USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 864 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 SER OG : rot -119:sc= -3.44! USER MOD Set 1.2: A 38 HIS : no HE2:sc= -49.9! C(o=-53!,f=-57!) USER MOD Set 2.1: A 10 TYR OH : rot 51:sc= -7.54! USER MOD Set 2.2: A 74 GLN : amide:sc= -48.8! C(o=-56!,f=-53!) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 38:sc= -3.55! USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -11.8! C(o=-12!,f=-16!) USER MOD Single : A 22 THR OG1 : rot -53:sc= 0 USER MOD Single : A 24 SER OG : rot -172:sc= -0.21 USER MOD Single : A 26 MET CE :methyl 143:sc= -19.9! (180deg=-21.6!) USER MOD Single : A 27 LYS NZ :NH3+ -103:sc= -4.53! (180deg=-9.16!) USER MOD Single : A 29 LYS NZ :NH3+ 150:sc= -0.0375 (180deg=-0.684) USER MOD Single : A 30 LYS NZ :NH3+ -129:sc= -3.01 (180deg=-5.15!) USER MOD Single : A 35 ASN : amide:sc= -23.4! C(o=-23!,f=-28!) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.464 USER MOD Single : A 41 LYS NZ :NH3+ -107:sc= -33.7! (180deg=-36.4!) USER MOD Single : A 44 ASN : amide:sc= -25.9! C(o=-26!,f=-22!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.483 USER MOD Single : A 56 LYS NZ :NH3+ 148:sc= -0.0537 (180deg=-0.462) USER MOD Single : A 60 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0107) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HE2:sc= -28.1! C(o=-28!,f=-21!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -12.2! C(o=-12!,f=-14!) USER MOD Single : A 72 LYS NZ :NH3+ -175:sc= -0.0208 (180deg=-0.0577) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -2.84! K(o=-2.8!,f=-0.21) USER MOD Single : A 84 LYS NZ :NH3+ 177:sc= 1.43 (180deg=1.42) USER MOD Single : A 85 GLN : amide:sc= -1.72! K(o=-1.7!,f=0) USER MOD Single : A 89 LYS NZ :NH3+ -117:sc= -7.29! (180deg=-10.5!) USER MOD Single : A 91 SER OG : rot -129:sc= -5.39! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= -0.701! C(o=-0.7!,f=-0.82!) USER MOD Single : A 97 LYS NZ :NH3+ -175:sc= -2.58! (180deg=-2.72!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.47) USER MOD Single : A 118 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-0.41) USER MOD Single : A 119 HIS : no HD1:sc= -0.292 X(o=-0.29,f=-0.078) USER MOD Single : A 121 SER OG : rot -15:sc= 0.18 USER MOD Single : A 122 LYS NZ :NH3+ 170:sc= -6.48! (180deg=-7.01!) USER MOD ----------------------------------------------------------------- ATOM 26 N GLN A 4 -1.287 -3.113 9.014 1.00 1.00 N ATOM 27 CA GLN A 4 -1.198 -1.740 8.437 1.00 1.00 C ATOM 28 C GLN A 4 -1.757 -1.728 7.012 1.00 1.00 C ATOM 29 O GLN A 4 -2.236 -2.728 6.514 1.00 1.00 O ATOM 30 CB GLN A 4 0.295 -1.409 8.430 1.00 1.00 C ATOM 31 CG GLN A 4 0.812 -1.355 9.870 1.00 1.00 C ATOM 32 CD GLN A 4 2.189 -2.017 9.943 1.00 1.00 C ATOM 33 OE1 GLN A 4 2.290 -3.217 10.107 1.00 1.00 O ATOM 34 NE2 GLN A 4 3.260 -1.282 9.828 1.00 1.00 N ATOM 0 HA GLN A 4 -1.774 -1.013 9.010 1.00 1.00 H new ATOM 0 HB2 GLN A 4 0.843 -2.162 7.864 1.00 1.00 H new ATOM 0 HB3 GLN A 4 0.464 -0.453 7.935 1.00 1.00 H new ATOM 0 HG2 GLN A 4 0.876 -0.320 10.206 1.00 1.00 H new ATOM 0 HG3 GLN A 4 0.116 -1.864 10.537 1.00 1.00 H new ATOM 0 HE21 GLN A 4 3.175 -0.275 9.690 1.00 1.00 H new ATOM 0 HE22 GLN A 4 4.183 -1.714 9.876 1.00 1.00 H new ATOM 43 N ILE A 5 -1.703 -0.604 6.353 1.00 1.00 N ATOM 44 CA ILE A 5 -2.234 -0.529 4.961 1.00 1.00 C ATOM 45 C ILE A 5 -1.084 -0.401 3.959 1.00 1.00 C ATOM 46 O ILE A 5 -0.670 0.686 3.608 1.00 1.00 O ATOM 47 CB ILE A 5 -3.107 0.726 4.942 1.00 1.00 C ATOM 48 CG1 ILE A 5 -4.580 0.320 4.849 1.00 1.00 C ATOM 49 CG2 ILE A 5 -2.740 1.588 3.733 1.00 1.00 C ATOM 50 CD1 ILE A 5 -4.903 -0.688 5.954 1.00 1.00 C ATOM 0 H ILE A 5 -1.315 0.266 6.717 1.00 1.00 H new ATOM 0 HA ILE A 5 -2.794 -1.422 4.683 1.00 1.00 H new ATOM 0 HB ILE A 5 -2.942 1.296 5.857 1.00 1.00 H new ATOM 0 HG12 ILE A 5 -5.217 1.199 4.946 1.00 1.00 H new ATOM 0 HG13 ILE A 5 -4.787 -0.117 3.872 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -3.363 2.482 3.721 1.00 1.00 H new ATOM 0 HG22 ILE A 5 -1.691 1.878 3.798 1.00 1.00 H new ATOM 0 HG23 ILE A 5 -2.904 1.019 2.818 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -5.952 -0.977 5.888 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -4.275 -1.571 5.836 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -4.712 -0.235 6.927 1.00 1.00 H new ATOM 62 N TYR A 6 -0.564 -1.506 3.495 1.00 1.00 N ATOM 63 CA TYR A 6 0.559 -1.450 2.515 1.00 1.00 C ATOM 64 C TYR A 6 0.104 -0.765 1.223 1.00 1.00 C ATOM 65 O TYR A 6 -1.072 -0.562 0.996 1.00 1.00 O ATOM 66 CB TYR A 6 0.923 -2.911 2.248 1.00 1.00 C ATOM 67 CG TYR A 6 1.413 -3.549 3.526 1.00 1.00 C ATOM 68 CD1 TYR A 6 2.154 -2.795 4.446 1.00 1.00 C ATOM 69 CD2 TYR A 6 1.127 -4.894 3.793 1.00 1.00 C ATOM 70 CE1 TYR A 6 2.607 -3.386 5.631 1.00 1.00 C ATOM 71 CE2 TYR A 6 1.580 -5.484 4.978 1.00 1.00 C ATOM 72 CZ TYR A 6 2.321 -4.730 5.897 1.00 1.00 C ATOM 73 OH TYR A 6 2.768 -5.312 7.066 1.00 1.00 O ATOM 0 H TYR A 6 -0.868 -2.445 3.752 1.00 1.00 H new ATOM 0 HA TYR A 6 1.408 -0.880 2.893 1.00 1.00 H new ATOM 0 HB2 TYR A 6 0.054 -3.450 1.870 1.00 1.00 H new ATOM 0 HB3 TYR A 6 1.694 -2.970 1.480 1.00 1.00 H new ATOM 0 HD1 TYR A 6 2.375 -1.758 4.241 1.00 1.00 H new ATOM 0 HD2 TYR A 6 0.557 -5.476 3.084 1.00 1.00 H new ATOM 0 HE1 TYR A 6 3.177 -2.805 6.340 1.00 1.00 H new ATOM 0 HE2 TYR A 6 1.358 -6.521 5.184 1.00 1.00 H new ATOM 0 HH TYR A 6 2.482 -6.249 7.095 1.00 1.00 H new ATOM 83 N SER A 7 1.029 -0.412 0.373 1.00 1.00 N ATOM 84 CA SER A 7 0.656 0.257 -0.907 1.00 1.00 C ATOM 85 C SER A 7 1.047 -0.627 -2.093 1.00 1.00 C ATOM 86 O SER A 7 2.030 -1.339 -2.051 1.00 1.00 O ATOM 87 CB SER A 7 1.455 1.559 -0.921 1.00 1.00 C ATOM 88 OG SER A 7 2.645 1.371 -1.677 1.00 1.00 O ATOM 0 H SER A 7 2.029 -0.558 0.509 1.00 1.00 H new ATOM 0 HA SER A 7 -0.416 0.438 -0.984 1.00 1.00 H new ATOM 0 HB2 SER A 7 0.858 2.361 -1.355 1.00 1.00 H new ATOM 0 HB3 SER A 7 1.701 1.859 0.098 1.00 1.00 H new ATOM 0 HG SER A 7 3.160 2.205 -1.690 1.00 1.00 H new ATOM 94 N ALA A 8 0.284 -0.597 -3.151 1.00 1.00 N ATOM 95 CA ALA A 8 0.619 -1.445 -4.332 1.00 1.00 C ATOM 96 C ALA A 8 0.338 -0.691 -5.634 1.00 1.00 C ATOM 97 O ALA A 8 -0.572 0.109 -5.718 1.00 1.00 O ATOM 98 CB ALA A 8 -0.294 -2.665 -4.212 1.00 1.00 C ATOM 0 H ALA A 8 -0.554 -0.024 -3.250 1.00 1.00 H new ATOM 0 HA ALA A 8 1.673 -1.721 -4.352 1.00 1.00 H new ATOM 0 HB1 ALA A 8 -0.109 -3.341 -5.047 1.00 1.00 H new ATOM 0 HB2 ALA A 8 -0.090 -3.182 -3.274 1.00 1.00 H new ATOM 0 HB3 ALA A 8 -1.335 -2.343 -4.230 1.00 1.00 H new ATOM 104 N ARG A 9 1.116 -0.944 -6.651 1.00 1.00 N ATOM 105 CA ARG A 9 0.899 -0.250 -7.954 1.00 1.00 C ATOM 106 C ARG A 9 1.340 -1.154 -9.107 1.00 1.00 C ATOM 107 O ARG A 9 2.488 -1.539 -9.203 1.00 1.00 O ATOM 108 CB ARG A 9 1.773 1.003 -7.887 1.00 1.00 C ATOM 109 CG ARG A 9 2.742 1.015 -9.071 1.00 1.00 C ATOM 110 CD ARG A 9 2.161 1.870 -10.199 1.00 1.00 C ATOM 111 NE ARG A 9 3.054 3.059 -10.277 1.00 1.00 N ATOM 112 CZ ARG A 9 4.299 2.918 -10.641 1.00 1.00 C ATOM 113 NH1 ARG A 9 4.762 1.735 -10.938 1.00 1.00 N ATOM 114 NH2 ARG A 9 5.082 3.961 -10.709 1.00 1.00 N ATOM 0 H ARG A 9 1.895 -1.603 -6.636 1.00 1.00 H new ATOM 0 HA ARG A 9 -0.149 -0.003 -8.124 1.00 1.00 H new ATOM 0 HB2 ARG A 9 1.148 1.896 -7.906 1.00 1.00 H new ATOM 0 HB3 ARG A 9 2.328 1.022 -6.949 1.00 1.00 H new ATOM 0 HG2 ARG A 9 3.708 1.413 -8.760 1.00 1.00 H new ATOM 0 HG3 ARG A 9 2.915 -0.002 -9.423 1.00 1.00 H new ATOM 0 HD2 ARG A 9 2.147 1.324 -11.142 1.00 1.00 H new ATOM 0 HD3 ARG A 9 1.133 2.161 -9.984 1.00 1.00 H new ATOM 0 HE ARG A 9 2.692 3.984 -10.046 1.00 1.00 H new ATOM 0 HH11 ARG A 9 4.151 0.920 -10.886 1.00 1.00 H new ATOM 0 HH12 ARG A 9 5.735 1.625 -11.223 1.00 1.00 H new ATOM 0 HH21 ARG A 9 4.720 4.886 -10.477 1.00 1.00 H new ATOM 0 HH22 ARG A 9 6.055 3.850 -10.994 1.00 1.00 H new ATOM 127 N TYR A 10 0.436 -1.500 -9.983 1.00 1.00 N ATOM 128 CA TYR A 10 0.806 -2.384 -11.126 1.00 1.00 C ATOM 129 C TYR A 10 0.025 -1.984 -12.380 1.00 1.00 C ATOM 130 O TYR A 10 -0.866 -1.160 -12.331 1.00 1.00 O ATOM 131 CB TYR A 10 0.417 -3.793 -10.678 1.00 1.00 C ATOM 132 CG TYR A 10 -0.806 -3.720 -9.795 1.00 1.00 C ATOM 133 CD1 TYR A 10 -1.729 -2.681 -9.963 1.00 1.00 C ATOM 134 CD2 TYR A 10 -1.015 -4.690 -8.808 1.00 1.00 C ATOM 135 CE1 TYR A 10 -2.862 -2.613 -9.142 1.00 1.00 C ATOM 136 CE2 TYR A 10 -2.147 -4.622 -7.988 1.00 1.00 C ATOM 137 CZ TYR A 10 -3.071 -3.584 -8.155 1.00 1.00 C ATOM 138 OH TYR A 10 -4.188 -3.516 -7.347 1.00 1.00 O ATOM 0 H TYR A 10 -0.541 -1.209 -9.957 1.00 1.00 H new ATOM 0 HA TYR A 10 1.864 -2.313 -11.377 1.00 1.00 H new ATOM 0 HB2 TYR A 10 0.215 -4.420 -11.547 1.00 1.00 H new ATOM 0 HB3 TYR A 10 1.243 -4.255 -10.137 1.00 1.00 H new ATOM 0 HD1 TYR A 10 -1.568 -1.933 -10.725 1.00 1.00 H new ATOM 0 HD2 TYR A 10 -0.302 -5.491 -8.679 1.00 1.00 H new ATOM 0 HE1 TYR A 10 -3.574 -1.812 -9.270 1.00 1.00 H new ATOM 0 HE2 TYR A 10 -2.308 -5.371 -7.226 1.00 1.00 H new ATOM 0 HH TYR A 10 -4.989 -3.417 -7.903 1.00 1.00 H new ATOM 148 N SER A 11 0.352 -2.561 -13.504 1.00 1.00 N ATOM 149 CA SER A 11 -0.373 -2.212 -14.759 1.00 1.00 C ATOM 150 C SER A 11 -0.377 -0.693 -14.957 1.00 1.00 C ATOM 151 O SER A 11 -1.300 -0.131 -15.512 1.00 1.00 O ATOM 152 CB SER A 11 -1.795 -2.732 -14.551 1.00 1.00 C ATOM 153 OG SER A 11 -2.723 -1.704 -14.871 1.00 1.00 O ATOM 0 H SER A 11 1.089 -3.258 -13.608 1.00 1.00 H new ATOM 0 HA SER A 11 0.093 -2.647 -15.643 1.00 1.00 H new ATOM 0 HB2 SER A 11 -1.971 -3.605 -15.180 1.00 1.00 H new ATOM 0 HB3 SER A 11 -1.930 -3.051 -13.518 1.00 1.00 H new ATOM 0 HG SER A 11 -2.398 -1.200 -15.646 1.00 1.00 H new ATOM 159 N GLY A 12 0.649 -0.027 -14.503 1.00 1.00 N ATOM 160 CA GLY A 12 0.708 1.454 -14.660 1.00 1.00 C ATOM 161 C GLY A 12 -0.169 2.112 -13.593 1.00 1.00 C ATOM 162 O GLY A 12 -0.068 3.295 -13.333 1.00 1.00 O ATOM 0 H GLY A 12 1.450 -0.445 -14.030 1.00 1.00 H new ATOM 0 HA2 GLY A 12 1.737 1.800 -14.565 1.00 1.00 H new ATOM 0 HA3 GLY A 12 0.366 1.739 -15.655 1.00 1.00 H new ATOM 166 N VAL A 13 -1.039 1.355 -12.981 1.00 1.00 N ATOM 167 CA VAL A 13 -1.935 1.930 -11.937 1.00 1.00 C ATOM 168 C VAL A 13 -1.267 1.867 -10.562 1.00 1.00 C ATOM 169 O VAL A 13 -0.461 1.000 -10.290 1.00 1.00 O ATOM 170 CB VAL A 13 -3.186 1.052 -11.966 1.00 1.00 C ATOM 171 CG1 VAL A 13 -4.398 1.900 -12.358 1.00 1.00 C ATOM 172 CG2 VAL A 13 -2.996 -0.070 -12.990 1.00 1.00 C ATOM 0 H VAL A 13 -1.168 0.359 -13.160 1.00 1.00 H new ATOM 0 HA VAL A 13 -2.165 2.979 -12.125 1.00 1.00 H new ATOM 0 HB VAL A 13 -3.350 0.621 -10.978 1.00 1.00 H new ATOM 0 HG11 VAL A 13 -5.289 1.273 -12.378 1.00 1.00 H new ATOM 0 HG12 VAL A 13 -4.533 2.700 -11.630 1.00 1.00 H new ATOM 0 HG13 VAL A 13 -4.236 2.332 -13.345 1.00 1.00 H new ATOM 0 HG21 VAL A 13 -3.887 -0.697 -13.012 1.00 1.00 H new ATOM 0 HG22 VAL A 13 -2.832 0.362 -13.977 1.00 1.00 H new ATOM 0 HG23 VAL A 13 -2.133 -0.675 -12.711 1.00 1.00 H new ATOM 182 N ASP A 14 -1.614 2.771 -9.687 1.00 1.00 N ATOM 183 CA ASP A 14 -1.021 2.761 -8.319 1.00 1.00 C ATOM 184 C ASP A 14 -2.089 2.347 -7.305 1.00 1.00 C ATOM 185 O ASP A 14 -3.127 2.970 -7.197 1.00 1.00 O ATOM 186 CB ASP A 14 -0.567 4.199 -8.069 1.00 1.00 C ATOM 187 CG ASP A 14 -0.496 4.456 -6.563 1.00 1.00 C ATOM 188 OD1 ASP A 14 -0.450 3.492 -5.818 1.00 1.00 O ATOM 189 OD2 ASP A 14 -0.487 5.616 -6.179 1.00 1.00 O ATOM 0 H ASP A 14 -2.285 3.519 -9.861 1.00 1.00 H new ATOM 0 HA ASP A 14 -0.193 2.059 -8.225 1.00 1.00 H new ATOM 0 HB2 ASP A 14 0.409 4.368 -8.524 1.00 1.00 H new ATOM 0 HB3 ASP A 14 -1.262 4.897 -8.536 1.00 1.00 H new ATOM 194 N VAL A 15 -1.854 1.299 -6.566 1.00 1.00 N ATOM 195 CA VAL A 15 -2.872 0.856 -5.572 1.00 1.00 C ATOM 196 C VAL A 15 -2.217 0.567 -4.220 1.00 1.00 C ATOM 197 O VAL A 15 -1.010 0.491 -4.102 1.00 1.00 O ATOM 198 CB VAL A 15 -3.466 -0.423 -6.161 1.00 1.00 C ATOM 199 CG1 VAL A 15 -3.466 -0.331 -7.688 1.00 1.00 C ATOM 200 CG2 VAL A 15 -2.624 -1.624 -5.723 1.00 1.00 C ATOM 0 H VAL A 15 -1.007 0.733 -6.606 1.00 1.00 H new ATOM 0 HA VAL A 15 -3.629 1.620 -5.395 1.00 1.00 H new ATOM 0 HB VAL A 15 -4.489 -0.546 -5.805 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -3.890 -1.243 -8.107 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -4.065 0.524 -8.001 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -2.443 -0.208 -8.045 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -3.047 -2.537 -6.142 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -1.601 -1.501 -6.079 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -2.624 -1.691 -4.635 1.00 1.00 H new ATOM 210 N TYR A 16 -3.012 0.400 -3.199 1.00 1.00 N ATOM 211 CA TYR A 16 -2.454 0.107 -1.850 1.00 1.00 C ATOM 212 C TYR A 16 -2.798 -1.330 -1.454 1.00 1.00 C ATOM 213 O TYR A 16 -3.798 -1.873 -1.872 1.00 1.00 O ATOM 214 CB TYR A 16 -3.135 1.103 -0.911 1.00 1.00 C ATOM 215 CG TYR A 16 -2.841 2.509 -1.372 1.00 1.00 C ATOM 216 CD1 TYR A 16 -2.866 2.819 -2.737 1.00 1.00 C ATOM 217 CD2 TYR A 16 -2.545 3.506 -0.434 1.00 1.00 C ATOM 218 CE1 TYR A 16 -2.593 4.125 -3.164 1.00 1.00 C ATOM 219 CE2 TYR A 16 -2.272 4.811 -0.861 1.00 1.00 C ATOM 220 CZ TYR A 16 -2.296 5.120 -2.226 1.00 1.00 C ATOM 221 OH TYR A 16 -2.028 6.407 -2.647 1.00 1.00 O ATOM 0 H TYR A 16 -4.030 0.454 -3.242 1.00 1.00 H new ATOM 0 HA TYR A 16 -1.369 0.202 -1.816 1.00 1.00 H new ATOM 0 HB2 TYR A 16 -4.211 0.930 -0.899 1.00 1.00 H new ATOM 0 HB3 TYR A 16 -2.778 0.961 0.109 1.00 1.00 H new ATOM 0 HD1 TYR A 16 -3.096 2.051 -3.461 1.00 1.00 H new ATOM 0 HD2 TYR A 16 -2.527 3.268 0.619 1.00 1.00 H new ATOM 0 HE1 TYR A 16 -2.612 4.364 -4.217 1.00 1.00 H new ATOM 0 HE2 TYR A 16 -2.043 5.579 -0.137 1.00 1.00 H new ATOM 0 HH TYR A 16 -1.843 6.974 -1.869 1.00 1.00 H new ATOM 231 N GLU A 17 -1.980 -1.957 -0.659 1.00 1.00 N ATOM 232 CA GLU A 17 -2.277 -3.361 -0.257 1.00 1.00 C ATOM 233 C GLU A 17 -2.425 -3.461 1.262 1.00 1.00 C ATOM 234 O GLU A 17 -1.480 -3.280 2.002 1.00 1.00 O ATOM 235 CB GLU A 17 -1.074 -4.173 -0.734 1.00 1.00 C ATOM 236 CG GLU A 17 0.201 -3.623 -0.093 1.00 1.00 C ATOM 237 CD GLU A 17 0.831 -4.695 0.797 1.00 1.00 C ATOM 238 OE1 GLU A 17 0.189 -5.712 1.010 1.00 1.00 O ATOM 239 OE2 GLU A 17 1.943 -4.483 1.251 1.00 1.00 O ATOM 0 H GLU A 17 -1.123 -1.563 -0.271 1.00 1.00 H new ATOM 0 HA GLU A 17 -3.210 -3.723 -0.688 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -1.203 -5.223 -0.470 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -0.997 -4.125 -1.820 1.00 1.00 H new ATOM 0 HG2 GLU A 17 0.906 -3.317 -0.866 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -0.030 -2.736 0.497 1.00 1.00 H new ATOM 246 N PHE A 18 -3.608 -3.753 1.729 1.00 1.00 N ATOM 247 CA PHE A 18 -3.822 -3.871 3.199 1.00 1.00 C ATOM 248 C PHE A 18 -4.620 -5.140 3.508 1.00 1.00 C ATOM 249 O PHE A 18 -5.531 -5.501 2.789 1.00 1.00 O ATOM 250 CB PHE A 18 -4.623 -2.626 3.585 1.00 1.00 C ATOM 251 CG PHE A 18 -5.075 -1.909 2.335 1.00 1.00 C ATOM 252 CD1 PHE A 18 -4.129 -1.433 1.421 1.00 1.00 C ATOM 253 CD2 PHE A 18 -6.441 -1.720 2.093 1.00 1.00 C ATOM 254 CE1 PHE A 18 -4.548 -0.768 0.262 1.00 1.00 C ATOM 255 CE2 PHE A 18 -6.860 -1.054 0.934 1.00 1.00 C ATOM 256 CZ PHE A 18 -5.914 -0.578 0.019 1.00 1.00 C ATOM 0 H PHE A 18 -4.436 -3.915 1.156 1.00 1.00 H new ATOM 0 HA PHE A 18 -2.885 -3.937 3.752 1.00 1.00 H new ATOM 0 HB2 PHE A 18 -5.487 -2.909 4.187 1.00 1.00 H new ATOM 0 HB3 PHE A 18 -4.011 -1.962 4.196 1.00 1.00 H new ATOM 0 HD1 PHE A 18 -3.076 -1.578 1.609 1.00 1.00 H new ATOM 0 HD2 PHE A 18 -7.171 -2.087 2.799 1.00 1.00 H new ATOM 0 HE1 PHE A 18 -3.818 -0.402 -0.444 1.00 1.00 H new ATOM 0 HE2 PHE A 18 -7.913 -0.908 0.746 1.00 1.00 H new ATOM 0 HZ PHE A 18 -6.237 -0.064 -0.874 1.00 1.00 H new ATOM 266 N ILE A 19 -4.287 -5.821 4.569 1.00 1.00 N ATOM 267 CA ILE A 19 -5.030 -7.066 4.917 1.00 1.00 C ATOM 268 C ILE A 19 -6.339 -6.720 5.627 1.00 1.00 C ATOM 269 O ILE A 19 -6.367 -5.938 6.556 1.00 1.00 O ATOM 270 CB ILE A 19 -4.097 -7.836 5.854 1.00 1.00 C ATOM 271 CG1 ILE A 19 -3.288 -8.850 5.044 1.00 1.00 C ATOM 272 CG2 ILE A 19 -4.926 -8.569 6.909 1.00 1.00 C ATOM 273 CD1 ILE A 19 -2.729 -8.176 3.791 1.00 1.00 C ATOM 0 H ILE A 19 -3.534 -5.570 5.210 1.00 1.00 H new ATOM 0 HA ILE A 19 -5.293 -7.650 4.035 1.00 1.00 H new ATOM 0 HB ILE A 19 -3.418 -7.140 6.346 1.00 1.00 H new ATOM 0 HG12 ILE A 19 -2.474 -9.248 5.650 1.00 1.00 H new ATOM 0 HG13 ILE A 19 -3.919 -9.694 4.765 1.00 1.00 H new ATOM 0 HG21 ILE A 19 -4.262 -9.118 7.577 1.00 1.00 H new ATOM 0 HG22 ILE A 19 -5.503 -7.846 7.485 1.00 1.00 H new ATOM 0 HG23 ILE A 19 -5.605 -9.267 6.418 1.00 1.00 H new ATOM 0 HD11 ILE A 19 -2.153 -8.900 3.215 1.00 1.00 H new ATOM 0 HD12 ILE A 19 -3.551 -7.800 3.182 1.00 1.00 H new ATOM 0 HD13 ILE A 19 -2.084 -7.347 4.081 1.00 1.00 H new ATOM 285 N HIS A 20 -7.423 -7.302 5.197 1.00 1.00 N ATOM 286 CA HIS A 20 -8.733 -7.013 5.845 1.00 1.00 C ATOM 287 C HIS A 20 -9.643 -8.237 5.741 1.00 1.00 C ATOM 288 O HIS A 20 -9.206 -9.361 5.889 1.00 1.00 O ATOM 289 CB HIS A 20 -9.316 -5.839 5.058 1.00 1.00 C ATOM 290 CG HIS A 20 -8.631 -4.566 5.474 1.00 1.00 C ATOM 291 ND1 HIS A 20 -8.208 -3.619 4.554 1.00 1.00 N ATOM 292 CD2 HIS A 20 -8.288 -4.070 6.708 1.00 1.00 C ATOM 293 CE1 HIS A 20 -7.640 -2.612 5.241 1.00 1.00 C ATOM 294 NE2 HIS A 20 -7.663 -2.835 6.558 1.00 1.00 N ATOM 0 H HIS A 20 -7.459 -7.966 4.424 1.00 1.00 H new ATOM 0 HA HIS A 20 -8.632 -6.777 6.904 1.00 1.00 H new ATOM 0 HB2 HIS A 20 -9.184 -6.003 3.989 1.00 1.00 H new ATOM 0 HB3 HIS A 20 -10.388 -5.763 5.239 1.00 1.00 H new ATOM 0 HD2 HIS A 20 -8.475 -4.563 7.651 1.00 1.00 H new ATOM 0 HE1 HIS A 20 -7.217 -1.730 4.784 1.00 1.00 H new ATOM 0 HE2 HIS A 20 -7.301 -2.230 7.295 1.00 1.00 H new ATOM 302 N SER A 21 -10.903 -8.033 5.472 1.00 1.00 N ATOM 303 CA SER A 21 -11.829 -9.193 5.348 1.00 1.00 C ATOM 304 C SER A 21 -11.394 -10.073 4.174 1.00 1.00 C ATOM 305 O SER A 21 -11.410 -11.286 4.252 1.00 1.00 O ATOM 306 CB SER A 21 -13.202 -8.580 5.082 1.00 1.00 C ATOM 307 OG SER A 21 -13.164 -7.193 5.389 1.00 1.00 O ATOM 0 H SER A 21 -11.330 -7.117 5.333 1.00 1.00 H new ATOM 0 HA SER A 21 -11.836 -9.821 6.239 1.00 1.00 H new ATOM 0 HB2 SER A 21 -13.482 -8.726 4.039 1.00 1.00 H new ATOM 0 HB3 SER A 21 -13.959 -9.078 5.688 1.00 1.00 H new ATOM 0 HG SER A 21 -13.807 -6.998 6.102 1.00 1.00 H new ATOM 313 N THR A 22 -10.993 -9.466 3.091 1.00 1.00 N ATOM 314 CA THR A 22 -10.541 -10.258 1.913 1.00 1.00 C ATOM 315 C THR A 22 -9.018 -10.389 1.940 1.00 1.00 C ATOM 316 O THR A 22 -8.399 -10.789 0.973 1.00 1.00 O ATOM 317 CB THR A 22 -10.990 -9.451 0.693 1.00 1.00 C ATOM 318 OG1 THR A 22 -11.397 -10.342 -0.336 1.00 1.00 O ATOM 319 CG2 THR A 22 -9.833 -8.585 0.196 1.00 1.00 C ATOM 0 H THR A 22 -10.959 -8.454 2.971 1.00 1.00 H new ATOM 0 HA THR A 22 -10.955 -11.266 1.902 1.00 1.00 H new ATOM 0 HB THR A 22 -11.826 -8.808 0.969 1.00 1.00 H new ATOM 0 HG1 THR A 22 -10.682 -10.989 -0.510 1.00 1.00 H new ATOM 0 HG21 THR A 22 -10.155 -8.011 -0.673 1.00 1.00 H new ATOM 0 HG22 THR A 22 -9.524 -7.902 0.987 1.00 1.00 H new ATOM 0 HG23 THR A 22 -8.994 -9.223 -0.081 1.00 1.00 H new ATOM 327 N GLY A 23 -8.409 -10.040 3.040 1.00 1.00 N ATOM 328 CA GLY A 23 -6.927 -10.125 3.129 1.00 1.00 C ATOM 329 C GLY A 23 -6.331 -8.773 2.736 1.00 1.00 C ATOM 330 O GLY A 23 -6.582 -7.767 3.369 1.00 1.00 O ATOM 0 H GLY A 23 -8.876 -9.700 3.881 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -6.624 -10.391 4.142 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.554 -10.908 2.469 1.00 1.00 H new ATOM 334 N SER A 24 -5.549 -8.736 1.693 1.00 1.00 N ATOM 335 CA SER A 24 -4.946 -7.444 1.260 1.00 1.00 C ATOM 336 C SER A 24 -5.954 -6.642 0.433 1.00 1.00 C ATOM 337 O SER A 24 -6.641 -7.176 -0.415 1.00 1.00 O ATOM 338 CB SER A 24 -3.742 -7.834 0.405 1.00 1.00 C ATOM 339 OG SER A 24 -2.565 -7.268 0.966 1.00 1.00 O ATOM 0 H SER A 24 -5.301 -9.544 1.122 1.00 1.00 H new ATOM 0 HA SER A 24 -4.659 -6.819 2.106 1.00 1.00 H new ATOM 0 HB2 SER A 24 -3.651 -8.919 0.358 1.00 1.00 H new ATOM 0 HB3 SER A 24 -3.878 -7.481 -0.617 1.00 1.00 H new ATOM 0 HG SER A 24 -1.812 -7.407 0.355 1.00 1.00 H new ATOM 345 N ILE A 25 -6.044 -5.363 0.671 1.00 1.00 N ATOM 346 CA ILE A 25 -7.003 -4.525 -0.103 1.00 1.00 C ATOM 347 C ILE A 25 -6.238 -3.524 -0.968 1.00 1.00 C ATOM 348 O ILE A 25 -5.416 -2.772 -0.481 1.00 1.00 O ATOM 349 CB ILE A 25 -7.837 -3.798 0.951 1.00 1.00 C ATOM 350 CG1 ILE A 25 -8.511 -4.824 1.865 1.00 1.00 C ATOM 351 CG2 ILE A 25 -8.908 -2.952 0.261 1.00 1.00 C ATOM 352 CD1 ILE A 25 -9.850 -4.271 2.354 1.00 1.00 C ATOM 0 H ILE A 25 -5.495 -4.861 1.369 1.00 1.00 H new ATOM 0 HA ILE A 25 -7.626 -5.117 -0.773 1.00 1.00 H new ATOM 0 HB ILE A 25 -7.189 -3.152 1.543 1.00 1.00 H new ATOM 0 HG12 ILE A 25 -8.667 -5.759 1.327 1.00 1.00 H new ATOM 0 HG13 ILE A 25 -7.866 -5.049 2.715 1.00 1.00 H new ATOM 0 HG21 ILE A 25 -9.503 -2.434 1.013 1.00 1.00 H new ATOM 0 HG22 ILE A 25 -8.430 -2.221 -0.391 1.00 1.00 H new ATOM 0 HG23 ILE A 25 -9.556 -3.598 -0.332 1.00 1.00 H new ATOM 0 HD11 ILE A 25 -10.330 -5.002 3.005 1.00 1.00 H new ATOM 0 HD12 ILE A 25 -9.682 -3.347 2.908 1.00 1.00 H new ATOM 0 HD13 ILE A 25 -10.494 -4.069 1.498 1.00 1.00 H new ATOM 364 N MET A 26 -6.495 -3.508 -2.247 1.00 1.00 N ATOM 365 CA MET A 26 -5.771 -2.553 -3.134 1.00 1.00 C ATOM 366 C MET A 26 -6.754 -1.612 -3.835 1.00 1.00 C ATOM 367 O MET A 26 -7.689 -2.041 -4.482 1.00 1.00 O ATOM 368 CB MET A 26 -5.049 -3.431 -4.157 1.00 1.00 C ATOM 369 CG MET A 26 -3.767 -3.988 -3.536 1.00 1.00 C ATOM 370 SD MET A 26 -2.873 -4.964 -4.769 1.00 1.00 S ATOM 371 CE MET A 26 -1.425 -5.343 -3.752 1.00 1.00 C ATOM 0 H MET A 26 -7.171 -4.111 -2.715 1.00 1.00 H new ATOM 0 HA MET A 26 -5.081 -1.922 -2.574 1.00 1.00 H new ATOM 0 HB2 MET A 26 -5.698 -4.248 -4.473 1.00 1.00 H new ATOM 0 HB3 MET A 26 -4.812 -2.850 -5.048 1.00 1.00 H new ATOM 0 HG2 MET A 26 -3.139 -3.172 -3.178 1.00 1.00 H new ATOM 0 HG3 MET A 26 -4.008 -4.607 -2.672 1.00 1.00 H new ATOM 0 HE1 MET A 26 -1.086 -6.357 -3.965 1.00 1.00 H new ATOM 0 HE2 MET A 26 -0.626 -4.638 -3.980 1.00 1.00 H new ATOM 0 HE3 MET A 26 -1.690 -5.263 -2.698 1.00 1.00 H new ATOM 381 N LYS A 27 -6.545 -0.331 -3.705 1.00 1.00 N ATOM 382 CA LYS A 27 -7.463 0.647 -4.360 1.00 1.00 C ATOM 383 C LYS A 27 -6.799 1.240 -5.605 1.00 1.00 C ATOM 384 O LYS A 27 -5.605 1.131 -5.796 1.00 1.00 O ATOM 385 CB LYS A 27 -7.699 1.732 -3.308 1.00 1.00 C ATOM 386 CG LYS A 27 -6.918 2.991 -3.688 1.00 1.00 C ATOM 387 CD LYS A 27 -5.574 3.000 -2.958 1.00 1.00 C ATOM 388 CE LYS A 27 -5.766 3.549 -1.543 1.00 1.00 C ATOM 389 NZ LYS A 27 -6.080 2.358 -0.707 1.00 1.00 N ATOM 0 H LYS A 27 -5.779 0.082 -3.174 1.00 1.00 H new ATOM 0 HA LYS A 27 -8.396 0.187 -4.686 1.00 1.00 H new ATOM 0 HB2 LYS A 27 -8.763 1.959 -3.237 1.00 1.00 H new ATOM 0 HB3 LYS A 27 -7.382 1.377 -2.327 1.00 1.00 H new ATOM 0 HG2 LYS A 27 -6.758 3.021 -4.766 1.00 1.00 H new ATOM 0 HG3 LYS A 27 -7.492 3.880 -3.426 1.00 1.00 H new ATOM 0 HD2 LYS A 27 -5.164 1.991 -2.916 1.00 1.00 H new ATOM 0 HD3 LYS A 27 -4.856 3.613 -3.503 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -4.866 4.053 -1.190 1.00 1.00 H new ATOM 0 HE3 LYS A 27 -6.575 4.279 -1.509 1.00 1.00 H new ATOM 0 HZ1 LYS A 27 -7.101 2.333 -0.508 1.00 1.00 H new ATOM 0 HZ2 LYS A 27 -5.805 1.494 -1.216 1.00 1.00 H new ATOM 0 HZ3 LYS A 27 -5.554 2.414 0.189 1.00 1.00 H new ATOM 402 N ARG A 28 -7.565 1.867 -6.456 1.00 1.00 N ATOM 403 CA ARG A 28 -6.977 2.466 -7.690 1.00 1.00 C ATOM 404 C ARG A 28 -6.396 3.849 -7.384 1.00 1.00 C ATOM 405 O ARG A 28 -7.027 4.671 -6.749 1.00 1.00 O ATOM 406 CB ARG A 28 -8.144 2.579 -8.670 1.00 1.00 C ATOM 407 CG ARG A 28 -7.703 3.378 -9.898 1.00 1.00 C ATOM 408 CD ARG A 28 -7.164 2.421 -10.964 1.00 1.00 C ATOM 409 NE ARG A 28 -8.339 1.604 -11.376 1.00 1.00 N ATOM 410 CZ ARG A 28 -8.316 0.952 -12.506 1.00 1.00 C ATOM 411 NH1 ARG A 28 -7.263 1.014 -13.274 1.00 1.00 N ATOM 412 NH2 ARG A 28 -9.346 0.237 -12.866 1.00 1.00 N ATOM 0 H ARG A 28 -8.572 1.991 -6.351 1.00 1.00 H new ATOM 0 HA ARG A 28 -6.163 1.864 -8.093 1.00 1.00 H new ATOM 0 HB2 ARG A 28 -8.478 1.586 -8.970 1.00 1.00 H new ATOM 0 HB3 ARG A 28 -8.991 3.069 -8.189 1.00 1.00 H new ATOM 0 HG2 ARG A 28 -8.544 3.946 -10.296 1.00 1.00 H new ATOM 0 HG3 ARG A 28 -6.934 4.099 -9.619 1.00 1.00 H new ATOM 0 HD2 ARG A 28 -6.746 2.967 -11.810 1.00 1.00 H new ATOM 0 HD3 ARG A 28 -6.367 1.794 -10.565 1.00 1.00 H new ATOM 0 HE ARG A 28 -9.162 1.554 -10.775 1.00 1.00 H new ATOM 0 HH11 ARG A 28 -6.458 1.572 -12.991 1.00 1.00 H new ATOM 0 HH12 ARG A 28 -7.245 0.504 -14.157 1.00 1.00 H new ATOM 0 HH21 ARG A 28 -10.168 0.188 -12.264 1.00 1.00 H new ATOM 0 HH22 ARG A 28 -9.329 -0.273 -13.749 1.00 1.00 H new ATOM 425 N LYS A 29 -5.198 4.111 -7.828 1.00 1.00 N ATOM 426 CA LYS A 29 -4.576 5.440 -7.561 1.00 1.00 C ATOM 427 C LYS A 29 -5.346 6.544 -8.291 1.00 1.00 C ATOM 428 O LYS A 29 -5.621 7.590 -7.739 1.00 1.00 O ATOM 429 CB LYS A 29 -3.154 5.329 -8.108 1.00 1.00 C ATOM 430 CG LYS A 29 -2.593 6.729 -8.361 1.00 1.00 C ATOM 431 CD LYS A 29 -3.485 7.767 -7.676 1.00 1.00 C ATOM 432 CE LYS A 29 -2.638 8.628 -6.736 1.00 1.00 C ATOM 433 NZ LYS A 29 -1.691 9.351 -7.628 1.00 1.00 N ATOM 0 H LYS A 29 -4.622 3.462 -8.365 1.00 1.00 H new ATOM 0 HA LYS A 29 -4.587 5.694 -6.501 1.00 1.00 H new ATOM 0 HB2 LYS A 29 -2.521 4.795 -7.399 1.00 1.00 H new ATOM 0 HB3 LYS A 29 -3.153 4.753 -9.033 1.00 1.00 H new ATOM 0 HG2 LYS A 29 -1.575 6.799 -7.978 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -2.545 6.925 -9.432 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -3.970 8.395 -8.423 1.00 1.00 H new ATOM 0 HD3 LYS A 29 -4.276 7.269 -7.116 1.00 1.00 H new ATOM 0 HE2 LYS A 29 -3.258 9.324 -6.171 1.00 1.00 H new ATOM 0 HE3 LYS A 29 -2.106 8.014 -6.010 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 -1.450 10.271 -7.206 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 -0.825 8.787 -7.746 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 -2.135 9.502 -8.556 1.00 1.00 H new ATOM 446 N LYS A 30 -5.697 6.318 -9.528 1.00 1.00 N ATOM 447 CA LYS A 30 -6.449 7.356 -10.289 1.00 1.00 C ATOM 448 C LYS A 30 -7.636 7.856 -9.460 1.00 1.00 C ATOM 449 O LYS A 30 -7.734 9.023 -9.139 1.00 1.00 O ATOM 450 CB LYS A 30 -6.937 6.646 -11.552 1.00 1.00 C ATOM 451 CG LYS A 30 -5.739 6.065 -12.306 1.00 1.00 C ATOM 452 CD LYS A 30 -5.865 6.390 -13.796 1.00 1.00 C ATOM 453 CE LYS A 30 -6.568 5.234 -14.512 1.00 1.00 C ATOM 454 NZ LYS A 30 -5.792 4.020 -14.136 1.00 1.00 N ATOM 0 H LYS A 30 -5.496 5.461 -10.044 1.00 1.00 H new ATOM 0 HA LYS A 30 -5.835 8.225 -10.524 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -7.635 5.851 -11.289 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -7.477 7.346 -12.190 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -4.812 6.479 -11.910 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -5.694 4.986 -12.161 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -6.429 7.313 -13.932 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -4.878 6.553 -14.228 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -7.609 5.150 -14.199 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -6.571 5.382 -15.592 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -5.539 3.490 -14.994 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -4.925 4.303 -13.636 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -6.369 3.418 -13.515 1.00 1.00 H new ATOM 467 N ASP A 31 -8.536 6.978 -9.110 1.00 1.00 N ATOM 468 CA ASP A 31 -9.714 7.400 -8.299 1.00 1.00 C ATOM 469 C ASP A 31 -9.683 6.713 -6.931 1.00 1.00 C ATOM 470 O ASP A 31 -10.641 6.751 -6.185 1.00 1.00 O ATOM 471 CB ASP A 31 -10.933 6.946 -9.101 1.00 1.00 C ATOM 472 CG ASP A 31 -11.882 8.129 -9.301 1.00 1.00 C ATOM 473 OD1 ASP A 31 -12.489 8.548 -8.329 1.00 1.00 O ATOM 474 OD2 ASP A 31 -11.987 8.597 -10.423 1.00 1.00 O ATOM 0 H ASP A 31 -8.507 5.987 -9.350 1.00 1.00 H new ATOM 0 HA ASP A 31 -9.727 8.474 -8.116 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -10.619 6.551 -10.067 1.00 1.00 H new ATOM 0 HB3 ASP A 31 -11.446 6.139 -8.578 1.00 1.00 H new ATOM 479 N ASP A 32 -8.588 6.086 -6.597 1.00 1.00 N ATOM 480 CA ASP A 32 -8.496 5.397 -5.278 1.00 1.00 C ATOM 481 C ASP A 32 -9.706 4.482 -5.072 1.00 1.00 C ATOM 482 O ASP A 32 -10.423 4.596 -4.097 1.00 1.00 O ATOM 483 CB ASP A 32 -8.492 6.522 -4.243 1.00 1.00 C ATOM 484 CG ASP A 32 -7.345 7.489 -4.544 1.00 1.00 C ATOM 485 OD1 ASP A 32 -7.352 8.068 -5.618 1.00 1.00 O ATOM 486 OD2 ASP A 32 -6.480 7.634 -3.697 1.00 1.00 O ATOM 0 H ASP A 32 -7.754 6.021 -7.180 1.00 1.00 H new ATOM 0 HA ASP A 32 -7.608 4.769 -5.202 1.00 1.00 H new ATOM 0 HB2 ASP A 32 -9.444 7.053 -4.264 1.00 1.00 H new ATOM 0 HB3 ASP A 32 -8.379 6.108 -3.241 1.00 1.00 H new ATOM 491 N TRP A 33 -9.940 3.575 -5.981 1.00 1.00 N ATOM 492 CA TRP A 33 -11.105 2.657 -5.833 1.00 1.00 C ATOM 493 C TRP A 33 -10.805 1.585 -4.780 1.00 1.00 C ATOM 494 O TRP A 33 -9.662 1.311 -4.469 1.00 1.00 O ATOM 495 CB TRP A 33 -11.286 2.015 -7.209 1.00 1.00 C ATOM 496 CG TRP A 33 -10.862 2.979 -8.271 1.00 1.00 C ATOM 497 CD1 TRP A 33 -10.406 4.233 -8.047 1.00 1.00 C ATOM 498 CD2 TRP A 33 -10.846 2.790 -9.715 1.00 1.00 C ATOM 499 NE1 TRP A 33 -10.111 4.825 -9.262 1.00 1.00 N ATOM 500 CE2 TRP A 33 -10.365 3.975 -10.319 1.00 1.00 C ATOM 501 CE3 TRP A 33 -11.198 1.715 -10.552 1.00 1.00 C ATOM 502 CZ2 TRP A 33 -10.239 4.091 -11.704 1.00 1.00 C ATOM 503 CZ3 TRP A 33 -11.072 1.828 -11.946 1.00 1.00 C ATOM 504 CH2 TRP A 33 -10.593 3.014 -12.521 1.00 1.00 C ATOM 0 H TRP A 33 -9.376 3.430 -6.818 1.00 1.00 H new ATOM 0 HA TRP A 33 -12.002 3.183 -5.507 1.00 1.00 H new ATOM 0 HB2 TRP A 33 -10.695 1.101 -7.276 1.00 1.00 H new ATOM 0 HB3 TRP A 33 -12.328 1.732 -7.355 1.00 1.00 H new ATOM 0 HD1 TRP A 33 -10.291 4.696 -7.078 1.00 1.00 H new ATOM 0 HE1 TRP A 33 -9.750 5.774 -9.364 1.00 1.00 H new ATOM 0 HE3 TRP A 33 -11.567 0.797 -10.119 1.00 1.00 H new ATOM 0 HZ2 TRP A 33 -9.870 5.007 -12.141 1.00 1.00 H new ATOM 0 HZ3 TRP A 33 -11.346 0.997 -12.579 1.00 1.00 H new ATOM 0 HH2 TRP A 33 -10.498 3.095 -13.594 1.00 1.00 H new ATOM 515 N VAL A 34 -11.820 0.976 -4.232 1.00 1.00 N ATOM 516 CA VAL A 34 -11.592 -0.079 -3.203 1.00 1.00 C ATOM 517 C VAL A 34 -12.364 -1.350 -3.572 1.00 1.00 C ATOM 518 O VAL A 34 -13.437 -1.292 -4.137 1.00 1.00 O ATOM 519 CB VAL A 34 -12.127 0.515 -1.901 1.00 1.00 C ATOM 520 CG1 VAL A 34 -11.122 0.269 -0.775 1.00 1.00 C ATOM 521 CG2 VAL A 34 -12.335 2.021 -2.077 1.00 1.00 C ATOM 0 H VAL A 34 -12.798 1.163 -4.452 1.00 1.00 H new ATOM 0 HA VAL A 34 -10.541 -0.357 -3.121 1.00 1.00 H new ATOM 0 HB VAL A 34 -13.076 0.042 -1.650 1.00 1.00 H new ATOM 0 HG11 VAL A 34 -11.505 0.693 0.153 1.00 1.00 H new ATOM 0 HG12 VAL A 34 -10.972 -0.803 -0.649 1.00 1.00 H new ATOM 0 HG13 VAL A 34 -10.172 0.742 -1.025 1.00 1.00 H new ATOM 0 HG21 VAL A 34 -12.717 2.446 -1.149 1.00 1.00 H new ATOM 0 HG22 VAL A 34 -11.385 2.493 -2.329 1.00 1.00 H new ATOM 0 HG23 VAL A 34 -13.052 2.198 -2.879 1.00 1.00 H new ATOM 531 N ASN A 35 -11.825 -2.496 -3.257 1.00 1.00 N ATOM 532 CA ASN A 35 -12.529 -3.767 -3.592 1.00 1.00 C ATOM 533 C ASN A 35 -13.864 -3.848 -2.846 1.00 1.00 C ATOM 534 O ASN A 35 -13.916 -4.197 -1.684 1.00 1.00 O ATOM 535 CB ASN A 35 -11.587 -4.878 -3.125 1.00 1.00 C ATOM 536 CG ASN A 35 -10.154 -4.344 -3.072 1.00 1.00 C ATOM 537 OD1 ASN A 35 -9.798 -3.454 -3.819 1.00 1.00 O ATOM 538 ND2 ASN A 35 -9.312 -4.852 -2.216 1.00 1.00 N ATOM 0 H ASN A 35 -10.929 -2.607 -2.783 1.00 1.00 H new ATOM 0 HA ASN A 35 -12.755 -3.844 -4.656 1.00 1.00 H new ATOM 0 HB2 ASN A 35 -11.890 -5.236 -2.141 1.00 1.00 H new ATOM 0 HB3 ASN A 35 -11.645 -5.728 -3.805 1.00 1.00 H new ATOM 0 HD21 ASN A 35 -8.355 -4.502 -2.173 1.00 1.00 H new ATOM 0 HD22 ASN A 35 -9.611 -5.599 -1.589 1.00 1.00 H new ATOM 545 N ALA A 36 -14.944 -3.526 -3.506 1.00 1.00 N ATOM 546 CA ALA A 36 -16.274 -3.584 -2.833 1.00 1.00 C ATOM 547 C ALA A 36 -16.341 -4.788 -1.887 1.00 1.00 C ATOM 548 O ALA A 36 -17.083 -4.789 -0.925 1.00 1.00 O ATOM 549 CB ALA A 36 -17.285 -3.740 -3.969 1.00 1.00 C ATOM 0 H ALA A 36 -14.963 -3.226 -4.481 1.00 1.00 H new ATOM 0 HA ALA A 36 -16.469 -2.697 -2.230 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -18.292 -3.790 -3.555 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -17.211 -2.885 -4.642 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -17.073 -4.656 -4.521 1.00 1.00 H new ATOM 555 N THR A 37 -15.570 -5.809 -2.146 1.00 1.00 N ATOM 556 CA THR A 37 -15.598 -7.001 -1.250 1.00 1.00 C ATOM 557 C THR A 37 -15.200 -6.589 0.167 1.00 1.00 C ATOM 558 O THR A 37 -15.840 -6.953 1.134 1.00 1.00 O ATOM 559 CB THR A 37 -14.571 -7.973 -1.833 1.00 1.00 C ATOM 560 OG1 THR A 37 -14.965 -8.343 -3.148 1.00 1.00 O ATOM 561 CG2 THR A 37 -14.493 -9.218 -0.950 1.00 1.00 C ATOM 0 H THR A 37 -14.925 -5.870 -2.934 1.00 1.00 H new ATOM 0 HA THR A 37 -16.588 -7.452 -1.193 1.00 1.00 H new ATOM 0 HB THR A 37 -13.593 -7.494 -1.870 1.00 1.00 H new ATOM 0 HG1 THR A 37 -14.307 -8.965 -3.524 1.00 1.00 H new ATOM 0 HG21 THR A 37 -13.762 -9.912 -1.364 1.00 1.00 H new ATOM 0 HG22 THR A 37 -14.192 -8.931 0.058 1.00 1.00 H new ATOM 0 HG23 THR A 37 -15.470 -9.700 -0.913 1.00 1.00 H new ATOM 569 N HIS A 38 -14.156 -5.817 0.297 1.00 1.00 N ATOM 570 CA HIS A 38 -13.733 -5.367 1.651 1.00 1.00 C ATOM 571 C HIS A 38 -14.818 -4.463 2.237 1.00 1.00 C ATOM 572 O HIS A 38 -15.006 -4.387 3.435 1.00 1.00 O ATOM 573 CB HIS A 38 -12.438 -4.585 1.430 1.00 1.00 C ATOM 574 CG HIS A 38 -12.049 -3.885 2.703 1.00 1.00 C ATOM 575 ND1 HIS A 38 -11.344 -2.692 2.705 1.00 1.00 N ATOM 576 CD2 HIS A 38 -12.261 -4.197 4.023 1.00 1.00 C ATOM 577 CE1 HIS A 38 -11.157 -2.333 3.988 1.00 1.00 C ATOM 578 NE2 HIS A 38 -11.697 -3.216 4.833 1.00 1.00 N ATOM 0 H HIS A 38 -13.580 -5.480 -0.474 1.00 1.00 H new ATOM 0 HA HIS A 38 -13.581 -6.194 2.345 1.00 1.00 H new ATOM 0 HB2 HIS A 38 -11.642 -5.261 1.117 1.00 1.00 H new ATOM 0 HB3 HIS A 38 -12.572 -3.858 0.629 1.00 1.00 H new ATOM 0 HD1 HIS A 38 -11.025 -2.179 1.883 1.00 1.00 H new ATOM 0 HD2 HIS A 38 -12.786 -5.071 4.379 1.00 1.00 H new ATOM 0 HE1 HIS A 38 -10.634 -1.440 4.297 1.00 1.00 H new ATOM 586 N ILE A 39 -15.541 -3.788 1.387 1.00 1.00 N ATOM 587 CA ILE A 39 -16.630 -2.892 1.866 1.00 1.00 C ATOM 588 C ILE A 39 -17.940 -3.678 1.949 1.00 1.00 C ATOM 589 O ILE A 39 -18.593 -3.717 2.973 1.00 1.00 O ATOM 590 CB ILE A 39 -16.727 -1.798 0.804 1.00 1.00 C ATOM 591 CG1 ILE A 39 -15.802 -0.639 1.179 1.00 1.00 C ATOM 592 CG2 ILE A 39 -18.168 -1.294 0.715 1.00 1.00 C ATOM 593 CD1 ILE A 39 -14.633 -0.584 0.195 1.00 1.00 C ATOM 0 H ILE A 39 -15.423 -3.819 0.374 1.00 1.00 H new ATOM 