -3.108 1.00 0.00 H new ATOM 0 HA PHE A 76 0.346 -4.869 -5.813 1.00 0.00 H new ATOM 0 HB2 PHE A 76 0.142 -7.064 -5.232 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.631 -6.719 -3.698 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.064 -6.370 -3.542 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.171 -7.255 -7.307 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -5.283 -6.864 -4.543 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.368 -7.931 -8.246 1.00 0.00 H new ATOM 0 HZ PHE A 76 -5.439 -7.626 -6.905 1.00 0.00 H new ATOM 1239 N LEU A 77 -1.936 -3.617 -3.775 1.00 0.00 N ATOM 1240 CA LEU A 77 -2.968 -2.581 -3.740 1.00 0.00 C ATOM 1241 C LEU A 77 -2.414 -1.336 -4.438 1.00 0.00 C ATOM 1242 O LEU A 77 -3.011 -0.817 -5.381 1.00 0.00 O ATOM 1243 CB LEU A 77 -3.369 -2.277 -2.285 1.00 0.00 C ATOM 1244 CG LEU A 77 -4.736 -1.594 -2.097 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -4.870 -1.219 -0.619 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -4.929 -0.309 -2.909 1.00 0.00 C ATOM 0 H LEU A 77 -1.711 -4.015 -2.863 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.866 -2.918 -4.258 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.371 -3.212 -1.725 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.602 -1.642 -1.842 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.485 -2.305 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.831 -0.732 -0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.810 -2.120 -0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.065 -0.538 -0.342 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.920 0.100 -2.712 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.172 0.420 -2.622 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.833 -0.532 -3.972 1.00 0.00 H new ATOM 1258 N GLY A 78 -1.237 -0.893 -3.985 1.00 0.00 N ATOM 1259 CA GLY A 78 -0.528 0.229 -4.575 1.00 0.00 C ATOM 1260 C GLY A 78 -0.403 0.083 -6.088 1.00 0.00 C ATOM 1261 O GLY A 78 -0.797 0.981 -6.826 1.00 0.00 O ATOM 0 H GLY A 78 -0.752 -1.312 -3.191 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.053 1.155 -4.341 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.466 0.305 -4.133 1.00 0.00 H new ATOM 1265 N ALA A 79 0.131 -1.047 -6.554 1.00 0.00 N ATOM 1266 CA ALA A 79 0.305 -1.316 -7.973 1.00 0.00 C ATOM 1267 C ALA A 79 -1.025 -1.199 -8.718 1.00 0.00 C ATOM 1268 O ALA A 79 -1.129 -0.426 -9.664 1.00 0.00 O ATOM 1269 CB ALA A 79 0.944 -2.693 -8.171 1.00 0.00 C ATOM 0 H ALA A 79 0.455 -1.802 -5.950 1.00 0.00 H new ATOM 0 HA ALA A 79 0.976 -0.567 -8.394 1.00 0.00 H new ATOM 0 HB1 ALA A 79 1.070 -2.886 -9.236 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.917 -2.717 -7.680 1.00 0.00 H new ATOM 0 HB3 ALA A 79 0.300 -3.459 -7.738 1.00 0.00 H new ATOM 1275 N LEU A 80 -2.044 -1.950 -8.292 1.00 0.00 N ATOM 1276 CA LEU A 80 -3.369 -1.965 -8.904 1.00 0.00 C ATOM 1277 C LEU A 80 -3.896 -0.528 -9.029 1.00 0.00 C ATOM 1278 O LEU A 80 -4.256 -0.062 -10.112 1.00 0.00 O ATOM 1279 CB LEU A 80 -4.292 -2.853 -8.044 1.00 0.00 C ATOM 1280 CG LEU A 80 -5.521 -3.454 -8.745 1.00 0.00 C ATOM 1281 CD1 LEU A 80 -6.327 -2.445 -9.564 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -5.138 -4.643 -9.631 1.00 0.00 C ATOM 0 H LEU A 80 -1.965 -2.579 -7.492 1.00 0.00 H new ATOM 0 HA LEU A 80 -3.331 -2.381 -9.911 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -3.697 -3.672 -7.640 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -4.639 -2.262 -7.196 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.165 -3.792 -7.934 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.177 -2.948 -10.026 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.687 -1.651 -8.910 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.693 -2.017 -10.340 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.032 -5.042 -10.110 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -4.432 -4.315 -10.394 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -4.677 -5.419 -9.020 1.00 0.00 H new ATOM 1294 N ALA A 81 -3.907 0.193 -7.907 1.00 0.00 N ATOM 1295 CA ALA A 81 -4.366 1.570 -7.862 1.00 0.00 C ATOM 1296 C ALA A 81 -3.551 2.460 -8.806 1.00 0.00 C ATOM 1297 O ALA A 81 -4.117 3.251 -9.554 1.00 0.00 O ATOM 1298 CB ALA A 81 -4.301 2.065 -6.419 1.00 0.00 C ATOM 0 H ALA A 81 -3.596 -0.168 -7.005 1.00 0.00 H new ATOM 0 HA ALA A 81 -5.399 1.620 -8.207 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.644 3.099 -6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.940 1.443 -5.792 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.273 2.007 -6.060 1.00 0.00 H new ATOM 1304 N MET A 82 -2.223 2.334 -8.792 1.00 0.00 N ATOM 1305 CA MET A 82 -1.352 3.117 -9.657 1.00 0.00 C ATOM 1306 C MET A 82 -1.635 2.815 -11.131 1.00 0.00 C ATOM 1307 O MET A 82 -1.609 3.726 -11.957 1.00 0.00 O ATOM 1308 CB MET A 82 0.117 2.874 -9.284 1.00 0.00 C ATOM 1309 CG MET A 82 1.053 3.851 -10.003 1.00 0.00 C ATOM 1310 SD MET A 82 2.785 3.738 -9.492 1.00 0.00 S ATOM 1311 CE MET A 82 3.494 5.054 -10.506 1.00 0.00 C ATOM 0 H MET A 82 -1.726 1.686 -8.180 1.00 0.00 H new ATOM 0 HA MET A 82 -1.558 4.177 -9.508 1.00 0.00 H new ATOM 0 HB2 MET A 82 0.241 2.978 -8.206 1.00 0.00 H new ATOM 0 HB3 MET A 82 0.393 1.851 -9.539 1.00 0.00 H new ATOM 0 HG2 MET A 82 0.991 3.672 -11.076 1.00 0.00 H new ATOM 0 HG3 MET A 82 0.701 4.868 -9.829 1.00 0.00 H new ATOM 0 HE1 MET A 82 4.565 5.123 -10.315 1.00 0.00 H new ATOM 0 HE2 MET A 82 3.327 4.831 -11.560 1.00 0.00 H new ATOM 0 HE3 MET A 82 3.019 6.002 -10.256 1.00 0.00 H new ATOM 1321 N ILE A 83 -1.902 1.546 -11.456 1.00 0.00 N ATOM 1322 CA ILE A 83 -2.332 1.113 -12.779 1.00 0.00 C ATOM 1323 C ILE A 83 -3.629 1.836 -13.159 1.00 0.00 C ATOM 1324 O ILE A 83 -3.748 2.313 -14.287 1.00 0.00 O ATOM 1325 CB ILE A 83 -2.404 -0.432 -12.850 1.00 0.00 C ATOM 1326 CG1 ILE A 83 -1.119 -1.019 -13.462 1.00 0.00 C ATOM 1327 CG2 ILE A 83 -3.594 -0.941 -13.676 1.00 0.00 C ATOM 1328 CD1 ILE A 83 0.153 -0.724 -12.664 1.00 0.00 C ATOM 0 H ILE A 83 -1.822 0.779 -10.789 1.00 0.00 H new ATOM 0 HA ILE A 83 -1.598 1.394 -13.534 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.527 -0.763 -11.819 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -1.235 -2.099 -13.552 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -0.999 -0.626 -14.472 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.589 -2.031 -13.688 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -4.524 -0.587 -13.231 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -3.515 -0.567 -14.697 1.00 0.00 H new ATOM 0 HD11 ILE A 83 1.010 -1.174 -13.166 1.00 0.00 H new ATOM 0 HD12 ILE A 83 0.298 0.354 -12.595 1.00 0.00 H new ATOM 0 HD13 ILE A 83 0.059 -1.142 -11.662 1.00 0.00 H new ATOM 1340 N TYR A 84 -4.577 1.998 -12.227 1.00 0.00 N ATOM 1341 CA TYR A 84 -5.736 2.869 -12.437 1.00 0.00 C ATOM 1342 C TYR A 84 -5.318 4.348 -12.353 1.00 0.00 C ATOM 1343 O TYR A 84 -5.895 5.135 -11.602 1.00 0.00 O ATOM 1344 CB TYR A 84 -6.843 2.554 -11.418 1.00 0.00 C ATOM 1345 CG TYR A 84 -7.433 1.155 -11.394 1.00 0.00 C ATOM 1346 CD1 TYR A 84 -7.293 0.266 -12.479 1.00 0.00 C ATOM 1347 CD2 TYR A 84 -8.293 0.821 -10.333 1.00 0.00 C ATOM 1348 CE1 TYR A 84 -8.009 -0.944 -12.495 1.00 0.00 C ATOM 1349 CE2 TYR A 84 -9.025 -0.378 -10.360 1.00 0.00 C ATOM 1350 CZ TYR A 84 -8.894 -1.253 -11.451 1.00 0.00 C ATOM 1351 OH TYR A 84 -9.633 -2.396 -11.507 1.00 0.00 O ATOM 0 H TYR A 84 -4.562 1.535 -11.318 1.00 0.00 H new ATOM 0 HA TYR A 84 -6.133 2.682 -13.435 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -6.447 2.763 -10.424 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -7.660 3.255 -11.590 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -6.635 0.515 -13.299 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.392 1.491 -9.491 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -7.877 -1.637 -13.313 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.687 -0.626 -9.544 1.00 0.00 H new ATOM 0 HH TYR A 84 -10.285 -2.400 -10.775 1.00 0.00 H new ATOM 1361 N ASN A 85 -4.334 4.755 -13.159 1.00 0.00 N ATOM 1362 CA ASN A 85 -3.683 6.052 -13.035 1.00 0.00 C ATOM 1363 C ASN A 85 -4.658 7.201 -13.288 1.00 0.00 C ATOM 1364 O ASN A 85 -4.583 8.246 -12.643 1.00 0.00 O ATOM 1365 CB ASN A 85 -2.468 6.130 -13.968 1.00 0.00 C ATOM 1366 CG ASN A 85 -1.358 6.953 -13.324 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -1.119 8.097 -13.688 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -0.670 6.362 -12.352 1.00 0.00 N ATOM 0 H ASN A 85 -3.967 4.185 -13.921 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.333 6.157 -12.008 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.105 5.126 -14.188 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -2.759 6.579 -14.918 1.00 0.00 H new ATOM 0 HD21 ASN A 85 0.085 6.864 -11.884 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -0.897 5.407 -12.075 1.00 0.00 H new ATOM 1375 N GLU A 86 -5.599 6.983 -14.211 1.00 0.00 N ATOM 1376 CA GLU A 86 -6.722 7.877 -14.448 1.00 0.00 C ATOM 1377 C GLU A 86 -7.429 8.174 -13.124 1.00 0.00 C ATOM 1378 O GLU A 86 -7.573 9.328 -12.738 1.00 0.00 O ATOM 1379 CB GLU A 86 -7.656 7.242 -15.494 1.00 0.00 C ATOM 1380 CG GLU A 86 -8.893 8.093 -15.826 1.00 0.00 C ATOM 1381 CD GLU A 86 -9.992 8.008 -14.766 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -10.363 6.865 -14.423 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -10.436 9.084 -14.312 1.00 0.00 O ATOM 0 H GLU A 86 -5.596 6.166 -14.821 1.00 0.00 H new ATOM 0 HA GLU A 86 -6.382 8.832 -14.848 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -7.092 7.066 -16.410 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.984 6.269 -15.130 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -8.589 9.133 -15.940 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -9.299 7.772 -16.786 1.00 0.00 H new ATOM 1390 N ALA A 87 -7.864 7.131 -12.414 1.00 0.00 N ATOM 1391 CA ALA A 87 -8.550 7.308 -11.144 1.00 0.00 C ATOM 1392 C ALA A 87 -7.601 7.919 -10.109 1.00 0.00 C ATOM 1393 O ALA A 87 -8.021 8.748 -9.304 1.00 0.00 O ATOM 1394 CB ALA A 87 -9.140 5.976 -10.680 1.00 0.00 C ATOM 0 H ALA A 87 -7.751 6.159 -12.701 1.00 0.00 H new ATOM 0 HA ALA A 87 -9.378 8.005 -11.269 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -9.652 6.117 -9.728 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -9.850 5.614 -11.424 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -8.339 5.247 -10.557 1.00 0.00 H new ATOM 1400 N LEU A 88 -6.320 7.536 -10.139 1.00 0.00 N ATOM 1401 CA LEU A 88 -5.314 8.101 -9.250 1.00 0.00 C ATOM 1402 C LEU A 88 -5.275 9.629 -9.371 1.00 0.00 C ATOM 1403 O LEU A 88 -5.659 10.319 -8.430 1.00 0.00 O ATOM 1404 CB LEU A 88 -3.933 7.471 -9.510 1.00 0.00 C ATOM 1405 CG LEU A 88 -2.903 7.775 -8.410 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -3.145 6.921 -7.159 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -1.496 7.487 -8.948 1.00 0.00 C ATOM 0 H LEU A 88 -5.958 6.829 -10.779 1.00 0.00 H new ATOM 0 HA LEU A 88 -5.591 7.862 -8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.047 6.391 -9.602 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.551 7.833 -10.464 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.003 8.824 -8.131 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -2.398 7.163 -6.403 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.140 7.127 -6.765 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.069 5.865 -7.419 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.760 7.700 -8.173 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.425 6.439 -9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.302 8.117 -9.816 1.00 0.00 H new ATOM 1479 N SER B 3 -17.340 -7.337 -7.540 1.00 0.00 N ATOM 1480 CA SER B 3 -15.934 -7.000 -7.343 1.00 0.00 C ATOM 1481 C SER B 3 -15.705 -6.135 -6.091 1.00 0.00 C ATOM 1482 O SER B 3 -15.248 -4.995 -6.206 1.00 0.00 O ATOM 1483 CB SER B 3 -15.373 -6.345 -8.613 1.00 0.00 C ATOM 1484 OG SER B 3 -15.625 -7.179 -9.726 1.00 0.00 O ATOM 0 HA SER B 3 -15.386 -7.925 -7.162 1.00 0.00 H new ATOM 0 HB2 SER B 3 -15.834 -5.369 -8.765 1.00 0.00 H new ATOM 0 HB3 SER B 3 -14.301 -6.178 -8.506 1.00 0.00 H new ATOM 0 HG SER B 3 -16.418 -7.727 -9.551 1.00 0.00 H new ATOM 1490 N PRO B 4 -15.958 -6.674 -4.884 1.00 0.00 N ATOM 1491 CA PRO B 4 -15.684 -5.981 -3.631 1.00 0.00 C ATOM 1492 C PRO B 4 -14.222 -5.531 -3.537 1.00 0.00 C ATOM 1493 O PRO B 4 -13.940 -4.443 -3.042 1.00 0.00 O ATOM 1494 CB PRO B 4 -16.093 -6.949 -2.515 1.00 0.00 C ATOM 1495 CG PRO B 4 -16.079 -8.322 -3.186 1.00 0.00 C ATOM 1496 CD PRO B 4 -16.483 -8.005 -4.624 1.00 0.00 C ATOM 0 HA PRO B 4 -16.253 -5.055 -3.551 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -15.397 -6.908 -1.677 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -17.080 -6.708 -2.121 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -15.094 -8.786 -3.136 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -16.779 -9.010 -2.712 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -16.068 -8.735 -5.319 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -17.566 -8.031 -4.743 1.00 0.00 H new ATOM 1504 N LEU B 5 -13.287 -6.335 -4.055 1.00 0.00 N ATOM 1505 CA LEU B 5 -11.893 -5.926 -4.173 1.00 0.00 C ATOM 1506 C LEU B 5 -11.796 -4.589 -4.913 1.00 0.00 C ATOM 1507 O LEU B 5 -11.182 -3.643 -4.428 1.00 0.00 O ATOM 1508 CB LEU B 5 -11.090 -7.017 -4.901 1.00 0.00 C ATOM 1509 CG LEU B 5 -9.590 -6.698 -5.030 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -8.917 -6.518 -3.663 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -8.898 -7.840 -5.783 1.00 0.00 C ATOM 0 H LEU B 5 -13.477 -7.276 -4.399 1.00 0.00 H new ATOM 0 HA LEU B 5 -11.471 -5.793 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -11.207 -7.960 -4.367 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -11.509 -7.161 -5.897 1.00 0.00 H new ATOM 0 HG LEU B 5 -9.495 -5.758 -5.574 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -7.860 -6.294 -3.805 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -9.393 -5.696 -3.128 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -9.019 -7.435 -3.083 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -7.834 -7.621 -5.878 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -9.029 -8.771 -5.232 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -9.338 -7.941 -6.775 1.00 0.00 H new ATOM 1523 N ASP B 6 -12.421 -4.505 -6.090 1.00 0.00 N ATOM 1524 CA ASP B 6 -12.362 -3.307 -6.912 1.00 0.00 C ATOM 1525 C ASP B 6 -13.015 -2.131 -6.195 1.00 0.00 C ATOM 1526 O ASP B 6 -12.486 -1.025 -6.227 1.00 0.00 O ATOM 1527 CB ASP B 6 -13.001 -3.553 -8.278 1.00 0.00 C ATOM 1528 CG ASP B 6 -12.821 -2.341 -9.184 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -11.732 -2.250 -9.791 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -13.772 -1.533 -9.251 1.00 0.00 O ATOM 0 H ASP B 6 -12.976 -5.261 -6.492 1.00 0.00 H new ATOM 0 HA ASP B 6 -11.315 -3.055 -7.079 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -12.551 -4.430 -8.743 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -14.063 -3.767 -8.155 1.00 0.00 H new ATOM 1535 N GLN B 7 -14.140 -2.369 -5.517 1.00 0.00 N ATOM 1536 CA GLN B 7 -14.735 -1.351 -4.659 1.00 0.00 C ATOM 1537 C GLN B 7 -13.712 -0.865 -3.625 1.00 0.00 C ATOM 1538 O GLN B 7 -13.564 0.338 -3.428 1.00 0.00 O ATOM 1539 CB GLN B 7 -16.004 -1.885 -3.986 1.00 0.00 C ATOM 1540 CG GLN B 7 -17.125 -2.142 -5.002 1.00 0.00 C ATOM 1541 CD GLN B 7 -18.168 -3.094 -4.428 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -18.786 -2.820 -3.405 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -18.357 -4.237 -5.072 1.00 0.00 N ATOM 0 H GLN B 7 -14.651 -3.251 -5.547 1.00 0.00 H new ATOM 0 HA GLN B 7 -15.024 -0.498 -5.273 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -15.773 -2.810 -3.458 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -16.348 -1.169 -3.239 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -17.598 -1.199 -5.275 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -16.705 -2.563 -5.915 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -17.828 -4.438 -5.921 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -19.031 -4.916 -4.719 1.00 0.00 H new ATOM 1552 N ALA B 8 -12.982 -1.783 -2.981 1.00 0.00 N ATOM 1553 CA ALA B 8 -11.991 -1.424 -1.971 1.00 0.00 C ATOM 1554 C ALA B 8 -10.890 -0.551 -2.574 1.00 0.00 C ATOM 1555 O ALA B 8 -10.557 0.498 -2.012 1.00 0.00 O ATOM 1556 CB ALA B 8 -11.415 -2.678 -1.310 1.00 0.00 C ATOM 0 H ALA B 8 -13.063 -2.786 -3.146 1.00 0.00 H new ATOM 0 HA ALA B 8 -12.486 -0.838 -1.196 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -10.678 -2.389 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -12.218 -3.239 -0.832 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -10.938 -3.301 -2.066 1.00 0.00 H new ATOM 1562 N ILE B 9 -10.351 -0.962 -3.730 1.00 0.00 N ATOM 1563 CA ILE B 9 -9.433 -0.125 -4.498 1.00 0.00 C ATOM 1564 C ILE B 9 -10.072 1.254 -4.688 1.00 0.00 C ATOM 1565 O ILE B 9 -9.448 2.263 -4.376 1.00 0.00 O ATOM 1566 CB ILE B 9 -9.061 -0.754 -5.858 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -8.404 -2.144 -5.762 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -8.152 0.199 -6.648 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -7.047 -2.163 -5.058 1.00 0.00 C ATOM 0 H ILE B 9 -10.539 -1.872 -4.151 1.00 0.00 H new ATOM 0 HA ILE B 9 -8.500 -0.032 -3.942 1.00 0.00 H new ATOM 0 HB ILE B 9 -10.006 -0.907 -6.379 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -9.081 -2.815 -5.234 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -8.281 -2.543 -6.769 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -7.895 -0.254 -7.606 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -8.674 1.140 -6.820 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -7.241 0.387 -6.080 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -6.662 -3.182 -5.038 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -6.349 -1.522 -5.596 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -7.162 -1.798 -4.037 1.00 0.00 H new ATOM 1581 N GLY B 10 -11.315 1.284 -5.173 1.00 0.00 N ATOM 1582 CA GLY B 10 -12.115 2.483 -5.363 1.00 0.00 C ATOM 1583 C GLY B 10 -12.089 3.395 -4.137 1.00 0.00 C ATOM 1584 O GLY B 10 -11.762 4.574 -4.252 1.00 0.00 O ATOM 0 H GLY B 10 -11.807 0.436 -5.454 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -11.745 3.031 -6.229 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -13.145 2.200 -5.581 1.00 0.00 H new ATOM 1588 N LEU B 11 -12.426 2.864 -2.959 1.00 0.00 N ATOM 1589 CA LEU B 11 -12.414 3.646 -1.729 1.00 0.00 C ATOM 1590 C LEU B 11 -11.015 4.216 -1.477 1.00 0.00 C ATOM 1591 O LEU B 11 -10.855 5.428 -1.321 1.00 0.00 O ATOM 1592 CB LEU B 11 -12.885 2.809 -0.528 1.00 0.00 C ATOM 1593 CG LEU B 11 -14.313 2.249 -0.639 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -14.628 1.433 0.620 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -15.363 3.350 -0.820 1.00 0.00 C ATOM 0 H LEU B 11 -12.711 1.892 -2.835 1.00 0.00 H new ATOM 0 HA LEU B 11 -13.113 4.474 -1.848 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -12.195 1.976 -0.393 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -12.822 3.424 0.370 1.00 0.00 H new ATOM 0 HG LEU B 11 -14.356 1.618 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -15.639 1.032 0.550 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -13.917 0.612 0.709 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -14.552 2.075 1.498 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -16.353 2.900 -0.893 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -15.333 4.025 0.035 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -15.151 3.909 -1.731 1.00 0.00 H new ATOM 1607 N LEU B 12 -9.998 3.349 -1.432 1.00 0.00 N ATOM 1608 CA LEU B 12 -8.644 3.764 -1.081 1.00 0.00 C ATOM 1609 C LEU B 12 -8.140 4.828 -2.059 1.00 0.00 C ATOM 1610 O LEU B 12 -7.719 5.917 -1.658 1.00 0.00 O ATOM 1611 CB LEU B 12 -7.728 2.531 -1.022 1.00 0.00 C ATOM 1612 CG LEU B 12 -6.298 2.778 -0.503 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -5.357 3.399 -1.545 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -6.273 3.603 0.791 1.00 0.00 C ATOM 0 H LEU B 12 -10.092 2.354 -1.636 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.641 4.224 -0.093 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -8.200 1.782 -0.386 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -7.662 2.104 -2.023 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.917 1.781 -0.283 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.370 3.542 -1.105 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.277 2.734 -2.405 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.754 4.362 -1.866 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -5.241 3.746 1.111 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -6.736 4.574 0.613 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -6.824 3.076 1.569 1.00 0.00 H new ATOM 1626 N ILE B 13 -8.181 4.515 -3.354 1.00 0.00 N ATOM 1627 CA ILE B 13 -7.720 5.426 -4.383 1.00 0.00 C ATOM 1628 C ILE B 13 -8.551 6.707 -4.347 1.00 0.00 C ATOM 1629 O ILE B 13 -7.990 7.789 -4.458 1.00 0.00 O ATOM 1630 CB ILE B 13 -7.673 4.738 -5.761 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -6.638 5.453 -6.642 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -9.036 4.688 -6.462 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -6.513 4.796 -8.016 1.00 0.00 C ATOM 0 H ILE B 13 -8.534 3.627 -3.710 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.689 5.719 -4.184 1.00 0.00 H new ATOM 0 HB ILE B 13 -7.383 3.700 -5.600 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -6.923 6.498 -6.763 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.668 5.443 -6.145 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -8.931 4.191 -7.426 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -9.743 4.135 -5.844 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -9.404 5.703 -6.615 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -5.771 5.331 -8.609 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -6.202 3.758 -7.896 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -7.477 4.829 -8.524 1.00 0.00 H new ATOM 1645 N GLY B 14 -9.866 6.602 -4.133 1.00 0.00 N ATOM 1646 CA GLY B 14 -10.754 7.741 -3.962 1.00 0.00 C ATOM 1647 C GLY B 14 -10.261 8.670 -2.854 1.00 0.00 C ATOM 1648 O GLY B 14 -10.186 9.880 -3.046 1.00 0.00 O ATOM 0 H GLY B 14 -10.346 5.704 -4.074 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -10.823 8.294 -4.899 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -11.758 7.389 -3.724 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.906 8.117 -1.691 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.336 8.911 -0.608 1.00 0.00 C ATOM 1654 C ILE B 15 -8.044 9.579 -1.098 1.00 0.00 C ATOM 1655 O ILE B 15 -7.903 10.801 -1.026 1.00 0.00 O ATOM 1656 CB ILE B 15 -9.133 8.037 0.644 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.496 7.571 1.193 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.375 8.805 1.739 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -10.381 6.275 1.998 1.00 0.00 C ATOM 0 H ILE B 15 -10.004 7.124 -1.479 1.00 0.00 H new ATOM 0 HA ILE B 15 -10.021 9.706 -0.315 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.540 7.170 0.354 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -10.918 8.353 1.824 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -11.188 7.422 0.364 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.246 8.163 2.611 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -7.397 9.106 1.362 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -8.943 9.691 2.022 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -11.366 5.986 2.364 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -9.984 5.485 1.361 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -9.710 6.430 2.843 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.098 8.786 -1.613 1.00 0.00 N ATOM 1672 CA PHE B 16 -5.806 9.307 -2.057 1.00 0.00 C ATOM 1673 C PHE B 16 -5.948 10.352 -3.179 1.00 0.00 C ATOM 1674 O PHE B 16 -5.118 11.257 -3.330 1.00 0.00 O ATOM 1675 CB PHE B 16 -4.881 8.152 -2.459 1.00 0.00 C ATOM 1676 CG PHE B 16 -3.433 8.574 -2.619 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -2.649 8.840 -1.482 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -2.912 8.843 -3.897 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -1.352 9.365 -1.620 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -1.627 9.398 -4.036 1.00 0.00 C ATOM 1681 CZ PHE B 16 -0.845 9.657 -2.898 1.00 0.00 C ATOM 0 H PHE B 16 -7.206 7.779 -1.732 1.00 0.00 H new ATOM 0 HA PHE B 16 -5.351 9.833 -1.218 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -4.943 7.367 -1.706 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.233 7.722 -3.397 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -3.045 8.640 -0.498 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -3.501 8.623 -4.775 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -0.746 9.544 -0.744 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.241 9.625 -5.019 1.00 0.00 H new ATOM 0 HZ PHE B 16 0.143 10.079 -3.005 1.00 0.00 H new ATOM 1691 N HIS B 17 -7.019 10.247 -3.969 1.00 0.00 N ATOM 1692 CA HIS B 17 -7.332 11.178 -5.035 1.00 0.00 C ATOM 1693 C HIS B 17 -7.428 12.607 -4.504 1.00 0.00 C ATOM 1694 O HIS B 17 -7.109 13.540 -5.232 1.00 0.00 O ATOM 1695 CB HIS B 17 -8.610 10.774 -5.778 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.823 11.572 -7.038 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -8.277 11.291 -8.268 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -9.526 12.742 -7.152 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -8.654 12.269 -9.108 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -9.417 13.177 -8.476 1.00 0.00 N ATOM 0 H HIS B 17 -7.701 9.494 -3.877 1.00 0.00 H new ATOM 0 HA HIS B 17 -6.514 11.142 -5.754 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -8.562 9.714 -6.027 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -9.467 10.907 -5.118 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -7.693 10.488 -8.500 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -10.067 13.239 -6.361 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -8.381 12.319 -10.152 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.833 12.797 -3.242 1.00 0.00 N ATOM 1709 CA LYS B 18 -7.871 14.129 -2.649 1.00 0.00 C ATOM 1710 C LYS B 18 -6.500 14.806 -2.764 1.00 0.00 C ATOM 1711 O LYS B 18 -6.411 15.985 -3.099 1.00 0.00 O ATOM 1712 CB LYS B 18 -8.311 14.033 -1.183 1.00 0.00 C ATOM 1713 CG LYS B 18 -8.635 15.425 -0.617 1.00 0.00 C ATOM 1714 CD LYS B 18 -9.124 15.397 0.839 1.00 0.00 C ATOM 1715 CE LYS B 18 -8.048 14.898 1.812 1.00 0.00 C ATOM 1716 NZ LYS B 18 -8.100 13.436 1.995 1.00 0.00 N ATOM 0 H LYS B 18 -8.136 12.048 -2.620 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.594 14.739 -3.191 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -9.188 13.390 -1.103 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -7.521 13.570 -0.591 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -7.745 16.050 -0.681 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -9.398 15.893 -1.239 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -9.438 16.399 1.132 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -10.001 14.754 0.912 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -7.064 15.181 1.439 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -8.177 15.388 2.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -7.133 13.063 2.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -8.638 13.213 2.856 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -8.565 13.000 1.173 1.00 0.00 H new ATOM 1730 N TYR B 19 -5.431 14.055 -2.483 1.00 0.00 N ATOM 1731 CA TYR B 19 -4.073 14.574 -2.541 1.00 0.00 C ATOM 1732 C TYR B 19 -3.635 14.645 -4.002 1.00 0.00 C ATOM 1733 O TYR B 19 -3.173 15.681 -4.474 1.00 0.00 O ATOM 1734 CB TYR B 19 -3.141 13.693 -1.699 1.00 0.00 C ATOM 1735 CG TYR B 19 -3.685 13.335 -0.326 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -4.087 14.341 0.573 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -3.889 11.985 0.009 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -4.645 13.994 1.816 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -4.516 11.640 1.218 1.00 0.00 C ATOM 1740 CZ TYR B 19 -4.898 12.648 2.119 1.00 0.00 C ATOM 1741 OH TYR B 19 -5.604 12.331 3.241 1.00 0.00 O ATOM 0 H TYR B 19 -5.489 13.074 -2.210 1.00 0.00 H new ATOM 0 HA TYR B 19 -4.029 15.579 -2.122 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -2.938 12.773 -2.247 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -2.188 14.208 -1.576 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -3.967 15.381 0.307 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -3.562 11.209 -0.667 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -4.879 14.763 2.537 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -4.704 10.603 1.454 1.00 0.00 H new ATOM 0 HH TYR B 19 -5.694 11.357 3.307 1.00 0.00 H new ATOM 1751 N SER B 20 -3.825 13.542 -4.730 1.00 0.00 N ATOM 1752 CA SER B 20 -3.462 13.441 -6.141 1.00 0.00 C ATOM 1753 C SER B 20 -4.044 14.596 -6.965 1.00 0.00 C ATOM 1754 O SER B 20 -3.401 15.111 -7.876 1.00 0.00 O ATOM 1755 CB SER B 20 -3.936 12.101 -6.699 1.00 0.00 C ATOM 1756 OG SER B 20 -3.651 11.045 -5.800 1.00 0.00 O ATOM 0 H SER B 20 -4.238 12.689 -4.352 1.00 0.00 H new ATOM 0 HA SER B 20 -2.376 13.505 -6.214 1.00 0.00 H new ATOM 0 HB2 SER B 20 -5.009 12.142 -6.889 1.00 0.00 H new ATOM 0 HB3 SER B 20 -3.450 11.909 -7.656 1.00 0.00 H new ATOM 0 HG SER B 20 -2.698 11.058 -5.572 1.00 0.00 H new ATOM 1762 N GLY B 21 -5.270 15.004 -6.633 1.00 0.00 N ATOM 1763 CA GLY B 21 -6.008 16.068 -7.289 1.00 0.00 C ATOM 1764 C GLY B 21 -5.262 17.402 -7.301 1.00 0.00 C ATOM 1765 O GLY B 21 -5.543 18.239 -8.157 1.00 0.00 O ATOM 0 H GLY B 21 -5.792 14.580 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -6.225 15.771 -8.315 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -6.966 16.200 -6.786 1.00 0.00 H new ATOM 1769 N LYS B 22 -4.310 17.621 -6.384 1.00 0.00 N ATOM 1770 CA LYS B 22 -3.493 18.828 -6.438 1.00 0.00 C ATOM 1771 C LYS B 22 -2.644 18.869 -7.714 1.00 0.00 C ATOM 1772 O LYS B 22 -2.219 19.949 -8.123 1.00 0.00 O ATOM 1773 CB LYS B 22 -2.604 18.945 -5.195 1.00 0.00 C ATOM 1774 CG LYS B 22 -3.356 18.872 -3.860 1.00 0.00 C ATOM 1775 CD LYS B 22 -4.486 19.892 -3.683 1.00 0.00 C ATOM 1776 CE LYS B 22 -5.035 19.752 -2.256 1.00 0.00 C ATOM 1777 NZ LYS B 22 -6.163 20.664 -2.001 1.00 0.00 N ATOM 0 H LYS B 22 -4.094 16.989 -5.613 1.00 0.00 H new ATOM 0 HA LYS B 22 -4.170 19.682 -6.457 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -1.860 18.149 -5.221 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -2.062 19.890 -5.240 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.774 17.871 -3.752 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.638 19.007 -3.051 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -4.116 20.903 -3.851 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -5.276 19.716 -4.414 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -5.357 18.724 -2.092 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -4.238 19.954 -1.541 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -6.457 20.583 -1.