0 HA ILE A 39 -16.436 -2.481 2.857 1.00 1.00 H new ATOM 0 HB ILE A 39 -16.427 -2.204 -0.162 1.00 1.00 H new ATOM 0 HG12 ILE A 39 -16.353 0.301 1.159 1.00 1.00 H new ATOM 0 HG13 ILE A 39 -15.430 -0.770 2.195 1.00 1.00 H new ATOM 0 HG21 ILE A 39 -18.234 -0.514 -0.043 1.00 1.00 H new ATOM 0 HG22 ILE A 39 -18.826 -2.120 0.445 1.00 1.00 H new ATOM 0 HG23 ILE A 39 -18.472 -0.889 1.680 1.00 1.00 H new ATOM 0 HD11 ILE A 39 -13.972 0.241 0.460 1.00 1.00 H new ATOM 0 HD12 ILE A 39 -14.078 -1.521 0.237 1.00 1.00 H new ATOM 0 HD13 ILE A 39 -15.014 -0.433 -0.815 1.00 1.00 H new ATOM 605 N LEU A 40 -18.323 -4.310 0.873 1.00 1.00 N ATOM 606 CA LEU A 40 -19.584 -5.103 0.878 1.00 1.00 C ATOM 607 C LEU A 40 -19.294 -6.551 1.286 1.00 1.00 C ATOM 608 O LEU A 40 -19.931 -7.099 2.165 1.00 1.00 O ATOM 609 CB LEU A 40 -20.095 -5.044 -0.562 1.00 1.00 C ATOM 610 CG LEU A 40 -20.808 -3.711 -0.797 1.00 1.00 C ATOM 611 CD1 LEU A 40 -22.298 -3.965 -1.036 1.00 1.00 C ATOM 612 CD2 LEU A 40 -20.634 -2.817 0.433 1.00 1.00 C ATOM 0 H LEU A 40 -17.815 -4.311 -0.011 1.00 1.00 H new ATOM 0 HA LEU A 40 -20.316 -4.713 1.586 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -19.264 -5.151 -1.259 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -20.778 -5.872 -0.751 1.00 1.00 H new ATOM 0 HG LEU A 40 -20.379 -3.218 -1.669 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -22.807 -3.016 -1.203 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -22.423 -4.603 -1.911 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -22.728 -4.458 -0.164 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -21.142 -1.867 0.267 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -21.063 -3.310 1.305 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -19.573 -2.636 0.604 1.00 1.00 H new ATOM 624 N LYS A 41 -18.330 -7.172 0.660 1.00 1.00 N ATOM 625 CA LYS A 41 -17.997 -8.582 1.015 1.00 1.00 C ATOM 626 C LYS A 41 -17.426 -8.639 2.431 1.00 1.00 C ATOM 627 O LYS A 41 -17.500 -9.648 3.104 1.00 1.00 O ATOM 628 CB LYS A 41 -16.946 -9.011 -0.009 1.00 1.00 C ATOM 629 CG LYS A 41 -16.209 -10.251 0.505 1.00 1.00 C ATOM 630 CD LYS A 41 -16.222 -11.335 -0.574 1.00 1.00 C ATOM 631 CE LYS A 41 -16.439 -10.691 -1.946 1.00 1.00 C ATOM 632 NZ LYS A 41 -17.755 -11.211 -2.411 1.00 1.00 N ATOM 0 H LYS A 41 -17.760 -6.764 -0.081 1.00 1.00 H new ATOM 0 HA LYS A 41 -18.869 -9.235 0.995 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -17.422 -9.228 -0.965 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -16.239 -8.200 -0.182 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -15.182 -9.995 0.766 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -16.686 -10.621 1.413 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -15.280 -11.884 -0.564 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -17.014 -12.056 -0.370 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -16.447 -9.603 -1.875 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -15.641 -10.959 -2.639 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -17.605 -11.906 -3.170 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -18.249 -11.666 -1.617 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -18.332 -10.424 -2.771 1.00 1.00 H new ATOM 645 N ALA A 42 -16.862 -7.557 2.891 1.00 1.00 N ATOM 646 CA ALA A 42 -16.292 -7.541 4.266 1.00 1.00 C ATOM 647 C ALA A 42 -17.425 -7.546 5.295 1.00 1.00 C ATOM 648 O ALA A 42 -17.244 -7.934 6.432 1.00 1.00 O ATOM 649 CB ALA A 42 -15.494 -6.239 4.351 1.00 1.00 C ATOM 0 H ALA A 42 -16.771 -6.683 2.373 1.00 1.00 H new ATOM 0 HA ALA A 42 -15.667 -8.411 4.469 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -15.041 -6.154 5.339 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -14.712 -6.242 3.592 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -16.160 -5.393 4.183 1.00 1.00 H new ATOM 655 N ALA A 43 -18.593 -7.113 4.903 1.00 1.00 N ATOM 656 CA ALA A 43 -19.736 -7.088 5.858 1.00 1.00 C ATOM 657 C ALA A 43 -20.882 -7.965 5.348 1.00 1.00 C ATOM 658 O ALA A 43 -21.968 -7.958 5.892 1.00 1.00 O ATOM 659 CB ALA A 43 -20.169 -5.623 5.918 1.00 1.00 C ATOM 0 H ALA A 43 -18.804 -6.776 3.964 1.00 1.00 H new ATOM 0 HA ALA A 43 -19.458 -7.474 6.839 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -21.010 -5.520 6.603 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -19.338 -5.012 6.270 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -20.468 -5.291 4.924 1.00 1.00 H new ATOM 665 N ASN A 44 -20.657 -8.721 4.307 1.00 1.00 N ATOM 666 CA ASN A 44 -21.746 -9.589 3.774 1.00 1.00 C ATOM 667 C ASN A 44 -21.192 -10.960 3.372 1.00 1.00 C ATOM 668 O ASN A 44 -21.805 -11.981 3.611 1.00 1.00 O ATOM 669 CB ASN A 44 -22.279 -8.847 2.548 1.00 1.00 C ATOM 670 CG ASN A 44 -21.655 -9.438 1.283 1.00 1.00 C ATOM 671 OD1 ASN A 44 -22.055 -10.492 0.828 1.00 1.00 O ATOM 672 ND2 ASN A 44 -20.685 -8.799 0.689 1.00 1.00 N ATOM 0 H ASN A 44 -19.771 -8.775 3.805 1.00 1.00 H new ATOM 0 HA ASN A 44 -22.525 -9.770 4.515 1.00 1.00 H new ATOM 0 HB2 ASN A 44 -23.365 -8.930 2.503 1.00 1.00 H new ATOM 0 HB3 ASN A 44 -22.043 -7.785 2.621 1.00 1.00 H new ATOM 0 HD21 ASN A 44 -20.263 -9.184 -0.156 1.00 1.00 H new ATOM 0 HD22 ASN A 44 -20.349 -7.915 1.070 1.00 1.00 H new ATOM 679 N PHE A 45 -20.041 -10.990 2.759 1.00 1.00 N ATOM 680 CA PHE A 45 -19.454 -12.294 2.339 1.00 1.00 C ATOM 681 C PHE A 45 -19.717 -12.528 0.849 1.00 1.00 C ATOM 682 O PHE A 45 -20.698 -12.062 0.303 1.00 1.00 O ATOM 683 CB PHE A 45 -20.177 -13.344 3.183 1.00 1.00 C ATOM 684 CG PHE A 45 -20.373 -12.816 4.584 1.00 1.00 C ATOM 685 CD1 PHE A 45 -19.326 -12.153 5.237 1.00 1.00 C ATOM 686 CD2 PHE A 45 -21.604 -12.988 5.230 1.00 1.00 C ATOM 687 CE1 PHE A 45 -19.509 -11.664 6.534 1.00 1.00 C ATOM 688 CE2 PHE A 45 -21.786 -12.498 6.529 1.00 1.00 C ATOM 689 CZ PHE A 45 -20.739 -11.836 7.182 1.00 1.00 C ATOM 0 H PHE A 45 -19.481 -10.168 2.531 1.00 1.00 H new ATOM 0 HA PHE A 45 -18.374 -12.331 2.484 1.00 1.00 H new ATOM 0 HB2 PHE A 45 -21.141 -13.585 2.735 1.00 1.00 H new ATOM 0 HB3 PHE A 45 -19.598 -14.267 3.209 1.00 1.00 H new ATOM 0 HD1 PHE A 45 -18.377 -12.020 4.739 1.00 1.00 H new ATOM 0 HD2 PHE A 45 -22.412 -13.498 4.727 1.00 1.00 H new ATOM 0 HE1 PHE A 45 -18.701 -11.153 7.037 1.00 1.00 H new ATOM 0 HE2 PHE A 45 -22.735 -12.631 7.028 1.00 1.00 H new ATOM 0 HZ PHE A 45 -20.880 -11.458 8.184 1.00 1.00 H new ATOM 699 N ALA A 46 -18.850 -13.240 0.184 1.00 1.00 N ATOM 700 CA ALA A 46 -19.056 -13.490 -1.271 1.00 1.00 C ATOM 701 C ALA A 46 -19.911 -14.739 -1.487 1.00 1.00 C ATOM 702 O ALA A 46 -19.418 -15.848 -1.542 1.00 1.00 O ATOM 703 CB ALA A 46 -17.654 -13.686 -1.847 1.00 1.00 C ATOM 0 H ALA A 46 -18.010 -13.659 0.583 1.00 1.00 H new ATOM 0 HA ALA A 46 -19.581 -12.667 -1.756 1.00 1.00 H new ATOM 0 HB1 ALA A 46 -17.724 -13.875 -2.918 1.00 1.00 H new ATOM 0 HB2 ALA A 46 -17.061 -12.788 -1.675 1.00 1.00 H new ATOM 0 HB3 ALA A 46 -17.176 -14.535 -1.359 1.00 1.00 H new ATOM 709 N LYS A 47 -21.189 -14.550 -1.623 1.00 1.00 N ATOM 710 CA LYS A 47 -22.112 -15.695 -1.852 1.00 1.00 C ATOM 711 C LYS A 47 -23.242 -15.226 -2.765 1.00 1.00 C ATOM 712 O LYS A 47 -23.166 -14.161 -3.345 1.00 1.00 O ATOM 713 CB LYS A 47 -22.648 -16.064 -0.468 1.00 1.00 C ATOM 714 CG LYS A 47 -22.986 -17.556 -0.432 1.00 1.00 C ATOM 715 CD LYS A 47 -23.606 -17.906 0.921 1.00 1.00 C ATOM 716 CE LYS A 47 -25.052 -17.405 0.966 1.00 1.00 C ATOM 717 NZ LYS A 47 -25.828 -18.525 1.567 1.00 1.00 N ATOM 0 H LYS A 47 -21.642 -13.637 -1.585 1.00 1.00 H new ATOM 0 HA LYS A 47 -21.630 -16.551 -2.324 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -21.906 -15.830 0.295 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -23.536 -15.474 -0.241 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -23.679 -17.802 -1.236 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -22.085 -18.148 -0.595 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -23.579 -18.984 1.077 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -23.028 -17.453 1.726 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -25.137 -16.499 1.566 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -25.417 -17.162 -0.032 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -26.831 -18.257 1.631 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -25.733 -19.372 0.971 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -25.462 -18.729 2.519 1.00 1.00 H new ATOM 730 N ALA A 48 -24.295 -15.980 -2.894 1.00 1.00 N ATOM 731 CA ALA A 48 -25.400 -15.513 -3.771 1.00 1.00 C ATOM 732 C ALA A 48 -25.767 -14.094 -3.350 1.00 1.00 C ATOM 733 O ALA A 48 -26.214 -13.288 -4.142 1.00 1.00 O ATOM 734 CB ALA A 48 -26.559 -16.478 -3.516 1.00 1.00 C ATOM 0 H ALA A 48 -24.438 -16.882 -2.440 1.00 1.00 H new ATOM 0 HA ALA A 48 -25.139 -15.498 -4.829 1.00 1.00 H new ATOM 0 HB1 ALA A 48 -27.412 -16.193 -4.132 1.00 1.00 H new ATOM 0 HB2 ALA A 48 -26.251 -17.492 -3.770 1.00 1.00 H new ATOM 0 HB3 ALA A 48 -26.841 -16.437 -2.464 1.00 1.00 H new ATOM 740 N LYS A 49 -25.540 -13.777 -2.105 1.00 1.00 N ATOM 741 CA LYS A 49 -25.828 -12.403 -1.620 1.00 1.00 C ATOM 742 C LYS A 49 -24.840 -11.424 -2.259 1.00 1.00 C ATOM 743 O LYS A 49 -25.223 -10.411 -2.812 1.00 1.00 O ATOM 744 CB LYS A 49 -25.621 -12.464 -0.106 1.00 1.00 C ATOM 745 CG LYS A 49 -26.975 -12.371 0.600 1.00 1.00 C ATOM 746 CD LYS A 49 -26.831 -11.537 1.874 1.00 1.00 C ATOM 747 CE LYS A 49 -26.470 -12.452 3.046 1.00 1.00 C ATOM 748 NZ LYS A 49 -26.420 -11.554 4.233 1.00 1.00 N ATOM 0 H LYS A 49 -25.166 -14.415 -1.402 1.00 1.00 H new ATOM 0 HA LYS A 49 -26.834 -12.067 -1.874 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -25.121 -13.393 0.166 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -24.974 -11.648 0.216 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -27.712 -11.917 -0.063 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -27.338 -13.369 0.845 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -26.059 -10.779 1.740 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -27.762 -11.010 2.084 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -27.213 -13.238 3.177 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -25.511 -12.944 2.882 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -26.178 -12.109 5.078 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -25.699 -10.820 4.083 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -27.348 -11.105 4.368 1.00 1.00 H new ATOM 761 N ARG A 50 -23.566 -11.725 -2.193 1.00 1.00 N ATOM 762 CA ARG A 50 -22.554 -10.817 -2.795 1.00 1.00 C ATOM 763 C ARG A 50 -22.791 -10.693 -4.299 1.00 1.00 C ATOM 764 O ARG A 50 -22.449 -9.698 -4.909 1.00 1.00 O ATOM 765 CB ARG A 50 -21.206 -11.484 -2.518 1.00 1.00 C ATOM 766 CG ARG A 50 -20.085 -10.455 -2.674 1.00 1.00 C ATOM 767 CD ARG A 50 -19.507 -10.540 -4.088 1.00 1.00 C ATOM 768 NE ARG A 50 -19.319 -11.995 -4.340 1.00 1.00 N ATOM 769 CZ ARG A 50 -20.209 -12.660 -5.025 1.00 1.00 C ATOM 770 NH1 ARG A 50 -21.263 -12.048 -5.492 1.00 1.00 N ATOM 771 NH2 ARG A 50 -20.044 -13.936 -5.244 1.00 1.00 N ATOM 0 H ARG A 50 -23.188 -12.561 -1.747 1.00 1.00 H new ATOM 0 HA ARG A 50 -22.602 -9.810 -2.380 1.00 1.00 H new ATOM 0 HB2 ARG A 50 -21.194 -11.900 -1.511 1.00 1.00 H new ATOM 0 HB3 ARG A 50 -21.051 -12.314 -3.207 1.00 1.00 H new ATOM 0 HG2 ARG A 50 -20.469 -9.452 -2.486 1.00 1.00 H new ATOM 0 HG3 ARG A 50 -19.302 -10.640 -1.938 1.00 1.00 H new ATOM 0 HD2 ARG A 50 -20.184 -10.097 -4.818 1.00 1.00 H new ATOM 0 HD3 ARG A 50 -18.562 -10.001 -4.161 1.00 1.00 H new ATOM 0 HE ARG