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -5.870 21.642 -2.197 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -6.960 20.411 -2.619 1.00 0.00 H new ATOM 1791 N GLU B 23 -2.375 17.712 -8.335 1.00 0.00 N ATOM 1792 CA GLU B 23 -1.679 17.558 -9.608 1.00 0.00 C ATOM 1793 C GLU B 23 -0.177 17.794 -9.440 1.00 0.00 C ATOM 1794 O GLU B 23 0.622 16.910 -9.740 1.00 0.00 O ATOM 1795 CB GLU B 23 -2.330 18.422 -10.705 1.00 0.00 C ATOM 1796 CG GLU B 23 -2.043 17.910 -12.126 1.00 0.00 C ATOM 1797 CD GLU B 23 -0.576 18.021 -12.534 1.00 0.00 C ATOM 1798 OE1 GLU B 23 -0.001 19.106 -12.298 1.00 0.00 O ATOM 1799 OE2 GLU B 23 -0.059 17.022 -13.079 1.00 0.00 O ATOM 0 H GLU B 23 -2.654 16.815 -7.937 1.00 0.00 H new ATOM 0 HA GLU B 23 -1.782 16.527 -9.947 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -3.408 18.449 -10.546 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -1.969 19.446 -10.614 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -2.353 16.867 -12.196 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -2.652 18.472 -12.835 1.00 0.00 H new ATOM 1806 N GLY B 24 0.218 18.961 -8.926 1.00 0.00 N ATOM 1807 CA GLY B 24 1.609 19.301 -8.652 1.00 0.00 C ATOM 1808 C GLY B 24 2.296 18.258 -7.764 1.00 0.00 C ATOM 1809 O GLY B 24 3.497 18.030 -7.885 1.00 0.00 O ATOM 0 H GLY B 24 -0.435 19.707 -8.686 1.00 0.00 H new ATOM 0 HA2 GLY B 24 2.152 19.389 -9.593 1.00 0.00 H new ATOM 0 HA3 GLY B 24 1.654 20.276 -8.166 1.00 0.00 H new ATOM 1813 N ASP B 25 1.531 17.606 -6.882 1.00 0.00 N ATOM 1814 CA ASP B 25 2.030 16.533 -6.028 1.00 0.00 C ATOM 1815 C ASP B 25 2.470 15.298 -6.827 1.00 0.00 C ATOM 1816 O ASP B 25 3.145 14.438 -6.265 1.00 0.00 O ATOM 1817 CB ASP B 25 0.953 16.129 -5.014 1.00 0.00 C ATOM 1818 CG ASP B 25 -0.107 15.251 -5.667 1.00 0.00 C ATOM 1819 OD1 ASP B 25 -0.921 15.828 -6.420 1.00 0.00 O ATOM 1820 OD2 ASP B 25 -0.033 14.019 -5.459 1.00 0.00 O ATOM 0 H ASP B 25 0.542 17.813 -6.743 1.00 0.00 H new ATOM 0 HA ASP B 25 2.909 16.919 -5.512 1.00 0.00 H new ATOM 0 HB2 ASP B 25 1.413 15.594 -4.183 1.00 0.00 H new ATOM 0 HB3 ASP B 25 0.486 17.022 -4.599 1.00 0.00 H new ATOM 1825 N LYS B 26 2.045 15.173 -8.091 1.00 0.00 N ATOM 1826 CA LYS B 26 2.271 14.047 -8.993 1.00 0.00 C ATOM 1827 C LYS B 26 1.415 12.850 -8.574 1.00 0.00 C ATOM 1828 O LYS B 26 0.514 12.435 -9.297 1.00 0.00 O ATOM 1829 CB LYS B 26 3.762 13.677 -9.104 1.00 0.00 C ATOM 1830 CG LYS B 26 4.642 14.893 -9.437 1.00 0.00 C ATOM 1831 CD LYS B 26 6.141 14.566 -9.360 1.00 0.00 C ATOM 1832 CE LYS B 26 6.606 14.069 -7.979 1.00 0.00 C ATOM 1833 NZ LYS B 26 6.080 14.892 -6.873 1.00 0.00 N ATOM 0 H LYS B 26 1.497 15.909 -8.536 1.00 0.00 H new ATOM 0 HA LYS B 26 1.962 14.354 -9.992 1.00 0.00 H new ATOM 0 HB2 LYS B 26 4.096 13.236 -8.164 1.00 0.00 H new ATOM 0 HB3 LYS B 26 3.889 12.917 -9.875 1.00 0.00 H new ATOM 0 HG2 LYS B 26 4.401 15.250 -10.438 1.00 0.00 H new ATOM 0 HG3 LYS B 26 4.413 15.704 -8.746 1.00 0.00 H new ATOM 0 HD2 LYS B 26 6.375 13.806 -10.105 1.00 0.00 H new ATOM 0 HD3 LYS B 26 6.710 15.457 -9.624 1.00 0.00 H new ATOM 0 HE2 LYS B 26 6.286 13.036 -7.842 1.00 0.00 H new ATOM 0 HE3 LYS B 26 7.695 14.073 -7.944 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 6.600 14.672 -5.999 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 6.199 15.899 -7.103 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 5.070 14.685 -6.736 1.00 0.00 H new ATOM 1847 N HIS B 27 1.726 12.300 -7.400 1.00 0.00 N ATOM 1848 CA HIS B 27 1.096 11.136 -6.791 1.00 0.00 C ATOM 1849 C HIS B 27 1.785 10.915 -5.445 1.00 0.00 C ATOM 1850 O HIS B 27 2.338 9.847 -5.170 1.00 0.00 O ATOM 1851 CB HIS B 27 1.201 9.905 -7.708 1.00 0.00 C ATOM 1852 CG HIS B 27 2.585 9.665 -8.261 1.00 0.00 C ATOM 1853 ND1 HIS B 27 3.702 9.331 -7.530 1.00 0.00 N ATOM 1854 CD2 HIS B 27 2.971 9.801 -9.568 1.00 0.00 C ATOM 1855 CE1 HIS B 27 4.738 9.260 -8.383 1.00 0.00 C ATOM 1856 NE2 HIS B 27 4.342 9.535 -9.637 1.00 0.00 N ATOM 0 H HIS B 27 2.470 12.681 -6.816 1.00 0.00 H new ATOM 0 HA HIS B 27 0.029 11.299 -6.642 1.00 0.00 H new ATOM 0 HB2 HIS B 27 0.886 9.023 -7.151 1.00 0.00 H new ATOM 0 HB3 HIS B 27 0.505 10.023 -8.538 1.00 0.00 H new ATOM 0 HD1 HIS B 27 3.737 9.167 -6.524 1.00 0.00 H new ATOM 0 HD2 HIS B 27 2.331 10.066 -10.397 1.00 0.00 H new ATOM 0 HE1 HIS B 27 5.751 9.015 -8.099 1.00 0.00 H new ATOM 1864 N THR B 28 1.803 11.956 -4.614 1.00 0.00 N ATOM 1865 CA THR B 28 2.507 11.949 -3.355 1.00 0.00 C ATOM 1866 C THR B 28 1.639 12.683 -2.342 1.00 0.00 C ATOM 1867 O THR B 28 0.852 13.558 -2.700 1.00 0.00 O ATOM 1868 CB THR B 28 3.904 12.585 -3.498 1.00 0.00 C ATOM 1869 OG1 THR B 28 3.832 13.996 -3.600 1.00 0.00 O ATOM 1870 CG2 THR B 28 4.714 12.049 -4.688 1.00 0.00 C ATOM 0 H THR B 28 1.320 12.833 -4.808 1.00 0.00 H new ATOM 0 HA THR B 28 2.679 10.928 -3.014 1.00 0.00 H new ATOM 0 HB THR B 28 4.425 12.301 -2.584 1.00 0.00 H new ATOM 0 HG1 THR B 28 3.594 14.246 -4.517 1.00 0.00 H new ATOM 0 HG21 THR B 28 5.684 12.545 -4.721 1.00 0.00 H new ATOM 0 HG22 THR B 28 4.859 10.975 -4.575 1.00 0.00 H new ATOM 0 HG23 THR B 28 4.174 12.246 -5.614 1.00 0.00 H new ATOM 1878 N LEU B 29 1.779 12.312 -1.076 1.00 0.00 N ATOM 1879 CA LEU B 29 1.212 13.052 0.029 1.00 0.00 C ATOM 1880 C LEU B 29 2.345 13.972 0.480 1.00 0.00 C ATOM 1881 O LEU B 29 3.280 13.553 1.166 1.00 0.00 O ATOM 1882 CB LEU B 29 0.681 12.082 1.098 1.00 0.00 C ATOM 1883 CG LEU B 29 -0.372 12.721 2.020 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -1.253 11.634 2.644 1.00 0.00 C ATOM 1885 CD2 LEU B 29 0.278 13.534 3.143 1.00 0.00 C ATOM 0 H LEU B 29 2.296 11.480 -0.791 1.00 0.00 H new ATOM 0 HA LEU B 29 0.337 13.651 -0.222 1.00 0.00 H new ATOM 0 HB2 LEU B 29 0.246 11.212 0.607 1.00 0.00 H new ATOM 0 HB3 LEU B 29 1.515 11.723 1.702 1.00 0.00 H new ATOM 0 HG LEU B 29 -0.975 13.392 1.408 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -1.995 12.096 3.295 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.759 11.078 1.855 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -0.633 10.953 3.227 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -0.498 13.970 3.773 1.00 0.00 H new ATOM 0 HD22 LEU B 29 0.911 12.882 3.745 1.00 0.00 H new ATOM 0 HD23 LEU B 29 0.885 14.330 2.712 1.00 0.00 H new ATOM 1897 N SER B 30 2.288 15.217 0.010 1.00 0.00 N ATOM 1898 CA SER B 30 3.358 16.188 0.152 1.00 0.00 C ATOM 1899 C SER B 30 3.140 16.981 1.443 1.00 0.00 C ATOM 1900 O SER B 30 2.056 16.915 2.014 1.00 0.00 O ATOM 1901 CB SER B 30 3.359 17.085 -1.092 1.00 0.00 C ATOM 1902 OG SER B 30 2.918 16.365 -2.234 1.00 0.00 O ATOM 0 H SER B 30 1.477 15.581 -0.490 1.00 0.00 H new ATOM 0 HA SER B 30 4.333 15.706 0.225 1.00 0.00 H new ATOM 0 HB2 SER B 30 2.710 17.945 -0.926 1.00 0.00 H new ATOM 0 HB3 SER B 30 4.363 17.472 -1.266 1.00 0.00 H new ATOM 0 HG SER B 30 3.498 15.587 -2.374 1.00 0.00 H new ATOM 1908 N LYS B 31 4.137 17.729 1.926 1.00 0.00 N ATOM 1909 CA LYS B 31 4.046 18.422 3.213 1.00 0.00 C ATOM 1910 C LYS B 31 2.754 19.248 3.335 1.00 0.00 C ATOM 1911 O LYS B 31 2.096 19.234 4.372 1.00 0.00 O ATOM 1912 CB LYS B 31 5.305 19.275 3.461 1.00 0.00 C ATOM 1913 CG LYS B 31 5.919 19.034 4.849 1.00 0.00 C ATOM 1914 CD LYS B 31 5.044 19.581 5.986 1.00 0.00 C ATOM 1915 CE LYS B 31 5.598 19.216 7.368 1.00 0.00 C ATOM 1916 NZ LYS B 31 6.978 19.693 7.565 1.00 0.00 N ATOM 0 H LYS B 31 5.023 17.870 1.440 1.00 0.00 H new ATOM 0 HA LYS B 31 3.998 17.665 3.996 1.00 0.00 H new ATOM 0 HB2 LYS B 31 6.048 19.051 2.695 1.00 0.00 H new ATOM 0 HB3 LYS B 31 5.050 20.330 3.359 1.00 0.00 H new ATOM 0 HG2 LYS B 31 6.070 17.964 4.994 1.00 0.00 H new ATOM 0 HG3 LYS B 31 6.902 19.504 4.894 1.00 0.00 H new ATOM 0 HD2 LYS B 31 4.974 20.665 5.899 1.00 0.00 H new ATOM 0 HD3 LYS B 31 4.033 19.187 5.886 1.00 0.00 H new ATOM 0 HE2 LYS B 31 4.956 19.643 8.138 1.00 0.00 H new ATOM 0 HE3 LYS B 31 5.569 18.134 7.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 7.119 19.943 8.564 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 7.646 18.942 7.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 7.144 20.531 6.971 1.00 0.00 H new ATOM 1930 N LYS B 32 2.358 19.932 2.259 1.00 0.00 N ATOM 1931 CA LYS B 32 1.094 20.663 2.203 1.00 0.00 C ATOM 1932 C LYS B 32 -0.104 19.736 2.464 1.00 0.00 C ATOM 1933 O LYS B 32 -1.036 20.095 3.179 1.00 0.00 O ATOM 1934 CB LYS B 32 0.953 21.355 0.839 1.00 0.00 C ATOM 1935 CG LYS B 32 2.119 22.289 0.478 1.00 0.00 C ATOM 1936 CD LYS B 32 2.330 23.391 1.528 1.00 0.00 C ATOM 1937 CE LYS B 32 3.325 24.452 1.042 1.00 0.00 C ATOM 1938 NZ LYS B 32 4.665 23.888 0.804 1.00 0.00 N ATOM 0 H LYS B 32 2.907 19.993 1.402 1.00 0.00 H new ATOM 0 HA LYS B 32 1.101 21.418 2.989 1.00 0.00 H new ATOM 0 HB2 LYS B 32 0.862 20.592 0.066 1.00 0.00 H new ATOM 0 HB3 LYS B 32 0.027 21.930 0.831 1.00 0.00 H new ATOM 0 HG2 LYS B 32 3.033 21.704 0.380 1.00 0.00 H new ATOM 0 HG3 LYS B 32 1.928 22.747 -0.493 1.00 0.00 H new ATOM 0 HD2 LYS B 32 1.375 23.864 1.756 1.00 0.00 H new ATOM 0 HD3 LYS B 32 2.695 22.947 2.454 1.00 0.00 H new ATOM 0 HE2 LYS B 32 2.953 24.902 0.122 1.00 0.00 H new ATOM 0 HE3 LYS B 32 3.394 25.249 1.782 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 5.313 24.646 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 5.018 23.451 1.679 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 4.611 23.169 0.055 1.00 0.00 H new ATOM 1952 N GLU B 33 -0.074 18.531 1.895 1.00 0.00 N ATOM 1953 CA GLU B 33 -1.112 17.528 2.067 1.00 0.00 C ATOM 1954 C GLU B 33 -1.067 16.960 3.485 1.00 0.00 C ATOM 1955 O GLU B 33 -2.105 16.680 4.076 1.00 0.00 O ATOM 1956 CB GLU B 33 -0.946 16.420 1.020 1.00 0.00 C ATOM 1957 CG GLU B 33 -0.787 16.973 -0.404 1.00 0.00 C ATOM 1958 CD GLU B 33 -1.858 18.009 -0.719 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -3.032 17.595 -0.827 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -1.486 19.198 -0.821 1.00 0.00 O ATOM 0 H GLU B 33 0.689 18.224 1.291 1.00 0.00 H new ATOM 0 HA GLU B 33 -2.088 17.991 1.922 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -0.074 15.816 1.271 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -1.812 15.759 1.055 1.00 0.00 H new ATOM 0 HG2 GLU B 33 0.200 17.422 -0.514 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -0.847 16.155 -1.122 1.00 0.00 H new ATOM 1967 N LEU B 34 0.135 16.806 4.040 1.00 0.00 N ATOM 1968 CA LEU B 34 0.333 16.420 5.429 1.00 0.00 C ATOM 1969 C LEU B 34 -0.349 17.460 6.327 1.00 0.00 C ATOM 1970 O LEU B 34 -1.157 17.114 7.186 1.00 0.00 O ATOM 1971 CB LEU B 34 1.841 16.268 5.699 1.00 0.00 C ATOM 1972 CG LEU B 34 2.190 15.175 6.721 1.00 0.00 C ATOM 1973 CD1 LEU B 34 3.714 15.029 6.793 1.00 0.00 C ATOM 1974 CD2 LEU B 34 1.653 15.492 8.118 1.00 0.00 C ATOM 0 H LEU B 34 1.006 16.948 3.528 1.00 0.00 H new ATOM 0 HA LEU B 34 -0.123 15.455 5.650 1.00 0.00 H new ATOM 0 HB2 LEU B 34 2.347 16.046 4.759 1.00 0.00 H new ATOM 0 HB3 LEU B 34 2.233 17.221 6.054 1.00 0.00 H new ATOM 0 HG LEU B 34 1.722 14.248 6.389 1.00 0.00 H new ATOM 0 HD11 LEU B 34 3.972 14.255 7.516 1.00 0.00 H new ATOM 0 HD12 LEU B 34 4.100 14.752 5.812 1.00 0.00 H new ATOM 0 HD13 LEU B 34 4.156 15.976 7.102 1.00 0.00 H new ATOM 0 HD21 LEU B 34 1.926 14.690 8.803 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.082 16.430 8.469 1.00 0.00 H new ATOM 0 HD23 LEU B 34 0.567 15.582 8.079 1.00 0.00 H new ATOM 1986 N LYS B 35 -0.072 18.745 6.089 1.00 0.00 N ATOM 1987 CA LYS B 35 -0.714 19.844 6.795 1.00 0.00 C ATOM 1988 C LYS B 35 -2.235 19.798 6.614 1.00 0.00 C ATOM 1989 O LYS B 35 -2.969 19.933 7.589 1.00 0.00 O ATOM 1990 CB LYS B 35 -0.102 21.181 6.349 1.00 0.00 C ATOM 1991 CG LYS B 35 -0.707 22.410 7.047 1.00 0.00 C ATOM 1992 CD LYS B 35 -0.691 22.398 8.586 1.00 0.00 C ATOM 1993 CE LYS B 35 0.716 22.413 9.204 1.00 0.00 C ATOM 1994 NZ LYS B 35 1.319 21.070 9.281 1.00 0.00 N ATOM 0 H LYS B 35 0.610 19.048 5.394 1.00 0.00 H new ATOM 0 HA LYS B 35 -0.531 19.742 7.865 1.00 0.00 H new ATOM 0 HB2 LYS B 35 0.971 21.159 6.540 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -0.232 21.287 5.272 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -0.170 23.295 6.706 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -1.740 22.517 6.717 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -1.244 23.264 8.950 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -1.220 21.511 8.936 1.00 0.00 H new ATOM 0 HE2 LYS B 35 1.361 23.063 8.613 1.00 0.00 H new ATOM 0 HE3 LYS B 35 0.664 22.841 10.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 2.038 21.055 10.032 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 0.580 20.370 9.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 1.765 20.837 8.371 1.00 0.00 H new ATOM 2008 N GLU B 36 -2.717 19.601 5.383 1.00 0.00 N ATOM 2009 CA GLU B 36 -4.141 19.455 5.102 1.00 0.00 C ATOM 2010 C GLU B 36 -4.739 18.346 5.978 1.00 0.00 C ATOM 2011 O GLU B 36 -5.718 18.564 6.690 1.00 0.00 O ATOM 2012 CB GLU B 36 -4.345 19.177 3.603 1.00 0.00 C ATOM 2013 CG GLU B 36 -5.819 19.216 3.180 1.00 0.00 C ATOM 2014 CD GLU B 36 -5.978 18.842 1.707 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -5.871 17.629 1.419 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -6.201 19.770 0.900 1.00 0.00 O ATOM 0 H GLU B 36 -2.126 19.539 4.554 1.00 0.00 H new ATOM 0 HA GLU B 36 -4.664 20.380 5.345 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -3.787 19.913 3.024 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -3.929 18.199 3.361 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -6.396 18.528 3.798 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -6.223 20.214 3.351 1.00 0.00 H new ATOM 2023 N LEU B 37 -4.145 17.154 5.932 1.00 0.00 N ATOM 2024 CA LEU B 37 -4.594 16.000 6.694 1.00 0.00 C ATOM 2025 C LEU B 37 -4.622 16.324 8.188 1.00 0.00 C ATOM 2026 O LEU B 37 -5.626 16.069 8.852 1.00 0.00 O ATOM 2027 CB LEU B 37 -3.689 14.801 6.387 1.00 0.00 C ATOM 2028 CG LEU B 37 -4.050 13.541 7.190 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -5.469 13.053 6.888 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -3.044 12.444 6.823 1.00 0.00 C ATOM 0 H LEU B 37 -3.326 16.965 5.354 1.00 0.00 H new ATOM 0 HA LEU B 37 -5.612 15.742 6.402 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -3.749 14.574 5.323 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -2.655 15.073 6.598 1.00 0.00 H new ATOM 0 HG LEU B 37 -4.010 13.779 8.253 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -5.680 12.161 7.478 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -6.185 13.835 7.143 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -5.554 12.815 5.828 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -3.277 11.536 7.379 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -3.103 12.239 5.754 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.036 12.775 7.074 1.00 0.00 H new ATOM 2042 N ILE B 38 -3.529 16.891 8.711 1.00 0.00 N ATOM 2043 CA ILE B 38 -3.458 17.374 10.085 1.00 0.00 C ATOM 2044 C ILE B 38 -4.656 18.279 10.371 1.00 0.00 C ATOM 2045 O ILE B 38 -5.380 18.039 11.331 1.00 0.00 O ATOM 2046 CB ILE B 38 -2.099 18.062 10.346 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -1.038 16.972 10.580 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -2.144 19.053 11.523 1.00 0.00 C ATOM 2049 CD1 ILE B 38 0.394 17.514 10.634 1.00 0.00 C ATOM 0 H ILE B 38 -2.666 17.026 8.185 1.00 0.00 H new ATOM 0 HA ILE B 38 -3.514 16.537 10.780 1.00 0.00 H new ATOM 0 HB ILE B 38 -1.842 18.659 9.471 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -1.258 16.457 11.515 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -1.108 16.231 9.783 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -1.161 19.504 11.657 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -2.876 19.833 11.314 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -2.428 18.524 12.433 1.00 0.00 H new ATOM 0 HD11 ILE B 38 1.089 16.691 10.801 1.00 0.00 H new ATOM 0 HD12 ILE B 38 0.633 18.004 9.690 1.00 0.00 H new ATOM 0 HD13 ILE B 38 0.480 18.233 11.449 1.00 0.00 H new ATOM 2061 N GLN B 39 -4.876 19.302 9.542 1.00 0.00 N ATOM 2062 CA GLN B 39 -5.969 20.245 9.718 1.00 0.00 C ATOM 2063 C GLN B 39 -7.303 19.504 9.826 1.00 0.00 C ATOM 2064 O GLN B 39 -8.048 19.723 10.776 1.00 0.00 O ATOM 2065 CB GLN B 39 -5.955 21.280 8.584 1.00 0.00 C ATOM 2066 CG GLN B 39 -6.985 22.394 8.810 1.00 0.00 C ATOM 2067 CD GLN B 39 -6.924 23.438 7.699 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -6.638 24.604 7.947 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -7.191 23.032 6.461 1.00 0.00 N ATOM 0 H GLN B 39 -4.294 19.496 8.727 1.00 0.00 H new ATOM 0 HA GLN B 39 -5.837 20.789 10.653 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.960 21.717 8.504 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -6.161 20.782 7.636 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -7.986 21.964 8.853 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -6.802 22.872 9.772 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -7.426 22.055 6.284 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -7.161 23.697 5.688 1.00 0.00 H new ATOM 2078 N LYS B 40 -7.610 18.619 8.869 1.00 0.00 N ATOM 2079 CA LYS B 40 -8.836 17.843 8.917 1.00 0.00 C ATOM 2080 C LYS B 40 -8.940 17.018 10.201 1.00 0.00 C ATOM 2081 O LYS B 40 -9.959 17.078 10.891 1.00 0.00 O ATOM 2082 CB LYS B 40 -8.972 16.949 7.676 1.00 0.00 C ATOM 2083 CG LYS B 40 -8.975 17.693 6.330 1.00 0.00 C ATOM 2084 CD LYS B 40 -9.926 18.896 6.263 1.00 0.00 C ATOM 2085 CE LYS B 40 -11.356 18.487 6.621 1.00 0.00 C ATOM 2086 NZ LYS B 40 -12.297 19.607 6.450 1.00 0.00 N ATOM 0 H LYS B 40 -7.022 18.429 8.058 1.00 0.00 H new ATOM 0 HA LYS B 40 -9.665 18.550 8.919 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -8.152 16.231 7.674 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -9.896 16.378 7.759 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -7.962 18.036 6.118 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -9.245 16.990 5.542 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -9.584 19.672 6.947 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -9.907 19.324 5.261 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -11.665 17.652 5.992 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -11.388 18.138 7.653 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -13.257 19.295 6.701 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -12.016 20.394 7.069 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -12.284 19.923 5.459 1.00 0.00 H new ATOM 2337 N LEU B 56 -0.451 9.386 13.874 1.00 0.00 N ATOM 2338 CA LEU B 56 -0.672 9.532 12.448 1.00 0.00 C ATOM 2339 C LEU B 56 0.567 10.111 11.781 1.00 0.00 C ATOM 2340 O LEU B 56 1.101 9.493 10.867 1.00 0.00 O ATOM 2341 CB LEU B 56 -1.911 10.401 12.189 1.00 0.00 C ATOM 2342 CG LEU B 56 -2.173 10.689 10.702 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -2.349 9.401 9.890 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -3.443 11.536 10.584 1.00 0.00 C ATOM 0 HA LEU B 56 -0.857 8.551 12.012 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -2.785 9.905 12.612 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -1.795 