A 50 -18.494 -12.473 -3.977 1.00 1.00 H new ATOM 0 HH11 ARG A 50 -21.391 -11.050 -5.322 1.00 1.00 H new ATOM 0 HH12 ARG A 50 -21.959 -12.567 -6.027 1.00 1.00 H new ATOM 0 HH21 ARG A 50 -19.220 -14.414 -4.880 1.00 1.00 H new ATOM 0 HH22 ARG A 50 -20.740 -14.456 -5.779 1.00 1.00 H new ATOM 784 N THR A 51 -23.391 -11.684 -4.903 1.00 1.00 N ATOM 785 CA THR A 51 -23.661 -11.604 -6.365 1.00 1.00 C ATOM 786 C THR A 51 -24.729 -10.545 -6.621 1.00 1.00 C ATOM 787 O THR A 51 -24.688 -9.826 -7.599 1.00 1.00 O ATOM 788 CB THR A 51 -24.168 -12.993 -6.756 1.00 1.00 C ATOM 789 OG1 THR A 51 -23.292 -13.981 -6.230 1.00 1.00 O ATOM 790 CG2 THR A 51 -24.216 -13.110 -8.280 1.00 1.00 C ATOM 0 H THR A 51 -23.704 -12.542 -4.448 1.00 1.00 H new ATOM 0 HA THR A 51 -22.780 -11.327 -6.944 1.00 1.00 H new ATOM 0 HB THR A 51 -25.169 -13.142 -6.351 1.00 1.00 H new ATOM 0 HG1 THR A 51 -23.617 -14.872 -6.478 1.00 1.00 H new ATOM 0 HG21 THR A 51 -24.577 -14.100 -8.558 1.00 1.00 H new ATOM 0 HG22 THR A 51 -24.889 -12.352 -8.682 1.00 1.00 H new ATOM 0 HG23 THR A 51 -23.216 -12.961 -8.688 1.00 1.00 H new ATOM 798 N ARG A 52 -25.679 -10.435 -5.736 1.00 1.00 N ATOM 799 CA ARG A 52 -26.744 -9.409 -5.911 1.00 1.00 C ATOM 800 C ARG A 52 -26.329 -8.129 -5.183 1.00 1.00 C ATOM 801 O ARG A 52 -26.077 -7.108 -5.791 1.00 1.00 O ATOM 802 CB ARG A 52 -27.993 -10.015 -5.270 1.00 1.00 C ATOM 803 CG ARG A 52 -29.165 -9.043 -5.414 1.00 1.00 C ATOM 804 CD ARG A 52 -29.578 -8.532 -4.032 1.00 1.00 C ATOM 805 NE ARG A 52 -30.007 -9.747 -3.285 1.00 1.00 N ATOM 806 CZ ARG A 52 -30.864 -9.642 -2.307 1.00 1.00 C ATOM 807 NH1 ARG A 52 -31.345 -8.473 -1.983 1.00 1.00 N ATOM 808 NH2 ARG A 52 -31.240 -10.706 -1.653 1.00 1.00 N ATOM 0 H ARG A 52 -25.764 -11.011 -4.899 1.00 1.00 H new ATOM 0 HA ARG A 52 -26.919 -9.152 -6.956 1.00 1.00 H new ATOM 0 HB2 ARG A 52 -28.234 -10.965 -5.747 1.00 1.00 H new ATOM 0 HB3 ARG A 52 -27.808 -10.225 -4.216 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -28.881 -8.207 -6.053 1.00 1.00 H new ATOM 0 HG3 ARG A 52 -30.007 -9.541 -5.896 1.00 1.00 H new ATOM 0 HD2 ARG A 52 -28.748 -8.033 -3.531 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -30.388 -7.807 -4.105 1.00 1.00 H new ATOM 0 HE ARG A 52 -29.631 -10.661 -3.538 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -31.051 -7.641 -2.494 1.00 1.00 H new ATOM 0 HH12 ARG A 52 -32.015 -8.391 -1.218 1.00 1.00 H new ATOM 0 HH21 ARG A 52 -30.864 -11.620 -1.906 1.00 1.00 H new ATOM 0 HH22 ARG A 52 -31.910 -10.624 -0.888 1.00 1.00 H new ATOM 821 N ILE A 53 -26.252 -8.183 -3.883 1.00 1.00 N ATOM 822 CA ILE A 53 -25.848 -6.975 -3.111 1.00 1.00 C ATOM 823 C ILE A 53 -24.621 -6.329 -3.760 1.00 1.00 C ATOM 824 O ILE A 53 -24.586 -5.136 -3.988 1.00 1.00 O ATOM 825 CB ILE A 53 -25.506 -7.493 -1.713 1.00 1.00 C ATOM 826 CG1 ILE A 53 -24.062 -7.998 -1.696 1.00 1.00 C ATOM 827 CG2 ILE A 53 -26.451 -8.640 -1.348 1.00 1.00 C ATOM 828 CD1 ILE A 53 -23.667 -8.367 -0.264 1.00 1.00 C ATOM 0 H ILE A 53 -26.451 -9.011 -3.322 1.00 1.00 H new ATOM 0 HA ILE A 53 -26.632 -6.218 -3.082 1.00 1.00 H new ATOM 0 HB ILE A 53 -25.618 -6.686 -0.989 1.00 1.00 H new ATOM 0 HG12 ILE A 53 -23.961 -8.866 -2.347 1.00 1.00 H new ATOM 0 HG13 ILE A 53 -23.392 -7.230 -2.083 1.00 1.00 H new ATOM 0 HG21 ILE A 53 -26.207 -9.009 -0.352 1.00 1.00 H new ATOM 0 HG22 ILE A 53 -27.480 -8.281 -1.360 1.00 1.00 H new ATOM 0 HG23 ILE A 53 -26.339 -9.448 -2.072 1.00 1.00 H new ATOM 0 HD11 ILE A 53 -22.638 -8.727 -0.252 1.00 1.00 H new ATOM 0 HD12 ILE A 53 -23.752 -7.488 0.375 1.00 1.00 H new ATOM 0 HD13 ILE A 53 -24.330 -9.149 0.106 1.00 1.00 H new ATOM 840 N LEU A 54 -23.620 -7.107 -4.079 1.00 1.00 N ATOM 841 CA LEU A 54 -22.413 -6.526 -4.735 1.00 1.00 C ATOM 842 C LEU A 54 -22.778 -6.045 -6.141 1.00 1.00 C ATOM 843 O LEU A 54 -22.614 -4.892 -6.482 1.00 1.00 O ATOM 844 CB LEU A 54 -21.403 -7.672 -4.800 1.00 1.00 C ATOM 845 CG LEU A 54 -20.062 -7.203 -4.234 1.00 1.00 C ATOM 846 CD1 LEU A 54 -19.026 -8.317 -4.384 1.00 1.00 C ATOM 847 CD2 LEU A 54 -19.592 -5.963 -4.999 1.00 1.00 C ATOM 0 H LEU A 54 -23.586 -8.113 -3.915 1.00 1.00 H new ATOM 0 HA LEU A 54 -22.011 -5.670 -4.193 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -21.770 -8.527 -4.232 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -21.279 -8.003 -5.831 1.00 1.00 H new ATOM 0 HG LEU A 54 -20.180 -6.957 -3.179 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -18.070 -7.982 -3.980 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -19.360 -9.200 -3.840 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -18.908 -8.564 -5.439 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -18.636 -5.628 -4.596 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -19.475 -6.209 -6.054 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -20.330 -5.168 -4.892 1.00 1.00 H new ATOM 859 N GLU A 55 -23.275 -6.936 -6.957 1.00 1.00 N ATOM 860 CA GLU A 55 -23.656 -6.549 -8.345 1.00 1.00 C ATOM 861 C GLU A 55 -24.590 -5.337 -8.311 1.00 1.00 C ATOM 862 O GLU A 55 -24.400 -4.376 -9.026 1.00 1.00 O ATOM 863 CB GLU A 55 -24.377 -7.771 -8.912 1.00 1.00 C ATOM 864 CG GLU A 55 -25.889 -7.565 -8.812 1.00 1.00 C ATOM 865 CD GLU A 55 -26.411 -6.973 -10.123 1.00 1.00 C ATOM 866 OE1 GLU A 55 -26.389 -5.759 -10.252 1.00 1.00 O ATOM 867 OE2 GLU A 55 -26.824 -7.742 -10.975 1.00 1.00 O ATOM 0 H GLU A 55 -23.433 -7.916 -6.721 1.00 1.00 H new ATOM 0 HA GLU A 55 -22.795 -6.270 -8.952 1.00 1.00 H new ATOM 0 HB2 GLU A 55 -24.089 -7.926 -9.952 1.00 1.00 H new ATOM 0 HB3 GLU A 55 -24.084 -8.666 -8.363 1.00 1.00 H new ATOM 0 HG2 GLU A 55 -26.383 -8.515 -8.607 1.00 1.00 H new ATOM 0 HG3 GLU A 55 -26.122 -6.899 -7.981 1.00 1.00 H new ATOM 874 N LYS A 56 -25.592 -5.368 -7.477 1.00 1.00 N ATOM 875 CA LYS A 56 -26.522 -4.206 -7.399 1.00 1.00 C ATOM 876 C LYS A 56 -25.836 -3.049 -6.671 1.00 1.00 C ATOM 877 O LYS A 56 -26.070 -1.893 -6.961 1.00 1.00 O ATOM 878 CB LYS A 56 -27.727 -4.709 -6.602 1.00 1.00 C ATOM 879 CG LYS A 56 -28.477 -3.517 -6.004 1.00 1.00 C ATOM 880 CD LYS A 56 -27.927 -3.215 -4.608 1.00 1.00 C ATOM 881 CE LYS A 56 -29.078 -3.196 -3.600 1.00 1.00 C ATOM 882 NZ LYS A 56 -29.545 -4.607 -3.521 1.00 1.00 N ATOM 0 H LYS A 56 -25.807 -6.143 -6.849 1.00 1.00 H new ATOM 0 HA LYS A 56 -26.818 -3.840 -8.382 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -28.391 -5.282 -7.249 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -27.397 -5.380 -5.809 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -28.365 -2.644 -6.647 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -29.543 -3.736 -5.947 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -27.193 -3.969 -4.324 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -27.413 -2.254 -4.608 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -28.744 -2.836 -2.627 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -29.879 -2.533 -3.928 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -29.895 -4.804 -2.562 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -30.312 -4.758 -4.207 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -28.755 -5.247 -3.739 1.00 1.00 H new ATOM 895 N GLU A 57 -24.980 -3.355 -5.736 1.00 1.00 N ATOM 896 CA GLU A 57 -24.266 -2.276 -4.998 1.00 1.00 C ATOM 897 C GLU A 57 -23.074 -1.794 -5.825 1.00 1.00 C ATOM 898 O GLU A 57 -22.906 -0.615 -6.065 1.00 1.00 O ATOM 899 CB GLU A 57 -23.792 -2.927 -3.698 1.00 1.00 C ATOM 900 CG GLU A 57 -24.951 -2.980 -2.701 1.00 1.00 C ATOM 901 CD GLU A 57 -25.086 -1.626 -2.003 1.00 1.00 C ATOM 902 OE1 GLU A 57 -24.065 -1.061 -1.646 1.00 1.00 O ATOM 903 OE2 GLU A 57 -26.208 -1.177 -1.836 1.00 1.00 O ATOM 0 H GLU A 57 -24.744 -4.306 -5.451 1.00 1.00 H new ATOM 0 HA GLU A 57 -24.899 -1.410 -4.805 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -23.423 -3.933 -3.896 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -22.962 -2.360 -3.277 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -25.878 -3.229 -3.218 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -24.776 -3.765 -1.965 1.00 1.00 H new ATOM 910 N VAL A 58 -22.244 -2.701 -6.265 1.00 1.00 N ATOM 911 CA VAL A 58 -21.062 -2.300 -7.079 1.00 1.00 C ATOM 912 C VAL A 58 -21.448 -2.185 -8.558 1.00 1.00 C ATOM 913 O VAL A 58 -21.134 -1.211 -9.213 1.00 1.00 O ATOM 914 CB VAL A 58 -20.040 -3.418 -6.869 1.00 1.00 C ATOM 915 CG1 VAL A 58 -20.151 -4.439 -8.005 1.00 1.00 C ATOM 916 CG2 VAL A 58 -18.630 -2.823 -6.858 1.00 1.00 C ATOM 0 H VAL A 58 -22.334 -3.703 -6.095 1.00 1.00 H new ATOM 0 HA VAL A 58 -20.666 -1.328 -6.784 1.00 1.00 H new ATOM 0 HB VAL A 58 -20.237 -3.912 -5.918 1.00 1.00 H new ATOM 0 HG11 VAL A 58 -19.421 -5.234 -7.852 1.00 1.00 H new ATOM 0 HG12 VAL A 58 -21.155 -4.864 -8.015 1.00 1.00 H new ATOM 0 HG13 VAL A 58 -19.956 -3.946 -8.957 1.00 1.00 H new ATOM 0 HG21 VAL A 58 -17.900 -3.619 -6.708 1.00 1.00 H new ATOM 0 HG22 VAL A 58 -18.437 -2.328 -7.810 1.00 1.00 H new ATOM 0 HG23 VAL A 58 -18.547 -2.098 -6.048 1.00 1.00 H new ATOM 926 N LEU A 59 -22.125 -3.168 -9.091 1.00 1.00 N ATOM 927 CA LEU A 59 -22.519 -3.094 -10.529 1.00 1.00 C ATOM 928 C LEU A 59 -23.011 -1.684 -10.856 1.00 1.00 C ATOM 929 O LEU A 59 -22.615 -1.090 -11.839 1.00 1.00 O ATOM 930 CB LEU A 59 -23.645 -4.113 -10.698 1.00 1.00 C ATOM 931 CG LEU A 59 -23.742 -4.516 -12.169 1.00 1.00 C ATOM 932 CD1 LEU A 59 -24.010 -3.274 -13.021 1.00 1.00 C ATOM 933 CD2 LEU A 59 -22.423 -5.158 -12.607 1.00 1.00 C ATOM 0 H LEU A 59 -22.420 -4.011 -8.599 1.00 1.00 H new ATOM 0 HA LEU A 59 -21.686 -3.310 -11.198 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -23.453 -4.990 -10.080 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -24.590 -3.687 -10.362 1.00 1.00 H new ATOM 0 HG LEU A 59 -24.556 -5.229 -12.299 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -24.079 -3.561 -14.070 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -24.947 -2.813 -12.708 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -23.195 -2.562 -12.893 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -22.489 -5.446 -13.656 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -21.610 -4.443 -12.478 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -22.229 -6.042 -11.999 1.00 1.00 H new ATOM 945 N LYS A 60 -23.855 -1.132 -10.026 1.00 1.00 N ATOM 946 CA LYS A 60 -24.345 0.251 -10.282 1.00 1.00 C ATOM 947 C LYS A 60 -23.194 1.224 -10.038 1.00 1.00 C ATOM 948 O LYS A 60 -23.286 2.407 -10.301 1.00 1.00 O ATOM 949 CB LYS A 60 -25.470 0.474 -9.272 1.00 1.00 C ATOM 950 CG LYS A 60 -26.816 0.158 -9.929 1.00 1.00 C ATOM 951 CD LYS A 60 -27.935 0.879 -9.175 1.00 1.00 C ATOM 952 CE LYS A 60 -29.201 0.896 -10.035 1.00 1.00 C ATOM 953 NZ LYS A 60 -29.782 -0.467 -9.892 1.00 1.00 N ATOM 0 H LYS A 60 -24.224 -1.577 -9.186 1.00 1.00 H new ATOM 0 HA LYS A 60 -24.701 0.400 -11.301 1.00 1.00 H new ATOM 0 HB2 LYS A 60 -25.321 -0.162 -8.399 1.00 1.00 H new ATOM 0 HB3 LYS A 60 -25.458 1.506 -8.920 1.00 1.00 H new ATOM 0 HG2 LYS A 60 -26.806 0.472 -10.973 1.00 1.00 H new ATOM 0 HG3 LYS A 60 -26.993 -0.918 -9.921 1.00 1.00 H new ATOM 0 HD2 LYS A 60 -28.132 0.377 -8.228 1.00 1.00 H new ATOM 0 HD3 LYS A 60 -27.630 1.898 -8.938 1.00 1.00 H new ATOM 0 HE2 LYS A 60 -29.899 1.660 -9.694 1.00 1.00 H new ATOM 0 HE3 LYS A 60 -28.968 1.118 -11.076 1.00 1.00 H new ATOM 0 HZ1 LYS A 60 -30.697 -0.508 -10.384 1.00 1.00 H new ATOM 0 HZ2 LYS A 60 -29.134 -1.166 -10.308 1.00 1.00 H new ATOM 0 HZ3 LYS A 60 -29.922 -0.681 -8.884 1.00 1.00 H new ATOM 966 N GLU A 61 -22.102 0.711 -9.544 1.00 1.00 N ATOM 967 CA GLU A 