11.348 12.717 1.00 0.00 H new ATOM 0 HG LEU B 56 -1.309 11.219 10.300 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -2.532 9.652 8.845 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -1.445 8.797 9.965 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -3.196 8.837 10.281 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -3.642 11.749 9.534 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -4.285 10.990 11.010 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -3.307 12.473 11.124 1.00 0.00 H new ATOM 2356 N MET B 57 1.025 11.288 12.218 1.00 0.00 N ATOM 2357 CA MET B 57 2.145 11.952 11.568 1.00 0.00 C ATOM 2358 C MET B 57 3.383 11.051 11.593 1.00 0.00 C ATOM 2359 O MET B 57 4.055 10.894 10.575 1.00 0.00 O ATOM 2360 CB MET B 57 2.375 13.353 12.159 1.00 0.00 C ATOM 2361 CG MET B 57 3.050 13.367 13.537 1.00 0.00 C ATOM 2362 SD MET B 57 3.107 14.996 14.321 1.00 0.00 S ATOM 2363 CE MET B 57 4.191 14.636 15.721 1.00 0.00 C ATOM 0 H MET B 57 0.637 11.793 13.014 1.00 0.00 H new ATOM 0 HA MET B 57 1.911 12.118 10.516 1.00 0.00 H new ATOM 0 HB2 MET B 57 2.987 13.929 11.465 1.00 0.00 H new ATOM 0 HB3 MET B 57 1.414 13.862 12.235 1.00 0.00 H new ATOM 0 HG2 MET B 57 2.520 12.678 14.195 1.00 0.00 H new ATOM 0 HG3 MET B 57 4.068 12.990 13.434 1.00 0.00 H new ATOM 0 HE1 MET B 57 4.332 15.540 16.314 1.00 0.00 H new ATOM 0 HE2 MET B 57 3.739 13.862 16.342 1.00 0.00 H new ATOM 0 HE3 MET B 57 5.157 14.288 15.354 1.00 0.00 H new ATOM 2373 N ASP B 58 3.655 10.428 12.745 1.00 0.00 N ATOM 2374 CA ASP B 58 4.773 9.509 12.898 1.00 0.00 C ATOM 2375 C ASP B 58 4.666 8.356 11.896 1.00 0.00 C ATOM 2376 O ASP B 58 5.579 8.131 11.107 1.00 0.00 O ATOM 2377 CB ASP B 58 4.823 8.994 14.341 1.00 0.00 C ATOM 2378 CG ASP B 58 5.941 7.973 14.523 1.00 0.00 C ATOM 2379 OD1 ASP B 58 7.093 8.421 14.708 1.00 0.00 O ATOM 2380 OD2 ASP B 58 5.621 6.766 14.474 1.00 0.00 O ATOM 0 H ASP B 58 3.102 10.551 13.594 1.00 0.00 H new ATOM 0 HA ASP B 58 5.703 10.037 12.688 1.00 0.00 H new ATOM 0 HB2 ASP B 58 4.976 9.830 15.023 1.00 0.00 H new ATOM 0 HB3 ASP B 58 3.867 8.541 14.602 1.00 0.00 H new ATOM 2385 N ASP B 59 3.553 7.621 11.932 1.00 0.00 N ATOM 2386 CA ASP B 59 3.369 6.440 11.098 1.00 0.00 C ATOM 2387 C ASP B 59 3.330 6.805 9.609 1.00 0.00 C ATOM 2388 O ASP B 59 3.794 6.041 8.767 1.00 0.00 O ATOM 2389 CB ASP B 59 2.100 5.699 11.537 1.00 0.00 C ATOM 2390 CG ASP B 59 1.922 4.361 10.821 1.00 0.00 C ATOM 2391 OD1 ASP B 59 2.943 3.664 10.634 1.00 0.00 O ATOM 2392 OD2 ASP B 59 0.759 4.048 10.489 1.00 0.00 O ATOM 0 H ASP B 59 2.760 7.829 12.538 1.00 0.00 H new ATOM 0 HA ASP B 59 4.223 5.776 11.230 1.00 0.00 H new ATOM 0 HB2 ASP B 59 2.137 5.529 12.613 1.00 0.00 H new ATOM 0 HB3 ASP B 59 1.231 6.328 11.344 1.00 0.00 H new ATOM 2397 N LEU B 60 2.755 7.962 9.279 1.00 0.00 N ATOM 2398 CA LEU B 60 2.677 8.476 7.920 1.00 0.00 C ATOM 2399 C LEU B 60 4.073 8.820 7.405 1.00 0.00 C ATOM 2400 O LEU B 60 4.419 8.454 6.283 1.00 0.00 O ATOM 2401 CB LEU B 60 1.727 9.686 7.889 1.00 0.00 C ATOM 2402 CG LEU B 60 1.509 10.376 6.528 1.00 0.00 C ATOM 2403 CD1 LEU B 60 2.656 11.316 6.128 1.00 0.00 C ATOM 2404 CD2 LEU B 60 1.193 9.380 5.407 1.00 0.00 C ATOM 0 H LEU B 60 2.322 8.578 9.967 1.00 0.00 H new ATOM 0 HA LEU B 60 2.272 7.715 7.253 1.00 0.00 H new ATOM 0 HB2 LEU B 60 0.756 9.362 8.263 1.00 0.00 H new ATOM 0 HB3 LEU B 60 2.106 10.431 8.589 1.00 0.00 H new ATOM 0 HG LEU B 60 0.628 11.003 6.669 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.436 11.767 5.160 1.00 0.00 H new ATOM 0 HD12 LEU B 60 2.762 12.100 6.878 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.585 10.749 6.061 1.00 0.00 H new ATOM 0 HD21 LEU B 60 1.049 9.920 4.471 1.00 0.00 H new ATOM 0 HD22 LEU B 60 2.021 8.680 5.298 1.00 0.00 H new ATOM 0 HD23 LEU B 60 0.284 8.831 5.653 1.00 0.00 H new ATOM 2416 N ASP B 61 4.864 9.553 8.194 1.00 0.00 N ATOM 2417 CA ASP B 61 6.157 10.060 7.756 1.00 0.00 C ATOM 2418 C ASP B 61 7.175 8.928 7.581 1.00 0.00 C ATOM 2419 O ASP B 61 8.050 8.733 8.423 1.00 0.00 O ATOM 2420 CB ASP B 61 6.665 11.128 8.736 1.00 0.00 C ATOM 2421 CG ASP B 61 8.011 11.720 8.316 1.00 0.00 C ATOM 2422 OD1 ASP B 61 8.371 11.567 7.127 1.00 0.00 O ATOM 2423 OD2 ASP B 61 8.658 12.330 9.194 1.00 0.00 O ATOM 0 H ASP B 61 4.622 9.808 9.151 1.00 0.00 H new ATOM 0 HA ASP B 61 6.030 10.524 6.778 1.00 0.00 H new ATOM 0 HB2 ASP B 61 5.928 11.928 8.810 1.00 0.00 H new ATOM 0 HB3 ASP B 61 6.760 10.689 9.729 1.00 0.00 H new ATOM 2428 N ARG B 62 7.104 8.218 6.452 1.00 0.00 N ATOM 2429 CA ARG B 62 8.094 7.223 6.058 1.00 0.00 C ATOM 2430 C ARG B 62 9.387 7.939 5.635 1.00 0.00 C ATOM 2431 O ARG B 62 9.753 7.924 4.462 1.00 0.00 O ATOM 2432 CB ARG B 62 7.557 6.312 4.931 1.00 0.00 C ATOM 2433 CG ARG B 62 6.091 5.867 5.054 1.00 0.00 C ATOM 2434 CD ARG B 62 5.695 5.285 6.413 1.00 0.00 C ATOM 2435 NE ARG B 62 6.217 3.928 6.618 1.00 0.00 N ATOM 2436 CZ ARG B 62 5.765 3.105 7.577 1.00 0.00 C ATOM 2437 NH1 ARG B 62 4.858 3.536 8.463 1.00 0.00 N ATOM 2438 NH2 ARG B 62 6.226 1.852 7.645 1.00 0.00 N ATOM 0 H ARG B 62 6.345 8.323 5.779 1.00 0.00 H new ATOM 0 HA ARG B 62 8.309 6.576 6.908 1.00 0.00 H new ATOM 0 HB2 ARG B 62 7.677 6.835 3.982 1.00 0.00 H new ATOM 0 HB3 ARG B 62 8.182 5.420 4.885 1.00 0.00 H new ATOM 0 HG2 ARG B 62 5.450 6.723 4.843 1.00 0.00 H new ATOM 0 HG3 ARG B 62 5.889 5.121 4.285 1.00 0.00 H new ATOM 0 HD2 ARG B 62 6.065 5.936 7.205 1.00 0.00 H new ATOM 0 HD3 ARG B 62 4.608 5.269 6.495 1.00 0.00 H new ATOM 0 HE ARG B 62 6.959 3.595 6.002 1.00 0.00 H new ATOM 0 HH11 ARG B 62 4.508 4.493 8.410 1.00 0.00 H new ATOM 0 HH12 ARG B 62 4.517 2.908 9.190 1.00 0.00 H new ATOM 0 HH21 ARG B 62 6.918 1.526 6.970 1.00 0.00 H new ATOM 0 HH22 ARG B 62 5.886 1.222 8.372 1.00 0.00 H new ATOM 2452 N ASN B 63 10.064 8.596 6.583 1.00 0.00 N ATOM 2453 CA ASN B 63 11.284 9.387 6.403 1.00 0.00 C ATOM 2454 C ASN B 63 11.070 10.672 5.595 1.00 0.00 C ATOM 2455 O ASN B 63 11.441 11.754 6.049 1.00 0.00 O ATOM 2456 CB ASN B 63 12.432 8.547 5.818 1.00 0.00 C ATOM 2457 CG ASN B 63 13.640 9.418 5.486 1.00 0.00 C ATOM 2458 OD1 ASN B 63 13.914 9.688 4.321 1.00 0.00 O ATOM 2459 ND2 ASN B 63 14.370 9.870 6.500 1.00 0.00 N ATOM 0 H ASN B 63 9.755 8.589 7.555 1.00 0.00 H new ATOM 0 HA ASN B 63 11.573 9.704 7.405 1.00 0.00 H new ATOM 0 HB2 ASN B 63 12.722 7.776 6.531 1.00 0.00 H new ATOM 0 HB3 ASN B 63 12.090 8.036 4.918 1.00 0.00 H new ATOM 0 HD21 ASN B 63 15.183 10.459 6.320 1.00 0.00 H new ATOM 0 HD22 ASN B 63 14.117 9.628 7.458 1.00 0.00 H new ATOM 2466 N LYS B 64 10.524 10.566 4.384 1.00 0.00 N ATOM 2467 CA LYS B 64 10.469 11.653 3.417 1.00 0.00 C ATOM 2468 C LYS B 64 9.369 12.667 3.752 1.00 0.00 C ATOM 2469 O LYS B 64 8.444 12.867 2.972 1.00 0.00 O ATOM 2470 CB LYS B 64 10.311 11.066 2.007 1.00 0.00 C ATOM 2471 CG LYS B 64 11.386 10.011 1.710 1.00 0.00 C ATOM 2472 CD LYS B 64 11.362 9.642 0.222 1.00 0.00 C ATOM 2473 CE LYS B 64 12.252 8.426 -0.064 1.00 0.00 C ATOM 2474 NZ LYS B 64 13.654 8.667 0.322 1.00 0.00 N ATOM 0 H LYS B 64 10.100 9.703 4.044 1.00 0.00 H new ATOM 0 HA LYS B 64 11.404 12.212 3.460 1.00 0.00 H new ATOM 0 HB2 LYS B 64 9.323 10.617 1.908 1.00 0.00 H new ATOM 0 HB3 LYS B 64 10.373 11.867 1.270 1.00 0.00 H new ATOM 0 HG2 LYS B 64 12.369 10.395 1.982 1.00 0.00 H new ATOM 0 HG3 LYS B 64 11.212 9.122 2.316 1.00 0.00 H new ATOM 0 HD2 LYS B 64 10.339 9.427 -0.085 1.00 0.00 H new ATOM 0 HD3 LYS B 64 11.701 10.491 -0.371 1.00 0.00 H new ATOM 0 HE2 LYS B 64 11.870 7.561 0.478 1.00 0.00 H new ATOM 0 HE3 LYS B 64 12.204 8.183 -1.126 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 14.246 7.879 -0.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 13.985 9.554 -0.109 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 13.722 8.739 1.357 1.00 0.00 H new ATOM 2488 N ASP B 65 9.493 13.349 4.895 1.00 0.00 N ATOM 2489 CA ASP B 65 8.531 14.340 5.372 1.00 0.00 C ATOM 2490 C ASP B 65 8.118 15.331 4.280 1.00 0.00 C ATOM 2491 O ASP B 65 6.947 15.690 4.183 1.00 0.00 O ATOM 2492 CB ASP B 65 9.114 15.087 6.576 1.00 0.00 C ATOM 2493 CG ASP B 65 8.173 16.194 7.041 1.00 0.00 C ATOM 2494 OD1 ASP B 65 7.199 15.859 7.749 1.00 0.00 O ATOM 2495 OD2 ASP B 65 8.439 17.359 6.668 1.00 0.00 O ATOM 0 H ASP B 65 10.284 13.222 5.526 1.00 0.00 H new ATOM 0 HA ASP B 65 7.629 13.805 5.669 1.00 0.00 H new ATOM 0 HB2 ASP B 65 9.289 14.387 7.393 1.00 0.00 H new ATOM 0 HB3 ASP B 65 10.081 15.515 6.310 1.00 0.00 H new ATOM 2500 N GLN B 66 9.086 15.783 3.473 1.00 0.00 N ATOM 2501 CA GLN B 66 8.848 16.712 2.377 1.00 0.00 C ATOM 2502 C GLN B 66 7.689 16.237 1.502 1.00 0.00 C ATOM 2503 O GLN B 66 6.744 16.985 1.242 1.00 0.00 O ATOM 2504 CB GLN B 66 10.144 16.909 1.574 1.00 0.00 C ATOM 2505 CG GLN B 66 9.984 17.783 0.318 1.00 0.00 C ATOM 2506 CD GLN B 66 9.486 19.193 0.625 1.00 0.00 C ATOM 2507 OE1 GLN B 66 10.269 20.132 0.701 1.00 0.00 O ATOM 2508 NE2 GLN B 66 8.179 19.361 0.795 1.00 0.00 N ATOM 0 H GLN B 66 10.063 15.508 3.569 1.00 0.00 H new ATOM 0 HA GLN B 66 8.555 17.681 2.781 1.00 0.00 H new ATOM 0 HB2 GLN B 66 10.895 17.360 2.223 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.525 15.932 1.276 1.00 0.00 H new ATOM 0 HG2 GLN B 66 10.943 17.847 -0.196 1.00 0.00 H new ATOM 0 HG3 GLN B 66 9.287 17.300 -0.367 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.549 18.562 0.726 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.806 20.289 0.994 1.00 0.00 H new ATOM 2517 N GLU B 67 7.822 15.028 0.974 1.00 0.00 N ATOM 2518 CA GLU B 67 6.730 14.316 0.341 1.00 0.00 C ATOM 2519 C GLU B 67 6.909 12.811 0.486 1.00 0.00 C ATOM 2520 O GLU B 67 7.949 12.289 0.086 1.00 0.00 O ATOM 2521 CB GLU B 67 6.500 14.780 -1.108 1.00 0.00 C ATOM 2522 CG GLU B 67 7.701 14.586 -2.043 1.00 0.00 C ATOM 2523 CD GLU B 67 7.400 15.115 -3.444 1.00 0.00 C ATOM 2524 OE1 GLU B 67 7.035 16.307 -3.535 1.00 0.00 O ATOM 2525 OE2 GLU B 67 7.537 14.320 -4.400 1.00 0.00 O ATOM 0 H GLU B 67 8.702 14.512 0.975 1.00 0.00 H new ATOM 0 HA GLU B 67 5.807 14.566 0.865 1.00 0.00 H new ATOM 0 HB2 GLU B 67 5.647 14.238 -1.517 1.00 0.00 H new ATOM 0 HB3 GLU B 67 6.232 15.836 -1.098 1.00 0.00 H new ATOM 0 