61 -20.912 1.567 -9.279 1.00 1.00 C ATOM 968 C GLU A 61 -19.783 1.192 -10.243 1.00 1.00 C ATOM 969 O GLU A 61 -20.014 0.617 -11.288 1.00 1.00 O ATOM 970 CB GLU A 61 -20.513 1.259 -7.836 1.00 1.00 C ATOM 971 CG GLU A 61 -21.742 0.791 -7.055 1.00 1.00 C ATOM 972 CD GLU A 61 -21.532 1.057 -5.563 1.00 1.00 C ATOM 973 OE1 GLU A 61 -20.503 1.615 -5.220 1.00 1.00 O ATOM 974 OE2 GLU A 61 -22.404 0.698 -4.790 1.00 1.00 O ATOM 0 H GLU A 61 -21.982 -0.275 -9.310 1.00 1.00 H new ATOM 0 HA GLU A 61 -21.119 2.628 -9.421 1.00 1.00 H new ATOM 0 HB2 GLU A 61 -19.742 0.489 -7.817 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -20.088 2.147 -7.368 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -22.631 1.315 -7.407 1.00 1.00 H new ATOM 0 HG3 GLU A 61 -21.911 -0.272 -7.225 1.00 1.00 H new ATOM 981 N THR A 62 -18.566 1.510 -9.902 1.00 1.00 N ATOM 982 CA THR A 62 -17.427 1.167 -10.803 1.00 1.00 C ATOM 983 C THR A 62 -16.778 -0.146 -10.355 1.00 1.00 C ATOM 984 O THR A 62 -15.572 -0.256 -10.271 1.00 1.00 O ATOM 985 CB THR A 62 -16.442 2.328 -10.658 1.00 1.00 C ATOM 986 OG1 THR A 62 -17.154 3.558 -10.707 1.00 1.00 O ATOM 987 CG2 THR A 62 -15.422 2.280 -11.796 1.00 1.00 C ATOM 0 H THR A 62 -18.309 1.992 -9.040 1.00 1.00 H new ATOM 0 HA THR A 62 -17.745 1.030 -11.837 1.00 1.00 H new ATOM 0 HB THR A 62 -15.921 2.247 -9.704 1.00 1.00 H new ATOM 0 HG1 THR A 62 -16.525 4.304 -10.613 1.00 1.00 H new ATOM 0 HG21 THR A 62 -14.721 3.108 -11.691 1.00 1.00 H new ATOM 0 HG22 THR A 62 -14.878 1.336 -11.757 1.00 1.00 H new ATOM 0 HG23 THR A 62 -15.939 2.361 -12.752 1.00 1.00 H new ATOM 995 N HIS A 63 -17.572 -1.143 -10.068 1.00 1.00 N ATOM 996 CA HIS A 63 -17.000 -2.448 -9.626 1.00 1.00 C ATOM 997 C HIS A 63 -16.130 -3.045 -10.735 1.00 1.00 C ATOM 998 O HIS A 63 -16.552 -3.171 -11.868 1.00 1.00 O ATOM 999 CB HIS A 63 -18.211 -3.339 -9.356 1.00 1.00 C ATOM 1000 CG HIS A 63 -19.047 -3.442 -10.601 1.00 1.00 C ATOM 1001 ND1 HIS A 63 -19.051 -4.577 -11.398 1.00 1.00 N ATOM 1002 CD2 HIS A 63 -19.912 -2.561 -11.201 1.00 1.00 C ATOM 1003 CE1 HIS A 63 -19.893 -4.351 -12.422 1.00 1.00 C ATOM 1004 NE2 HIS A 63 -20.445 -3.137 -12.351 1.00 1.00 N ATOM 0 H HIS A 63 -18.590 -1.110 -10.120 1.00 1.00 H new ATOM 0 HA HIS A 63 -16.366 -2.345 -8.745 1.00 1.00 H new ATOM 0 HB2 HIS A 63 -17.884 -4.330 -9.042 1.00 1.00 H new ATOM 0 HB3 HIS A 63 -18.804 -2.926 -8.540 1.00 1.00 H new ATOM 0 HD1 HIS A 63 -18.513 -5.428 -11.237 1.00 1.00 H new ATOM 0 HD2 HIS A 63 -20.144 -1.571 -10.836 1.00 1.00 H new ATOM 0 HE1 HIS A 63 -20.098 -5.065 -13.206 1.00 1.00 H new ATOM 1012 N GLU A 64 -14.916 -3.409 -10.421 1.00 1.00 N ATOM 1013 CA GLU A 64 -14.022 -3.993 -11.462 1.00 1.00 C ATOM 1014 C GLU A 64 -13.346 -5.263 -10.938 1.00 1.00 C ATOM 1015 O GLU A 64 -12.989 -5.357 -9.781 1.00 1.00 O ATOM 1016 CB GLU A 64 -12.978 -2.911 -11.732 1.00 1.00 C ATOM 1017 CG GLU A 64 -13.461 -2.007 -12.868 1.00 1.00 C ATOM 1018 CD GLU A 64 -12.542 -2.174 -14.080 1.00 1.00 C ATOM 1019 OE1 GLU A 64 -11.888 -3.201 -14.165 1.00 1.00 O ATOM 1020 OE2 GLU A 64 -12.509 -1.273 -14.903 1.00 1.00 O ATOM 0 H GLU A 64 -14.505 -3.328 -9.491 1.00 1.00 H new ATOM 0 HA GLU A 64 -14.569 -4.275 -12.362 1.00 1.00 H new ATOM 0 HB2 GLU A 64 -12.809 -2.321 -10.831 1.00 1.00 H new ATOM 0 HB3 GLU A 64 -12.025 -3.369 -11.997 1.00 1.00 H new ATOM 0 HG2 GLU A 64 -14.486 -2.261 -13.138 1.00 1.00 H new ATOM 0 HG3 GLU A 64 -13.465 -0.967 -12.542 1.00 1.00 H new ATOM 1027 N LYS A 65 -13.161 -6.238 -11.786 1.00 1.00 N ATOM 1028 CA LYS A 65 -12.500 -7.498 -11.342 1.00 1.00 C ATOM 1029 C LYS A 65 -11.039 -7.505 -11.798 1.00 1.00 C ATOM 1030 O LYS A 65 -10.746 -7.618 -12.972 1.00 1.00 O ATOM 1031 CB LYS A 65 -13.281 -8.620 -12.027 1.00 1.00 C ATOM 1032 CG LYS A 65 -14.776 -8.290 -12.001 1.00 1.00 C ATOM 1033 CD LYS A 65 -15.357 -8.444 -13.408 1.00 1.00 C ATOM 1034 CE LYS A 65 -14.875 -9.762 -14.018 1.00 1.00 C ATOM 1035 NZ LYS A 65 -15.456 -9.785 -15.389 1.00 1.00 N ATOM 0 H LYS A 65 -13.439 -6.216 -12.767 1.00 1.00 H new ATOM 0 HA LYS A 65 -12.500 -7.609 -10.258 1.00 1.00 H new ATOM 0 HB2 LYS A 65 -12.942 -8.738 -13.056 1.00 1.00 H new ATOM 0 HB3 LYS A 65 -13.098 -9.567 -11.520 1.00 1.00 H new ATOM 0 HG2 LYS A 65 -15.294 -8.953 -11.308 1.00 1.00 H new ATOM 0 HG3 LYS A 65 -14.928 -7.272 -11.642 1.00 1.00 H new ATOM 0 HD2 LYS A 65 -16.446 -8.427 -13.367 1.00 1.00 H new ATOM 0 HD3 LYS A 65 -15.048 -7.607 -14.034 1.00 1.00 H new ATOM 0 HE2 LYS A 65 -13.786 -9.808 -14.049 1.00 1.00 H new ATOM 0 HE3 LYS A 65 -15.213 -10.616 -13.431 1.00 1.00 H new ATOM 0 HZ1 LYS A 65 -15.170 -10.660 -15.873 1.00 1.00 H new ATOM 0 HZ2 LYS A 65 -16.493 -9.747 -15.327 1.00 1.00 H new ATOM 0 HZ3 LYS A 65 -15.111 -8.964 -15.926 1.00 1.00 H new ATOM 1048 N VAL A 66 -10.119 -7.379 -10.881 1.00 1.00 N ATOM 1049 CA VAL A 66 -8.678 -7.372 -11.269 1.00 1.00 C ATOM 1050 C VAL A 66 -8.096 -8.785 -11.182 1.00 1.00 C ATOM 1051 O VAL A 66 -8.155 -9.431 -10.154 1.00 1.00 O ATOM 1052 CB VAL A 66 -8.001 -6.449 -10.257 1.00 1.00 C ATOM 1053 CG1 VAL A 66 -7.877 -5.044 -10.850 1.00 1.00 C ATOM 1054 CG2 VAL A 66 -8.843 -6.389 -8.980 1.00 1.00 C ATOM 0 H VAL A 66 -10.301 -7.281 -9.882 1.00 1.00 H new ATOM 0 HA VAL A 66 -8.529 -7.033 -12.294 1.00 1.00 H new ATOM 0 HB VAL A 66 -7.008 -6.834 -10.022 1.00 1.00 H new ATOM 0 HG11 VAL A 66 -7.394 -4.386 -10.128 1.00 1.00 H new ATOM 0 HG12 VAL A 66 -7.279 -5.085 -11.760 1.00 1.00 H new ATOM 0 HG13 VAL A 66 -8.869 -4.659 -11.085 1.00 1.00 H new ATOM 0 HG21 VAL A 66 -8.361 -5.731 -8.257 1.00 1.00 H new ATOM 0 HG22 VAL A 66 -9.835 -6.004 -9.216 1.00 1.00 H new ATOM 0 HG23 VAL A 66 -8.933 -7.389 -8.556 1.00 1.00 H new ATOM 1064 N GLN A 67 -7.529 -9.267 -12.254 1.00 1.00 N ATOM 1065 CA GLN A 67 -6.939 -10.635 -12.237 1.00 1.00 C ATOM 1066 C GLN A 67 -5.654 -10.662 -13.068 1.00 1.00 C ATOM 1067 O GLN A 67 -5.251 -9.668 -13.638 1.00 1.00 O ATOM 1068 CB GLN A 67 -8.004 -11.535 -12.863 1.00 1.00 C ATOM 1069 CG GLN A 67 -9.374 -10.866 -12.739 1.00 1.00 C ATOM 1070 CD GLN A 67 -9.831 -10.901 -11.279 1.00 1.00 C ATOM 1071 OE1 GLN A 67 -9.092 -11.318 -10.410 1.00 1.00 O ATOM 1072 NE2 GLN A 67 -11.026 -10.477 -10.972 1.00 1.00 N ATOM 0 H GLN A 67 -7.449 -8.772 -13.142 1.00 1.00 H new ATOM 0 HA GLN A 67 -6.675 -10.960 -11.231 1.00 1.00 H new ATOM 0 HB2 GLN A 67 -7.770 -11.718 -13.912 1.00 1.00 H new ATOM 0 HB3 GLN A 67 -8.014 -12.505 -12.365 1.00 1.00 H new ATOM 0 HG2 GLN A 67 -9.320 -9.835 -13.089 1.00 1.00 H new ATOM 0 HG3 GLN A 67 -10.099 -11.379 -13.370 1.00 1.00 H new ATOM 0 HE21 GLN A 67 -11.646 -10.127 -11.702 1.00 1.00 H new ATOM 0 HE22 GLN A 67 -11.340 -10.496 -10.002 1.00 1.00 H new ATOM 1081 N GLY A 68 -5.007 -11.793 -13.145 1.00 1.00 N ATOM 1082 CA GLY A 68 -3.751 -11.878 -13.942 1.00 1.00 C ATOM 1083 C GLY A 68 -2.606 -11.228 -13.163 1.00 1.00 C ATOM 1084 O GLY A 68 -1.513 -11.064 -13.668 1.00 1.00 O ATOM 0 H GLY A 68 -5.294 -12.660 -12.691 1.00 1.00 H new ATOM 0 HA2 GLY A 68 -3.514 -12.920 -14.156 1.00 1.00 H new ATOM 0 HA3 GLY A 68 -3.882 -11.378 -14.901 1.00 1.00 H new ATOM 1088 N GLY A 69 -2.847 -10.854 -11.936 1.00 1.00 N ATOM 1089 CA GLY A 69 -1.772 -10.215 -11.126 1.00 1.00 C ATOM 1090 C GLY A 69 -1.985 -8.700 -11.094 1.00 1.00 C ATOM 1091 O GLY A 69 -1.357 -7.992 -10.333 1.00 1.00 O ATOM 0 H GLY A 69 -3.742 -10.964 -11.460 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -1.780 -10.615 -10.112 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -0.796 -10.446 -11.552 1.00 1.00 H new ATOM 1095 N PHE A 70 -2.866 -8.196 -11.914 1.00 1.00 N ATOM 1096 CA PHE A 70 -3.117 -6.726 -11.927 1.00 1.00 C ATOM 1097 C PHE A 70 -4.411 -6.403 -11.176 1.00 1.00 C ATOM 1098 O PHE A 70 -5.474 -6.320 -11.758 1.00 1.00 O ATOM 1099 CB PHE A 70 -3.249 -6.359 -13.406 1.00 1.00 C ATOM 1100 CG PHE A 70 -3.927 -7.487 -14.147 1.00 1.00 C ATOM 1101 CD1 PHE A 70 -3.166 -8.548 -14.654 1.00 1.00 C ATOM 1102 CD2 PHE A 70 -5.315 -7.473 -14.328 1.00 1.00 C ATOM 1103 CE1 PHE A 70 -3.794 -9.594 -15.342 1.00 1.00 C ATOM 1104 CE2 PHE A 70 -5.942 -8.518 -15.014 1.00 1.00 C ATOM 1105 CZ PHE A 70 -5.182 -9.579 -15.523 1.00 1.00 C ATOM 0 H PHE A 70 -3.423 -8.738 -12.575 1.00 1.00 H new ATOM 0 HA PHE A 70 -2.319 -6.167 -11.438 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -3.826 -5.441 -13.514 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -2.265 -6.169 -13.834 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -2.095 -8.560 -14.514 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -5.902 -6.655 -13.938 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -3.207 -10.412 -15.733 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -7.013 -8.507 -15.151 1.00 1.00 H new ATOM 0 HZ PHE A 70 -5.666 -10.385 -16.055 1.00 1.00 H new ATOM 1115 N GLY A 71 -4.329 -6.221 -9.886 1.00 1.00 N ATOM 1116 CA GLY A 71 -5.555 -5.904 -9.099 1.00 1.00 C ATOM 1117 C GLY A 71 -6.178 -7.200 -8.577 1.00 1.00 C ATOM 1118 O GLY A 71 -7.341 -7.241 -8.216 1.00 1.00 O ATOM 0 H GLY A 71 -3.467 -6.278 -9.343 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -5.305 -5.247 -8.266 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -6.272 -5.369 -9.722 1.00 1.00 H new ATOM 1122 N LYS A 72 -5.413 -8.256 -8.520 1.00 1.00 N ATOM 1123 CA LYS A 72 -5.968 -9.545 -8.019 1.00 1.00 C ATOM 1124 C LYS A 72 -6.163 -9.457 -6.511 1.00 1.00 C ATOM 1125 O LYS A 72 -6.733 -10.334 -5.891 1.00 1.00 O ATOM 1126 CB LYS A 72 -4.911 -10.595 -8.364 1.00 1.00 C ATOM 1127 CG LYS A 72 -3.730 -10.466 -7.400 1.00 1.00 C ATOM 1128 CD LYS A 72 -4.189 -10.804 -5.979 1.00 1.00 C ATOM 1129 CE LYS A 72 -3.657 -12.184 -5.585 1.00 1.00 C ATOM 1130 NZ LYS A 72 -4.777 -13.123 -5.868 1.00 1.00 N ATOM 0 H LYS A 72 -4.432 -8.282 -8.797 1.00 1.00 H new ATOM 0 HA LYS A 72 -6.934 -9.789 -8.461 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -5.341 -11.595 -8.298 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -4.572 -10.461 -9.391 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -2.926 -11.136 -7.702 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -3.330 -9.453 -7.433 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -3.828 -10.050 -5.280 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -5.278 -10.793 -5.925 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -2.769 -12.444 -6.161 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -3.374 -12.212 -4.533 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -4.520 -14.077 -5.545 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -5.631 -12.806 -5.366 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -4.964 -13.143 -6.891 1.00 1.00 H new ATOM 1143 N TYR A 73 -5.713 -8.387 -5.921 1.00 1.00 N ATOM 1144 CA TYR A 73 -5.890 -8.216 -4.457 1.00 1.00 C ATOM 1145 C TYR A 73 -7.190 -7.452 -4.201 1.00 1.00 C ATOM 1146 O TYR A 73 -7.773 -7.536 -3.139 1.00 1.00 O ATOM 1147 CB TYR A 73 -4.682 -7.398 -4.000 1.00 1.00 C ATOM 1148 CG TYR A 73 -3.706 -8.299 -3.283 1.00 1.00 C ATOM 1149 CD1 TYR A 73 -3.944 -9.678 -3.220 1.00 1.00 C ATOM 1150 CD2 TYR A 73 -2.565 -7.757 -2.681 1.00 1.00 C ATOM 1151 CE1 TYR A 73 -3.039 -10.514 -2.554 1.00 1.00 C ATOM 1152 CE2 TYR A 73 -1.660 -8.593 -2.015 1.00 1.00 C ATOM 1153 CZ TYR A 73 -1.897 -9.972 -1.953 1.00 1.00 C ATOM 1154 OH TYR A 73 -1.006 -10.796 -1.297 1.00 1.00 O ATOM 0 H TYR A 73 -5.229 -7.622 -6.392 1.00 1.00 H new ATOM 0 HA TYR A 73 -5.951 -9.163 -3.921 1.00 1.00 H new ATOM 0 HB2 TYR A 73 -4.199 -6.932 -4.859 1.00 1.00 H new ATOM 0 HB3 TYR A 73 -5.003 -6.593 -3.339 1.00 1.00 H new ATOM 0 HD1 TYR A 73 -4.825 -10.096 -3.685 1.00 1.00 H new ATOM 0 HD2 TYR A 73 -2.382 -6.694 -2.730 1.00 1.00 H new ATOM 0 HE1 TYR A 73 -3.222 -11.577 -2.504 1.00 1.00 H new ATOM 0 HE2 TYR A 73 -0.780 -8.175 -1.549 1.00 1.00 H new ATOM 0 HH TYR A 73 -0.268 -10.260 -0.938 1.00 1.00 H new ATOM 1164 N GLN A 74 -7.650 -6.709 -5.175 1.00 1.00 N ATOM 1165 CA GLN A 74 -8.915 -5.944 -4.989 1.00 1.00 C ATOM 1166 C GLN A 74 -10.103 -6.751 -5.519 1.00 1.00 C ATOM 1167 O GLN A 74 -11.123 -6.871 -4.869 1.00 1.00 O ATOM 1168 CB GLN A 74 -8.729 -4.665 -5.806 1.00 1.00 C ATOM 1169 CG GLN A 74 -7.431 -3.973 -5.384 1.00 1.00 C ATOM 1170 CD GLN A 74 -6.239 -4.689 -6.023 1.00 1.00 C ATOM 1171 OE1 GLN A 74 -5.862 -4.387 -7.139 1.00 1.00 O ATOM 1172 NE2 GLN A 74 -5.626 -5.630 -5.360 1.00 1.00 N ATOM 0 H GLN A 74 -7.205 -6.601 -6.086 1.00 1.00 H new ATOM 0 HA GLN A 74 -9.118 -5.731 -3.940 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -8.698 -4.902 -6.870 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -9.576 -3.997 -5.653 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -7.448 -2.927 -5.691 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -7.336 -3.985 -4.298 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -5.942 -5.883 -4.424 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -4.830 -6.113 -5.778 1.00 1.00 H new ATOM 1181 N GLY A 75 -9.980 -7.308 -6.694 1.00 1.00 N ATOM 1182 CA GLY A 75 -11.106 -8.106 -7.258 1.00 1.00 C ATOM 1183 C GLY A 75 -12.238 -7.165 -7.667 1.00 1.00 C ATOM 1184 O GLY A 75 -12.481 -6.934 -8.835 1.00 1.00 O ATOM 0 H GLY A 75 -9.151 -7.245 -7.286 1.00 1.00 H new ATOM 0 HA2 GLY A 75 -10.765 -8.679 -8.120 1.00 1.00 H new ATOM 0 HA3 GLY A 75 -11.463 -8.824 -6.520 1.00 1.00 H new ATOM 1188 N THR A 76 -12.926 -6.612 -6.707 1.00 1.00 N ATOM 1189 CA THR A 76 -14.041 -5.673 -7.021 1.00 1.00 C ATOM 1190 C THR A 76 -13.831 -4.355 -6.272 1.00 1.00 C ATOM 1191 O THR A 76 -14.575 -4.016 -5.372 1.00 1.00 O ATOM 1192 CB THR A 76 -15.306 -6.378 -6.528 1.00 1.00 C ATOM 1193 OG1 THR A 76 -15.221 -7.764 -6.830 1.00 1.00 O ATOM 1194 CG2 THR A 76 -16.531 -5.777 -7.218 1.00 1.00 C ATOM 0 H THR A 76 -12.763 -6.771 -5.713 1.00 1.00 H new ATOM 0 HA THR A 76 -14.101 -5.435 -8.083 1.00 1.00 H new ATOM 0 HB THR A 76 -15.400 -6.245 -5.450 1.00 1.00 H new ATOM 0 HG1 THR A 76 -16.030 -8.218 -6.513 1.00 1.00 H new ATOM 0 HG21 THR A 76 -17.431 -6.281 -6.865 1.00 1.00 H new ATOM 0 HG22 THR A 76 -16.595 -4.714 -6.985 1.00 1.00 H new ATOM 0 HG23 THR A 76 -16.441 -5.907 -8.297 1.00 1.00 H new ATOM 1202 N TRP A 77 -12.817 -3.615 -6.625 1.00 1.00 N ATOM 1203 CA TRP A 77 -12.553 -2.328 -5.922 1.00 1.00 C ATOM 1204 C TRP A 77 -13.539 -1.251 -6.380 1.00 1.00 C ATOM 1205 O TRP A 77 -14.151 -1.354 -7.425 1.00 1.00 O ATOM 1206 CB TRP A 77 -11.126 -1.944 -6.316 1.00 1.00 C ATOM 1207 CG TRP A 77 -10.901 -2.269 -7.757 1.00 1.00 C ATOM 1208 CD1 TRP A 77 -11.829 -2.797 -8.589 1.00 1.00 C ATOM 1209 CD2 TRP A 77 -9.691 -2.096 -8.550 1.00 1.00 C ATOM 1210 NE1 TRP A 77 -11.265 -2.961 -9.842 1.00 1.00 N ATOM 1211 CE2 TRP A 77 -9.948 -2.542 -9.868 1.00 1.00 C ATOM 1212 CE3 TRP A 77 -8.407 -1.602 -8.256 1.00 1.00 C ATOM 1213 CZ2 TRP A 77 -8.967 -2.500 -10.860 1.00 1.00 C ATOM 1214 CZ3 TRP A 77 -7.417 -1.557 -9.252 1.00 1.00 C ATOM 1215 CH2 TRP A 77 -7.698 -2.005 -10.551 1.00 1.00 C ATOM 0 H TRP A 77 -12.160 -3.846 -7.370 1.00 1.00 H new ATOM 0 HA TRP A 77 -12.670 -2.424 -4.843 1.00 1.00 H new ATOM 0 HB2 TRP A 77 -10.964 -0.880 -6.143 1.00 1.00 H new ATOM 0 HB3 TRP A 77 -10.409 -2.481 -5.695 1.00 1.00 H new ATOM 0 HD1 TRP A 77 -12.844 -3.049 -8.319 1.00 1.00 H new ATOM 0 HE1 TRP A 77 -11.760 -3.344 -10.647 1.00 1.00 H new ATOM 0 HE3 TRP A 77 -8.181 -1.255 -7.259 1.00 1.00 H new ATOM 0 HZ2 TRP A 77 -9.187 -2.847 -11.859 1.00 1.00 H new ATOM 0 HZ3 TRP A 77 -6.435 -1.175 -9.016 1.00 1.00 H new ATOM 0 HH2 TRP A 77 -6.933 -1.967 -11.312 1.00 1.00 H new ATOM 1226 N VAL A 78 -13.689 -0.215 -5.603 1.00 1.00 N ATOM 1227 CA VAL A 78 -14.623 0.882 -5.981 1.00 1.00 C ATOM 1228 C VAL A 78 -14.015 2.233 -5.599 1.00 1.00 C ATOM 1229 O VAL A 78 -13.012 2.287 -4.914 1.00 1.00 O ATOM 1230 CB VAL A 78 -15.894 0.616 -5.174 1.00 1.00 C ATOM 1231 CG1 VAL A 78 -17.026 0.215 -6.121 1.00 1.00 C ATOM 1232 CG2 VAL A 78 -15.638 -0.519 -4.179 1.00 1.00 C ATOM 0 H VAL A 78 -13.202 -0.080 -4.717 1.00 1.00 H new ATOM 0 HA VAL A 78 -14.824 0.910 -7.052 1.00 1.00 H new ATOM 0 HB VAL A 78 -16.175 1.519 -4.633 1.00 1.00 H new ATOM 0 HG11 VAL A 78 -17.932 0.025 -5.545 1.00 1.00 H new ATOM 0 HG12 VAL A 78 -17.209 1.021 -6.831 1.00 1.00 H new ATOM 0 HG13 VAL A 78 -16.745 -0.688 -6.663 1.00 1.00 H new ATOM 0 HG21 VAL A 78 -16.544 -0.709 -3.603 1.00 1.00 H new ATOM 0 HG22 VAL A 78 -15.356 -1.422 -4.721 1.00 1.00 H new ATOM 0 HG23 VAL A 78 -14.831 -0.235 -3.503 1.00 1.00 H new ATOM 1242 N PRO A 79 -14.643 3.282 -6.052 1.00 1.00 N ATOM 1243 CA PRO A 79 -14.152 4.649 -5.750 1.00 1.00 C ATOM 1244 C PRO A 79 -14.060 4.849 -4.234 1.00 1.00 C ATOM 1245 O PRO A 79 -15.059 4.923 -3.548 1.00 1.00 O ATOM 1246 CB PRO A 79 -15.207 5.574 -6.361 1.00 1.00 C ATOM 1247 CG PRO A 79 -16.371 4.699 -6.715 1.00 1.00 C ATOM 1248 CD PRO A 79 -15.850 3.297 -6.874 1.00 1.00 C ATOM 0 HA PRO A 79 -13.157 4.842 -6.151 1.00 1.00 H new ATOM 0 HB2 PRO A 79 -15.503 6.349 -5.654 1.00 1.00 H new ATOM 0 HB3 PRO A 79 -14.817 6.080 -7.244 1.00 1.00 H new ATOM 0 HG2 PRO A 79 -17.132 4.739 -5.936 1.00 1.00 H new ATOM 0 HG3 PRO A 79 -16.841 5.040 -7.637 1.00 1.00 H new ATOM 0 HD2 PRO A 79 -16.576 2.559 -6.533 1.00 1.00 H new ATOM 0 HD3 PRO A 79 -15.628 3.068 -7.916 1.00 1.00 H new ATOM 1256 N LEU A 80 -12.869 4.933 -3.707 1.00 1.00 N ATOM 1257 CA LEU A 80 -12.714 5.123 -2.235 1.00 1.00 C ATOM 1258 C LEU A 80 -13.585 6.284 -1.750 1.00 1.00 C ATOM 1259 O LEU A 80 -14.083 6.272 -0.639 1.00 1.00 O ATOM 1260 CB LEU A 80 -11.233 5.445 -2.034 1.00 1.00 C ATOM 1261 CG LEU A 80 -11.054 6.227 -0.731 1.00 1.00 C ATOM 1262 CD1 LEU A 80 -10.988 5.253 0.445 1.00 1.00 C ATOM 1263 CD2 LEU A 80 -9.755 7.034 -0.797 1.00 1.00 C ATOM 0 H LEU A 80 -11.996 4.878 -4.231 1.00 1.00 H new ATOM 0 HA LEU A 80 -13.023 4.242 -1.672 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -10.651 4.524 -2.001 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -10.859 6.029 -2.875 1.00 1.00 H new ATOM 0 HG LEU A 80 -11.898 6.903 -0.595 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -10.860 5.811 1.373 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -11.912 4.677 0.492 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -10.144 4.576 0.310 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -9.626 7.592 0.130 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -8.912 6.356 -0.933 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -9.801 7.729 -1.635 1.00 1.00 H new ATOM 1275 N ASN A 81 -13.785 7.281 -2.571 1.00 1.00 N ATOM 1276 CA ASN A 81 -14.633 8.433 -2.150 1.00 1.00 C ATOM 1277 C ASN A 81 -16.052 7.947 -1.858 1.00 1.00 C ATOM 1278 O ASN A 81 -16.749 8.489 -1.023 1.00 1.00 O ATOM 1279 CB ASN A 81 -14.625 9.390 -3.342 1.00 1.00 C ATOM 1280 CG ASN A 81 -13.491 10.403 -3.177 1.00 1.00 C ATOM 1281 OD1 ASN A 81 -13.081 11.034 -4.130 1.00 1.00 O ATOM 1282 ND2 ASN A 81 -12.964 10.587 -1.997 1.00 1.00 N ATOM 0 H ASN A 81 -13.399 7.347 -3.513 1.00 1.00 H new ATOM 0 HA ASN A 81 -14.264 8.916 -1.245 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -14.496 8.832 -4.269 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -15.582 9.908 -3.412 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -12.208 11.261 -1.876 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -13.308 10.057 -1.196 1.00 1.00 H new ATOM 1289 N ILE A 82 -16.476 6.918 -2.535 1.00 1.00 N ATOM 1290 CA ILE A 82 -17.843 6.376 -2.297 1.00 1.00 C ATOM 1291 C ILE A 82 -17.735 5.013 -1.611 1.00 1.00 C ATOM 1292 O ILE A 82 -18.596 4.617 -0.850 1.00 1.00 O ATOM 1293 CB ILE A 82 -18.463 6.233 -3.688 1.00 1.00 C ATOM 1294 CG1 ILE A 82 -18.917 4.786 -3.895 1.00 1.00 C ATOM 1295 CG2 ILE A 82 -17.426 6.598 -4.750 1.00 1.00 C ATOM 1296 CD1 ILE A 82 -20.314 4.599 -3.299 1.00 1.00 C ATOM 0 H ILE A 82 -15.933 6.427 -3.245 1.00 1.00 H new ATOM 0 HA ILE A 82 -18.446 7.018 -1.655 1.00 1.00 H new ATOM 0 HB ILE A 82 -19.320 6.901 -3.774 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -18.929 4.546 -4.958 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -18.213 4.102 -3.421 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -17.869 6.496 -5.741 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -17.101 7.628 -4.602 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -16.568 5.931 -4.665 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -20.637 3.569 -3.446 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -20.287 4.822 -2.232 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -21.014 5.273 -3.793 1.00 1.00 H new ATOM 1308 N ALA A 83 -16.674 4.299 -1.870 1.00 1.00 N ATOM 1309 CA ALA A 83 -16.500 2.967 -1.230 1.00 1.00 C ATOM 1310 C ALA A 83 -16.375 3.131 0.286 1.00 1.00 C ATOM 1311 O ALA A 83 -17.152 2.584 1.043 1.00 1.00 O ATOM 1312 CB ALA A 83 -15.204 2.409 -1.819 1.00 1.00 C ATOM 0 H ALA A 83 -15.921 4.581 -2.497 1.00 1.00 H new ATOM 0 HA ALA A 83 -17.345 2.304 -1.413 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -15.006 1.425 -1.395 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -15.303 2.325 -2.901 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -14.378 3.079 -1.581 1.00 1.00 H new ATOM 1318 N LYS A 84 -15.404 3.880 0.738 1.00 1.00 N ATOM 1319 CA LYS A 84 -15.240 4.070 2.208 1.00 1.00 C ATOM 1320 C LYS A 84 -16.489 4.725 2.800 1.00 1.00 C ATOM 1321 O LYS A 84 -16.850 4.482 3.933 1.00 1.00 O ATOM 1322 CB LYS A 84 -14.029 4.992 2.355 1.00 1.00 C ATOM 1323 CG LYS A 84 -14.503 6.414 2.664 1.00 1.00 C ATOM 1324 CD LYS A 84 -13.508 7.421 2.086 1.00 1.00 C ATOM 1325 CE LYS A 84 -13.344 8.593 3.057 1.00 1.00 C ATOM 1326 NZ LYS A 84 -12.079 8.310 3.790 1.00 1.00 N ATOM 0 H LYS A 84 -14.721 4.366 0.156 1.00 1.00 H new ATOM 0 HA LYS A 84 -15.099 3.125 2.733 1.00 1.00 H new ATOM 0 HB2 LYS A 84 -13.380 4.632 3.153 1.00 1.00 H new ATOM 0 HB3 LYS A 84 -13.440 4.985 1.438 1.00 1.00 H new ATOM 0 HG2 LYS A 84 -15.493 6.579 2.238 1.00 1.00 H new ATOM 0 HG3 LYS A 84 -14.592 6.553 3.741 1.00 1.00 H new ATOM 0 HD2 LYS A 84 -12.545 6.939 1.915 1.00 1.00 H new ATOM 0 HD3 LYS A 84 -13.860 7.782 1.120 1.00 1.00 H new ATOM 0 HE2 LYS A 84 -13.288 9.542 2.524 1.00 1.00 H new ATOM 0 HE3 LYS A 84 -14.190 8.661 3.741 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 -11.871 9.095 4.439 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 -12.182 7.429 4.333 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 -11.299 8.208 3.110 1.00 1.00 H new ATOM 1339 N GLN A 85 -17.157 5.553 2.042 1.00 1.00 N ATOM 1340 CA GLN A 85 -18.383 6.213 2.572 1.00 1.00 C ATOM 1341 C GLN A 85 -19.497 5.179 2.738 1.00 1.00 C ATOM 1342 O GLN A 85 -20.374 5.322 3.567 1.00 1.00 O ATOM 1343 CB GLN A 85 -18.763 7.256 1.521 1.00 1.00 C ATOM 1344 CG GLN A 85 -20.284 7.417 1.487 1.00 1.00 C ATOM 1345 CD GLN A 85 -20.652 8.592 0.579 1.00 1.00 C ATOM 1346 OE1 GLN A 85 -21.803 8.770 0.234 1.00 1.00 O ATOM 1347 NE2 GLN A 85 -19.716 9.406 0.174 1.00 1.00 N ATOM 0 H GLN A 85 -16.908 5.799 1.084 1.00 1.00 H new ATOM 0 HA GLN A 85 -18.222 6.670 3.549 1.00 1.00 H new ATOM 0 HB2 GLN A 85 -18.291 8.211 1.754 1.00 1.00 H new ATOM 0 HB3 GLN A 85 -18.397 6.950 0.541 1.00 1.00 H new ATOM 0 HG2 GLN A 85 -20.749 6.502 1.122 1.00 1.00 H new