HG2 GLU B 67 8.570 15.102 -1.635 1.00 0.00 H new ATOM 0 HG3 GLU B 67 7.956 13.528 -2.098 1.00 0.00 H new ATOM 2532 N VAL B 68 5.893 12.113 0.998 1.00 0.00 N ATOM 2533 CA VAL B 68 5.891 10.661 0.966 1.00 0.00 C ATOM 2534 C VAL B 68 5.128 10.265 -0.294 1.00 0.00 C ATOM 2535 O VAL B 68 4.114 10.877 -0.630 1.00 0.00 O ATOM 2536 CB VAL B 68 5.320 10.050 2.260 1.00 0.00 C ATOM 2537 CG1 VAL B 68 6.175 10.448 3.469 1.00 0.00 C ATOM 2538 CG2 VAL B 68 3.856 10.411 2.531 1.00 0.00 C ATOM 0 H VAL B 68 5.071 12.531 1.434 1.00 0.00 H new ATOM 0 HA VAL B 68 6.904 10.261 0.924 1.00 0.00 H new ATOM 0 HB VAL B 68 5.353 8.971 2.108 1.00 0.00 H new ATOM 0 HG11 VAL B 68 5.755 10.007 4.373 1.00 0.00 H new ATOM 0 HG12 VAL B 68 7.194 10.087 3.329 1.00 0.00 H new ATOM 0 HG13 VAL B 68 6.185 11.534 3.566 1.00 0.00 H new ATOM 0 HG21 VAL B 68 3.531 9.942 3.460 1.00 0.00 H new ATOM 0 HG22 VAL B 68 3.758 11.493 2.618 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.235 10.056 1.708 1.00 0.00 H new ATOM 2548 N ASN B 69 5.605 9.256 -1.019 1.00 0.00 N ATOM 2549 CA ASN B 69 5.081 8.946 -2.342 1.00 0.00 C ATOM 2550 C ASN B 69 3.913 7.983 -2.178 1.00 0.00 C ATOM 2551 O ASN B 69 3.805 7.334 -1.142 1.00 0.00 O ATOM 2552 CB ASN B 69 6.195 8.305 -3.181 1.00 0.00 C ATOM 2553 CG ASN B 69 5.673 7.756 -4.509 1.00 0.00 C ATOM 2554 OD1 ASN B 69 4.927 8.426 -5.215 1.00 0.00 O ATOM 2555 ND2 ASN B 69 6.015 6.515 -4.844 1.00 0.00 N ATOM 0 H ASN B 69 6.356 8.639 -0.709 1.00 0.00 H new ATOM 0 HA ASN B 69 4.738 9.848 -2.848 1.00 0.00 H new ATOM 0 HB2 ASN B 69 6.972 9.044 -3.375 1.00 0.00 H new ATOM 0 HB3 ASN B 69 6.657 7.498 -2.613 1.00 0.00 H new ATOM 0 HD21 ASN B 69 5.655 6.101 -5.704 1.00 0.00 H new ATOM 0 HD22 ASN B 69 6.637 5.977 -4.241 1.00 0.00 H new ATOM 2562 N PHE B 70 3.032 7.884 -3.176 1.00 0.00 N ATOM 2563 CA PHE B 70 1.900 6.963 -3.125 1.00 0.00 C ATOM 2564 C PHE B 70 2.294 5.574 -2.594 1.00 0.00 C ATOM 2565 O PHE B 70 1.619 5.036 -1.724 1.00 0.00 O ATOM 2566 CB PHE B 70 1.204 6.865 -4.489 1.00 0.00 C ATOM 2567 CG PHE B 70 -0.013 5.957 -4.502 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -1.011 6.102 -3.520 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.166 4.983 -5.508 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -2.152 5.285 -3.537 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -1.306 4.161 -5.522 1.00 0.00 C ATOM 2572 CZ PHE B 70 -2.296 4.311 -4.535 1.00 0.00 C ATOM 0 H PHE B 70 3.084 8.435 -4.033 1.00 0.00 H new ATOM 0 HA PHE B 70 1.188 7.377 -2.412 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.902 7.864 -4.803 1.00 0.00 H new ATOM 0 HB3 PHE B 70 1.921 6.503 -5.225 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.898 6.848 -2.747 1.00 0.00 H new ATOM 0 HD2 PHE B 70 0.592 4.868 -6.268 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.916 5.406 -2.784 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -1.422 3.413 -6.292 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.169 3.675 -4.546 1.00 0.00 H new ATOM 2582 N GLN B 71 3.416 5.009 -3.052 1.00 0.00 N ATOM 2583 CA GLN B 71 3.906 3.728 -2.541 1.00 0.00 C ATOM 2584 C GLN B 71 4.161 3.768 -1.022 1.00 0.00 C ATOM 2585 O GLN B 71 3.886 2.806 -0.304 1.00 0.00 O ATOM 2586 CB GLN B 71 5.166 3.328 -3.318 1.00 0.00 C ATOM 2587 CG GLN B 71 5.647 1.920 -2.944 1.00 0.00 C ATOM 2588 CD GLN B 71 6.819 1.493 -3.820 1.00 0.00 C ATOM 2589 OE1 GLN B 71 7.973 1.628 -3.431 1.00 0.00 O ATOM 2590 NE2 GLN B 71 6.537 0.989 -5.018 1.00 0.00 N ATOM 0 H GLN B 71 4.002 5.421 -3.778 1.00 0.00 H new ATOM 0 HA GLN B 71 3.136 2.972 -2.694 1.00 0.00 H new ATOM 0 HB2 GLN B 71 4.961 3.369 -4.388 1.00 0.00 H new ATOM 0 HB3 GLN B 71 5.960 4.048 -3.118 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.946 1.900 -1.896 1.00 0.00 H new ATOM 0 HG3 GLN B 71 4.827 1.210 -3.055 1.00 0.00 H new ATOM 0 HE21 GLN B 71 5.566 0.889 -5.313 1.00 0.00 H new ATOM 0 HE22 GLN B 71 7.292 0.702 -5.641 1.00 0.00 H new ATOM 2599 N GLU B 72 4.700 4.878 -0.520 1.00 0.00 N ATOM 2600 CA GLU B 72 4.963 5.064 0.898 1.00 0.00 C ATOM 2601 C GLU B 72 3.648 5.269 1.657 1.00 0.00 C ATOM 2602 O GLU B 72 3.481 4.714 2.737 1.00 0.00 O ATOM 2603 CB GLU B 72 5.935 6.229 1.103 1.00 0.00 C ATOM 2604 CG GLU B 72 7.295 5.929 0.458 1.00 0.00 C ATOM 2605 CD GLU B 72 8.247 7.113 0.583 1.00 0.00 C ATOM 2606 OE1 GLU B 72 7.984 8.111 -0.124 1.00 0.00 O ATOM 2607 OE2 GLU B 72 9.208 7.001 1.370 1.00 0.00 O ATOM 0 H GLU B 72 4.967 5.677 -1.094 1.00 0.00 H new ATOM 0 HA GLU B 72 5.435 4.168 1.302 1.00 0.00 H new ATOM 0 HB2 GLU B 72 5.516 7.138 0.671 1.00 0.00 H new ATOM 0 HB3 GLU B 72 6.067 6.414 2.169 1.00 0.00 H new ATOM 0 HG2 GLU B 72 7.738 5.053 0.932 1.00 0.00 H new ATOM 0 HG3 GLU B 72 7.153 5.684 -0.595 1.00 0.00 H new ATOM 2614 N TYR B 73 2.699 6.020 1.091 1.00 0.00 N ATOM 2615 CA TYR B 73 1.346 6.120 1.633 1.00 0.00 C ATOM 2616 C TYR B 73 0.722 4.721 1.750 1.00 0.00 C ATOM 2617 O TYR B 73 0.151 4.362 2.774 1.00 0.00 O ATOM 2618 CB TYR B 73 0.492 7.052 0.765 1.00 0.00 C ATOM 2619 CG TYR B 73 -0.984 7.038 1.111 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -1.471 7.822 2.172 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -1.862 6.188 0.409 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -2.834 7.777 2.515 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.223 6.144 0.752 1.00 0.00 C ATOM 2624 CZ TYR B 73 -3.708 6.933 1.807 1.00 0.00 C ATOM 2625 OH TYR B 73 -5.035 6.901 2.115 1.00 0.00 O ATOM 0 H TYR B 73 2.849 6.573 0.247 1.00 0.00 H new ATOM 0 HA TYR B 73 1.389 6.551 2.633 1.00 0.00 H new ATOM 0 HB2 TYR B 73 0.868 8.070 0.865 1.00 0.00 H new ATOM 0 HB3 TYR B 73 0.612 6.769 -0.281 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -0.797 8.460 2.724 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -1.488 5.570 -0.394 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -3.209 8.390 3.321 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -3.897 5.503 0.204 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.492 6.264 1.527 1.00 0.00 H new ATOM 2635 N ILE B 74 0.848 3.914 0.700 1.00 0.00 N ATOM 2636 CA ILE B 74 0.396 2.533 0.691 1.00 0.00 C ATOM 2637 C ILE B 74 1.104 1.741 1.800 1.00 0.00 C ATOM 2638 O ILE B 74 0.458 1.030 2.563 1.00 0.00 O ATOM 2639 CB ILE B 74 0.604 1.954 -0.719 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -0.398 2.532 -1.732 1.00 0.00 C ATOM 2641 CG2 ILE B 74 0.556 0.430 -0.724 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.813 1.952 -1.625 1.00 0.00 C ATOM 0 H ILE B 74 1.273 4.209 -0.179 1.00 0.00 H new ATOM 0 HA ILE B 74 -0.669 2.465 0.912 1.00 0.00 H new ATOM 0 HB ILE B 74 1.604 2.256 -1.030 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -0.450 3.612 -1.597 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.021 2.355 -2.739 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.707 0.065 -1.740 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.341 0.039 -0.077 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.415 0.095 -0.359 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.454 2.415 -2.376 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.778 0.875 -1.792 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.214 2.153 -0.632 1.00 0.00 H new ATOM 2654 N THR B 75 2.423 1.875 1.936 1.00 0.00 N ATOM 2655 CA THR B 75 3.151 1.230 3.029 1.00 0.00 C ATOM 2656 C THR B 75 2.600 1.683 4.392 1.00 0.00 C ATOM 2657 O THR B 75 2.406 0.865 5.290 1.00 0.00 O ATOM 2658 CB THR B 75 4.656 1.504 2.889 1.00 0.00 C ATOM 2659 OG1 THR B 75 5.093 1.152 1.590 1.00 0.00 O ATOM 2660 CG2 THR B 75 5.472 0.688 3.895 1.00 0.00 C ATOM 0 H THR B 75 3.008 2.423 1.305 1.00 0.00 H new ATOM 0 HA THR B 75 3.005 0.151 2.973 1.00 0.00 H new ATOM 0 HB THR B 75 4.809 2.567 3.077 1.00 0.00 H new ATOM 0 HG1 THR B 75 4.753 1.804 0.942 1.00 0.00 H new ATOM 0 HG21 THR B 75 6.532 0.907 3.767 1.00 0.00 H new ATOM 0 HG22 THR B 75 5.167 0.950 4.908 1.00 0.00 H new ATOM 0 HG23 THR B 75 5.299 -0.375 3.727 1.00 0.00 H new ATOM 2668 N PHE B 76 2.307 2.978 4.535 1.00 0.00 N ATOM 2669 CA PHE B 76 1.629 3.534 5.698 1.00 0.00 C ATOM 2670 C PHE B 76 0.279 2.844 5.916 1.00 0.00 C ATOM 2671 O PHE B 76 -0.020 2.469 7.047 1.00 0.00 O ATOM 2672 CB PHE B 76 1.510 5.063 5.576 1.00 0.00 C ATOM 2673 CG PHE B 76 0.332 5.677 6.303 1.00 0.00 C ATOM 2674 CD1 PHE B 76 0.338 5.742 7.707 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -0.807 6.095 5.589 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -0.768 6.268 8.394 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -1.911 6.626 6.275 1.00 0.00 C ATOM 2678 CZ PHE B 76 -1.889 6.721 7.677 1.00 0.00 C ATOM 0 H PHE B 76 2.540 3.678 3.831 1.00 0.00 H new ATOM 0 HA PHE B 76 2.226 3.338 6.589 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.427 5.514 5.956 1.00 0.00 H new ATOM 0 HB3 PHE B 76 1.441 5.323 4.520 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.196 5.386 8.259 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -0.832 6.007 4.513 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.757 6.324 9.472 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -2.778 6.962 5.725 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.733 7.142 8.203 1.00 0.00 H new ATOM 2688 N LEU B 77 -0.518 2.627 4.862 1.00 0.00 N ATOM 2689 CA LEU B 77 -1.747 1.838 4.965 1.00 0.00 C ATOM 2690 C LEU B 77 -1.391 0.479 5.577 1.00 0.00 C ATOM 2691 O LEU B 77 -1.992 0.047 6.560 1.00 0.00 O ATOM 2692 CB LEU B 77 -2.398 1.675 3.578 1.00 0.00 C ATOM 2693 CG LEU B 77 -3.899 1.339 3.579 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -4.291 0.928 2.156 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -4.291 0.194 4.517 1.00 0.00 C ATOM 0 H LEU B 77 -0.331 2.989 3.927 1.00 0.00 H new ATOM 0 HA LEU B 77 -2.472 2.344 5.603 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -2.252 2.599 3.018 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -1.869 0.889 3.039 1.00 0.00 H new ATOM 0 HG LEU B 77 -4.417 2.230 3.933 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.353 0.684 2.127 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.090 1.752 1.471 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.710 0.056 1.856 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -5.366 0.024 4.455 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -3.763 -0.713 4.224 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.024 0.455 5.541 1.00 0.00 H new ATOM 2707 N GLY B 78 -0.376 -0.171 5.004 1.00 0.00 N ATOM 2708 CA GLY B 78 0.175 -1.416 5.504 1.00 0.00 C ATOM 2709 C GLY B 78 0.390 -1.368 7.011 1.00 0.00 C ATOM 2710 O GLY B 78 -0.197 -2.169 7.727 1.00 0.00 O ATOM 0 H GLY B 78 0.090 0.167 4.162 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -0.498 -2.237 5.258 1.00 0.00 H new ATOM 0 HA3 GLY B 78 1.123 -1.621 5.007 1.00 0.00 H new ATOM 2714 N ALA B 79 1.200 -0.425 7.498 1.00 0.00 N ATOM 2715 CA ALA B 79 1.465 -0.267 8.924 1.00 0.00 C ATOM 2716 C ALA B 79 0.166 -0.062 9.717 1.00 0.00 C ATOM 2717 O ALA B 79 -0.096 -0.759 10.698 1.00 0.00 O ATOM 2718 CB ALA B 79 2.435 0.898 9.132 1.00 0.00 C ATOM 0 H ALA B 79 1.690 0.250 6.911 1.00 0.00 H new ATOM 0 HA ALA B 79 1.923 -1.181 9.302 1.00 0.00 H new ATOM 0 HB1 ALA B 79 2.635 1.019 10.197 1.00 0.00 H new ATOM 0 HB2 ALA B 79 3.368 0.692 8.608 1.00 0.00 H new ATOM 0 HB3 ALA B 79 1.993 1.814 8.740 1.00 0.00 H new ATOM 2724 N LEU B 80 -0.648 0.900 9.278 1.00 0.00 N ATOM 2725 CA LEU B 80 -1.902 1.286 9.909 1.00 0.00 C ATOM 2726 C LEU B 80 -2.848 0.091 10.055 1.00 0.00 C ATOM 2727 O LEU B 80 -3.594 0.023 11.029 1.00 0.00 O ATOM 2728 CB LEU B 80 -2.546 2.423 9.100 1.00 0.00 C ATOM 2729 CG LEU B 80 -3.880 2.934 9.671 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -3.710 3.544 11.069 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -4.455 3.994 8.725 1.00 0.00 C ATOM 0 H LEU B 80 -0.441 1.448 8.443 1.00 0.00 H new ATOM 0 HA LEU B 80 -1.697 1.643 10.918 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -1.845 3.256 9.046 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.710 2.078 8.079 1.00 0.00 H new ATOM 0 HG LEU B 80 -4.557 2.084 9.758 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -4.676 3.892 11.434 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -3.315 2.790 11.750 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -3.018 4.384 11.018 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -5.401 4.362 9.122 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -3.752 4.822 8.637 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -4.621 3.553 7.742 1.00 0.00 H new ATOM 2743 N ALA B 81 -2.833 -0.836 9.092 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.587 -2.080 9.163 1.00 0.00 C ATOM 2745 C ALA B 81 -2.876 -3.111 10.050 1.00 0.00 C ATOM 2746 O ALA B 81 -3.498 -3.732 10.908 1.00 0.00 O ATOM 2747 CB ALA B 81 -3.806 -2.614 7.744 1.00 0.00 C ATOM 0 H ALA B 81 -2.290 -0.737 8.234 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.557 -1.888 9.622 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -4.370 -3.546 7.789 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -4.363 -1.880 7.161 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.841 -2.796 7.271 1.00 0.00 H new ATOM 2753 N MET B 82 -1.572 -3.297 9.835 1.00 0.00 N ATOM 2754 CA MET B 82 -0.726 -4.313 10.453 1.00 0.00 C ATOM 2755 C MET B 82 -0.830 -4.311 11.977 1.00 0.00 C ATOM 2756 O MET B 82 -0.730 -5.372 12.595 1.00 0.00 O ATOM 2757 CB MET B 82 0.722 -4.102 9.988 1.00 0.00 C ATOM 2758 CG MET B 82 1.731 -5.110 10.553 1.00 0.00 C ATOM 2759 SD MET B 82 3.457 -4.833 10.069 1.00 0.00 S ATOM 2760 CE MET B 82 3.353 -4.944 8.267 1.00 0.00 C ATOM 0 H MET B 82 -1.051 -2.707 9.187 1.00 0.00 H new ATOM 0 HA MET B 82 -1.074 -5.296 10.134 1.00 0.00 H new ATOM 0 HB2 MET B 82 0.750 -4.152 8.900 1.00 0.00 H new ATOM 0 HB3 MET B 82 1.037 -3.097 10.270 1.00 0.00 H new ATOM 0 HG2 MET B 82 1.668 -5.091 11.641 1.00 0.00 H new ATOM 0 HG3 MET B 82 1.438 -6.110 10.234 1.00 0.00 H new ATOM 0 HE1 MET B 82 4.356 -5.025 7.849 1.00 0.00 H new ATOM 0 HE2 MET B 82 2.772 -5.824 7.990 1.00 0.00 H new ATOM 0 HE3 MET B 82 2.868 -4.050 7.875 1.00 0.00 H new ATOM 2770 N ILE B 83 -1.005 -3.134 12.586 1.00 0.00 N ATOM 2771 CA ILE B 83 -1.196 -3.040 14.030 1.00 0.00 C ATOM 2772 C ILE B 83 -2.405 -3.855 14.517 1.00 0.00 C ATOM 2773 O ILE B 83 -2.359 -4.389 15.624 1.00 0.00 O ATOM 2774 CB ILE B 83 -1.212 -1.580 14.516 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -2.228 -0.719 13.750 1.00 0.00 C ATOM 2776 CG2 ILE B 83 0.200 -0.986 14.401 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -2.532 0.597 14.472 1.00 0.00 C ATOM 0 H ILE B 83 -1.018 -2.237 12.100 1.00 0.00 H new ATOM 0 HA ILE B 83 -0.326 -3.503 14.496 1.00 0.00 H new ATOM 0 HB ILE B 83 -1.527 -1.578 15.560 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -1.841 -0.504 12.754 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -3.152 -1.281 13.619 1.00 0.00 H new ATOM 0 HG21 ILE B 83 0.189 0.048 14.745 1.00 0.00 H new ATOM 0 HG22 ILE B 83 0.890 -1.565 15.015 1.00 0.00 H new ATOM 0 HG23 ILE B 83 0.525 -1.019 13.361 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -3.255 1.171 13.893 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -2.944 0.384 15.458 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -1.613 1.174 14.580 1.00 0.00 H new ATOM 2789 N TYR B 84 -3.453 -4.046 13.703 1.00 0.00 N ATOM 2790 CA TYR B 84 -4.536 -4.985 14.015 1.00 0.00 C ATOM 2791 C TYR B 84 -4.044 -6.400 13.684 1.00 0.00 C ATOM 2792 O TYR B 84 -4.659 -7.137 12.915 1.00 0.00 O ATOM 2793 CB TYR B 84 -5.807 -4.625 13.224 1.00 0.00 C ATOM 2794 CG TYR B 84 -6.119 -3.143 13.141 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -6.017 -2.325 14.282 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -6.313 -2.555 11.877 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -5.961 -0.927 14.141 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -6.261 -1.160 11.740 1.00 0.00 C ATOM 2799 CZ TYR B 84 -6.014 -0.354 12.860 1.00 0.00 C ATOM 2800 OH TYR B 84 -5.586 0.923 12.672 1.00 0.00 O ATOM 0 H TYR B 84 -3.572 -3.557 12.816 1.00 0.00 H new ATOM 0 HA TYR B 84 -4.798 -4.931 15.072 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.708 -5.016 12.211 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.656 -5.134 13.681 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -5.982 -2.771 15.265 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.502 -3.177 11.014 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -5.878 -0.297 15.014 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -6.411 -0.707 10.771 1.00 0.00 H new ATOM 0 HH TYR B 84 -4.820 0.925 12.060 1.00 0.00 H new ATOM 2810 N ASN B 85 -2.918 -6.785 14.285 1.00 0.00 N ATOM 2811 CA ASN B 85 -2.150 -7.949 13.876 1.00 0.00 C ATOM 2812 C ASN B 85 -2.950 -9.244 13.878 1.00 0.00 C ATOM 2813 O ASN B 85 -2.760 -10.083 13.001 1.00 0.00 O ATOM 2814 CB ASN B 85 -0.863 -8.057 14.698 1.00 0.00 C ATOM 2815 CG ASN B 85 0.263 -8.617 13.841 1.00 0.00 C ATOM 2816 OD1 ASN B 85 0.720 -9.736 14.040 1.00 0.00 O ATOM 2817 ND2 ASN B 85 0.720 -7.824 12.875 1.00 0.00 N ATOM 0 H ASN B 85 -2.513 -6.288 15.078 1.00 0.00 H new ATOM 0 HA ASN B 85 -1.878 -7.796 12.832 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -0.584 -7.075 15.081 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -1.027 -8.701 15.562 1.00 0.00 H new ATOM 0 HD21 ASN B 85 1.477 -8.142 12.269 1.00 0.00 H new ATOM 0 HD22 ASN B 85 0.314 -6.898 12.740 1.00 0.00 H new ATOM 2824 N GLU B 86 -3.888 -9.383 14.816 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.807 -10.512 14.875 1.00 0.00 C ATOM 2826 C GLU B 86 -5.477 -10.769 13.518 1.00 0.00 C ATOM 2827 O GLU B 86 -5.668 -11.918 13.129 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.872 -10.271 15.958 1.00 0.00 C ATOM 2829 CG GLU B 86 -5.294 -9.885 17.329 1.00 0.00 C ATOM 2830 CD GLU B 86 -4.221 -10.860 17.804 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -4.608 -11.985 18.187 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -3.036 -10.463 17.762 1.00 0.00 O ATOM 0 H GLU B 86 -4.030 -8.704 15.564 1.00 0.00 H new ATOM 0 HA GLU B 86 -4.228 -11.400 15.131 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.544 -9.481 15.623 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -6.473 -11.174 16.070 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -4.870 -8.882 17.272 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -6.099 -9.850 18.063 1.00 0.00 H new ATOM 2839 N ALA B 87 -5.837 -9.701 12.799 1.00 0.00 N ATOM 2840 CA ALA B 87 -6.486 -9.804 11.499 1.00 0.00 C ATOM 2841 C ALA B 87 -5.488 -10.160 10.392 1.00 0.00 C ATOM 2842 O ALA B 87 -5.886 -10.682 9.354 1.00 0.00 O ATOM 2843 CB ALA B 87 -7.210 -8.492 11.188 1.00 0.00 C ATOM 0 H ALA B 87 -5.684 -8.741 13.108 1.00 0.00 H new ATOM 0 HA ALA B 87 -7.213 -10.615 11.538 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -7.697 -8.567 10.215 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -7.960 -8.300 11.955 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -6.490 -7.674 11.172 1.00 0.00 H new ATOM 2849 N LEU B 88 -4.197 -9.876 10.594 1.00 0.00 N ATOM 2850 CA LEU B 88 -3.143 -10.262 9.664 1.00 0.00 C ATOM 2851 C LEU B 88 -2.865 -11.754 9.848 1.00 0.00 C ATOM 2852 O LEU B 88 -2.858 -12.508 8.875 1.00 0.00 O ATOM 2853 CB LEU B 88 -1.900 -9.391 9.912 1.00 0.00 C ATOM 2854 CG LEU B 88 -0.899 -9.355 8.743 1.00 0.00 C ATOM 2855 CD1 LEU B 88 0.159 -8.291 9.052 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -0.189 -10.692 8.496 1.00 0.00 C ATOM 0 H LEU B 88 -3.858 -9.370 11.412 1.00 0.00 H new ATOM 0 HA LEU B 88 -3.444 -10.099 8.629 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -2.223 -8.373 10.128 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -1.387 -9.758 10.801 1.00 0.00 H new ATOM 0 HG LEU B 88 -1.467 -9.129 7.840 1.00 0.00 H new ATOM 0 HD11 LEU B 88 0.880 -8.247 8.236 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -0.323 -7.320 9.162 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.674 -8.548 9.978 1.00 0.00 H new ATOM 0 HD21 LEU B 88 0.500 -10.589 7.658 1.00 0.00 H new ATOM 0 HD22 LEU B 88 0.366 -10.979 9.389 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -0.928 -11.459 8.266 1.00 0.00 H new