ATOM 0 HG3 GLN A 85 -20.665 7.588 2.494 1.00 1.00 H new ATOM 0 HE21 GLN A 85 -18.750 9.256 0.464 1.00 1.00 H new ATOM 0 HE22 GLN A 85 -19.951 10.192 -0.432 1.00 1.00 H new ATOM 1356 N LEU A 86 -19.458 4.130 1.965 1.00 1.00 N ATOM 1357 CA LEU A 86 -20.503 3.076 2.087 1.00 1.00 C ATOM 1358 C LEU A 86 -20.051 2.028 3.103 1.00 1.00 C ATOM 1359 O LEU A 86 -20.836 1.516 3.877 1.00 1.00 O ATOM 1360 CB LEU A 86 -20.619 2.465 0.694 1.00 1.00 C ATOM 1361 CG LEU A 86 -22.094 2.243 0.355 1.00 1.00 C ATOM 1362 CD1 LEU A 86 -22.467 3.077 -0.872 1.00 1.00 C ATOM 1363 CD2 LEU A 86 -22.330 0.761 0.054 1.00 1.00 C ATOM 0 H LEU A 86 -18.748 3.957 1.254 1.00 1.00 H new ATOM 0 HA LEU A 86 -21.460 3.469 2.430 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -20.161 3.124 -0.043 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -20.079 1.519 0.654 1.00 1.00 H new ATOM 0 HG LEU A 86 -22.711 2.546 1.201 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -23.518 2.919 -1.114 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -22.298 4.133 -0.659 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -21.851 2.775 -1.719 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -23.381 0.602 -0.188 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -21.713 0.459 -0.792 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -22.064 0.166 0.927 1.00 1.00 H new ATOM 1375 N ALA A 87 -18.786 1.707 3.107 1.00 1.00 N ATOM 1376 CA ALA A 87 -18.275 0.695 4.072 1.00 1.00 C ATOM 1377 C ALA A 87 -17.875 1.373 5.387 1.00 1.00 C ATOM 1378 O ALA A 87 -18.404 1.068 6.437 1.00 1.00 O ATOM 1379 CB ALA A 87 -17.054 0.079 3.392 1.00 1.00 C ATOM 0 H ALA A 87 -18.084 2.103 2.482 1.00 1.00 H new ATOM 0 HA ALA A 87 -19.025 -0.057 4.318 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -16.619 -0.679 4.043 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -17.355 -0.380 2.450 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -16.315 0.856 3.197 1.00 1.00 H new ATOM 1385 N GLU A 88 -16.940 2.285 5.341 1.00 1.00 N ATOM 1386 CA GLU A 88 -16.503 2.971 6.585 1.00 1.00 C ATOM 1387 C GLU A 88 -17.674 3.129 7.554 1.00 1.00 C ATOM 1388 O GLU A 88 -17.488 3.233 8.751 1.00 1.00 O ATOM 1389 CB GLU A 88 -15.999 4.332 6.120 1.00 1.00 C ATOM 1390 CG GLU A 88 -17.032 5.408 6.458 1.00 1.00 C ATOM 1391 CD GLU A 88 -16.345 6.773 6.527 1.00 1.00 C ATOM 1392 OE1 GLU A 88 -15.232 6.879 6.037 1.00 1.00 O ATOM 1393 OE2 GLU A 88 -16.943 7.688 7.067 1.00 1.00 O ATOM 0 H GLU A 88 -16.461 2.583 4.491 1.00 1.00 H new ATOM 0 HA GLU A 88 -15.737 2.409 7.119 1.00 1.00 H new ATOM 0 HB2 GLU A 88 -15.049 4.563 6.602 1.00 1.00 H new ATOM 0 HB3 GLU A 88 -15.816 4.315 5.046 1.00 1.00 H new ATOM 0 HG2 GLU A 88 -17.818 5.423 5.703 1.00 1.00 H new ATOM 0 HG3 GLU A 88 -17.510 5.181 7.411 1.00 1.00 H new ATOM 1400 N LYS A 89 -18.878 3.133 7.057 1.00 1.00 N ATOM 1401 CA LYS A 89 -20.051 3.263 7.963 1.00 1.00 C ATOM 1402 C LYS A 89 -20.201 1.991 8.797 1.00 1.00 C ATOM 1403 O LYS A 89 -19.536 1.806 9.797 1.00 1.00 O ATOM 1404 CB LYS A 89 -21.252 3.445 7.034 1.00 1.00 C ATOM 1405 CG LYS A 89 -20.783 3.413 5.579 1.00 1.00 C ATOM 1406 CD LYS A 89 -21.832 4.083 4.689 1.00 1.00 C ATOM 1407 CE LYS A 89 -23.201 4.012 5.370 1.00 1.00 C ATOM 1408 NZ LYS A 89 -23.122 4.988 6.492 1.00 1.00 N ATOM 0 H LYS A 89 -19.100 3.052 6.065 1.00 1.00 H new ATOM 0 HA LYS A 89 -19.952 4.095 8.660 1.00 1.00 H new ATOM 0 HB2 LYS A 89 -21.983 2.655 7.209 1.00 1.00 H new ATOM 0 HB3 LYS A 89 -21.749 4.392 7.246 1.00 1.00 H new ATOM 0 HG2 LYS A 89 -19.827 3.928 5.483 1.00 1.00 H new ATOM 0 HG3 LYS A 89 -20.624 2.383 5.260 1.00 1.00 H new ATOM 0 HD2 LYS A 89 -21.559 5.122 4.506 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -21.871 3.588 3.719 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -24.001 4.271 4.677 1.00 1.00 H new ATOM 0 HE3 LYS A 89 -23.409 3.006 5.735 1.00 1.00 H new ATOM 0 HZ1 LYS A 89 -23.227 4.486 7.397 1.00 1.00 H new ATOM 0 HZ2 LYS A 89 -22.201 5.471 6.468 1.00 1.00 H new ATOM 0 HZ3 LYS A 89 -23.883 5.690 6.396 1.00 1.00 H new ATOM 1421 N PHE A 90 -21.067 1.107 8.383 1.00 1.00 N ATOM 1422 CA PHE A 90 -21.261 -0.163 9.139 1.00 1.00 C ATOM 1423 C PHE A 90 -20.713 -1.344 8.333 1.00 1.00 C ATOM 1424 O PHE A 90 -20.807 -2.485 8.740 1.00 1.00 O ATOM 1425 CB PHE A 90 -22.774 -0.291 9.318 1.00 1.00 C ATOM 1426 CG PHE A 90 -23.230 0.625 10.428 1.00 1.00 C ATOM 1427 CD1 PHE A 90 -22.373 0.906 11.499 1.00 1.00 C ATOM 1428 CD2 PHE A 90 -24.508 1.194 10.387 1.00 1.00 C ATOM 1429 CE1 PHE A 90 -22.796 1.755 12.530 1.00 1.00 C ATOM 1430 CE2 PHE A 90 -24.930 2.044 11.416 1.00 1.00 C ATOM 1431 CZ PHE A 90 -24.074 2.324 12.488 1.00 1.00 C ATOM 0 H PHE A 90 -21.650 1.210 7.552 1.00 1.00 H new ATOM 0 HA PHE A 90 -20.738 -0.160 10.095 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -23.284 -0.035 8.389 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -23.037 -1.322 9.552 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -21.386 0.468 11.530 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -25.169 0.977 9.561 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -22.136 1.970 13.357 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -25.916 2.484 11.383 1.00 1.00 H new ATOM 0 HZ PHE A 90 -24.400 2.979 13.282 1.00 1.00 H new ATOM 1441 N SER A 91 -20.150 -1.080 7.184 1.00 1.00 N ATOM 1442 CA SER A 91 -19.607 -2.183 6.345 1.00 1.00 C ATOM 1443 C SER A 91 -18.273 -2.684 6.906 1.00 1.00 C ATOM 1444 O SER A 91 -18.193 -3.750 7.482 1.00 1.00 O ATOM 1445 CB SER A 91 -19.409 -1.567 4.962 1.00 1.00 C ATOM 1446 OG SER A 91 -20.394 -0.564 4.750 1.00 1.00 O ATOM 0 H SER A 91 -20.043 -0.145 6.791 1.00 1.00 H new ATOM 0 HA SER A 91 -20.276 -3.043 6.319 1.00 1.00 H new ATOM 0 HB2 SER A 91 -18.411 -1.136 4.883 1.00 1.00 H new ATOM 0 HB3 SER A 91 -19.486 -2.337 4.194 1.00 1.00 H new ATOM 0 HG SER A 91 -20.839 -0.719 3.891 1.00 1.00 H new ATOM 1452 N VAL A 92 -17.223 -1.926 6.739 1.00 1.00 N ATOM 1453 CA VAL A 92 -15.896 -2.364 7.262 1.00 1.00 C ATOM 1454 C VAL A 92 -15.381 -1.366 8.301 1.00 1.00 C ATOM 1455 O VAL A 92 -14.267 -1.468 8.777 1.00 1.00 O ATOM 1456 CB VAL A 92 -14.979 -2.389 6.042 1.00 1.00 C ATOM 1457 CG1 VAL A 92 -14.441 -3.807 5.836 1.00 1.00 C ATOM 1458 CG2 VAL A 92 -15.768 -1.960 4.802 1.00 1.00 C ATOM 0 H VAL A 92 -17.226 -1.023 6.264 1.00 1.00 H new ATOM 0 HA VAL A 92 -15.946 -3.335 7.754 1.00 1.00 H new ATOM 0 HB VAL A 92 -14.147 -1.703 6.200 1.00 1.00 H new ATOM 0 HG11 VAL A 92 -13.786 -3.825 4.965 1.00 1.00 H new ATOM 0 HG12 VAL A 92 -13.880 -4.115 6.718 1.00 1.00 H new ATOM 0 HG13 VAL A 92 -15.274 -4.493 5.678 1.00 1.00 H new ATOM 0 HG21 VAL A 92 -15.114 -1.978 3.930 1.00 1.00 H new ATOM 0 HG22 VAL A 92 -16.600 -2.646 4.645 1.00 1.00 H new ATOM 0 HG23 VAL A 92 -16.152 -0.950 4.947 1.00 1.00 H new ATOM 1468 N TYR A 93 -16.182 -0.401 8.660 1.00 1.00 N ATOM 1469 CA TYR A 93 -15.738 0.602 9.670 1.00 1.00 C ATOM 1470 C TYR A 93 -14.811 -0.059 10.694 1.00 1.00 C ATOM 1471 O TYR A 93 -13.942 0.573 11.261 1.00 1.00 O ATOM 1472 CB TYR A 93 -17.024 1.084 10.341 1.00 1.00 C ATOM 1473 CG TYR A 93 -17.171 0.417 11.688 1.00 1.00 C ATOM 1474 CD1 TYR A 93 -17.424 -0.958 11.763 1.00 1.00 C ATOM 1475 CD2 TYR A 93 -17.053 1.172 12.861 1.00 1.00 C ATOM 1476 CE1 TYR A 93 -17.561 -1.577 13.012 1.00 1.00 C ATOM 1477 CE2 TYR A 93 -17.190 0.553 14.109 1.00 1.00 C ATOM 1478 CZ TYR A 93 -17.444 -0.822 14.184 1.00 1.00 C ATOM 1479 OH TYR A 93 -17.578 -1.432 15.415 1.00 1.00 O ATOM 0 H TYR A 93 -17.125 -0.263 8.298 1.00 1.00 H new ATOM 0 HA TYR A 93 -15.181 1.425 9.221 1.00 1.00 H new ATOM 0 HB2 TYR A 93 -17.000 2.167 10.461 1.00 1.00 H new ATOM 0 HB3 TYR A 93 -17.884 0.851 9.713 1.00 1.00 H new ATOM 0 HD1 TYR A 93 -17.513 -1.541 10.858 1.00 1.00 H new ATOM 0 HD2 TYR A 93 -16.856 2.232 12.803 1.00 1.00 H new ATOM 0 HE1 TYR A 93 -17.757 -2.637 13.070 1.00 1.00 H new ATOM 0 HE2 TYR A 93 -17.100 1.136 15.014 1.00 1.00 H new ATOM 0 HH TYR A 93 -17.468 -0.765 16.124 1.00 1.00 H new ATOM 1489 N ASP A 94 -14.988 -1.330 10.931 1.00 1.00 N ATOM 1490 CA ASP A 94 -14.117 -2.036 11.914 1.00 1.00 C ATOM 1491 C ASP A 94 -12.892 -2.627 11.208 1.00 1.00 C ATOM 1492 O ASP A 94 -11.764 -2.349 11.563 1.00 1.00 O ATOM 1493 CB ASP A 94 -14.991 -3.149 12.491 1.00 1.00 C ATOM 1494 CG ASP A 94 -15.197 -2.913 13.988 1.00 1.00 C ATOM 1495 OD1 ASP A 94 -14.991 -1.793 14.426 1.00 1.00 O ATOM 1496 OD2 ASP A 94 -15.555 -3.857 14.674 1.00 1.00 O ATOM 0 H ASP A 94 -15.699 -1.911 10.486 1.00 1.00 H new ATOM 0 HA ASP A 94 -13.744 -1.367 12.690 1.00 1.00 H new ATOM 0 HB2 ASP A 94 -15.954 -3.172 11.980 1.00 1.00 H new ATOM 0 HB3 ASP A 94 -14.520 -4.118 12.326 1.00 1.00 H new ATOM 1501 N GLN A 95 -13.109 -3.443 10.212 1.00 1.00 N ATOM 1502 CA GLN A 95 -11.961 -4.058 9.484 1.00 1.00 C ATOM 1503 C GLN A 95 -11.005 -2.975 8.975 1.00 1.00 C ATOM 1504 O GLN A 95 -9.802 -3.149 8.976 1.00 1.00 O ATOM 1505 CB GLN A 95 -12.593 -4.808 8.312 1.00 1.00 C ATOM 1506 CG GLN A 95 -12.250 -6.296 8.412 1.00 1.00 C ATOM 1507 CD GLN A 95 -12.277 -6.728 9.879 1.00 1.00 C ATOM 1508 OE1 GLN A 95 -11.265 -7.115 10.429 1.00 1.00 O ATOM 1509 NE2 GLN A 95 -13.401 -6.681 10.540 1.00 1.00 N ATOM 0 H GLN A 95 -14.032 -3.711 9.871 1.00 1.00 H new ATOM 0 HA GLN A 95 -11.375 -4.717 10.125 1.00 1.00 H new ATOM 0 HB2 GLN A 95 -13.674 -4.672 8.321 1.00 1.00 H new ATOM 0 HB3 GLN A 95 -12.228 -4.403 7.368 1.00 1.00 H new ATOM 0 HG2 GLN A 95 -12.964 -6.884 7.835 1.00 1.00 H new ATOM 0 HG3 GLN A 95 -11.265 -6.483 7.985 1.00 1.00 H new ATOM 0 HE21 GLN A 95 -14.251 -6.356 10.079 1.00 1.00 H new ATOM 0 HE22 GLN A 95 -13.430 -6.969 11.518 1.00 1.00 H new ATOM 1518 N LEU A 96 -11.526 -1.863 8.535 1.00 1.00 N ATOM 1519 CA LEU A 96 -10.638 -0.777 8.025 1.00 1.00 C ATOM 1520 C LEU A 96 -10.266 0.183 9.157 1.00 1.00 C ATOM 1521 O LEU A 96 -10.162 1.377 8.960 1.00 1.00 O ATOM 1522 CB LEU A 96 -11.466 -0.056 6.961 1.00 1.00 C ATOM 1523 CG LEU A 96 -12.792 -0.788 6.758 1.00 1.00 C ATOM 1524 CD1 LEU A 96 -13.597 -0.094 5.658 1.00 1.00 C ATOM 1525 CD2 LEU A 96 -12.517 -2.237 6.349 1.00 1.00 C ATOM 0 H LEU A 96 -12.525 -1.658 8.506 1.00 1.00 H new ATOM 0 HA LEU A 96 -9.703 -1.166 7.622 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -11.651 0.974 7.266 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -10.914 -0.016 6.022 1.00 1.00 H new ATOM 0 HG LEU A 96 -13.360 -0.773 7.688 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -14.542 -0.617 5.514 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -13.794 0.938 5.947 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -13.029 -0.108 4.728 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -13.462 -2.760 6.204 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -11.948 -2.251 5.419 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -11.944 -2.734 7.132 1.00 1.00 H new ATOM 1537 N LYS A 97 -10.065 -0.328 10.340 1.00 1.00 N ATOM 1538 CA LYS A 97 -9.699 0.559 11.481 1.00 1.00 C ATOM 1539 C LYS A 97 -8.409 1.324 11.165 1.00 1.00 C ATOM 1540 O LYS A 97 -8.395 2.539 11.154 1.00 1.00 O ATOM 1541 CB LYS A 97 -9.486 -0.385 12.665 1.00 1.00 C ATOM 1542 CG LYS A 97 -10.829 -0.987 13.083 1.00 1.00 C ATOM 1543 CD LYS A 97 -11.966 -0.225 12.400 1.00 1.00 C ATOM 1544 CE LYS A 97 -12.629 0.716 13.408 1.00 1.00 C ATOM 1545 NZ LYS A 97 -12.001 0.381 14.716 1.00 1.00 N ATOM 0 H LYS A 97 -10.138 -1.320 10.566 1.00 1.00 H new ATOM 0 HA LYS A 97 -10.467 1.304 11.687 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -8.789 -1.177 12.392 1.00 1.00 H new ATOM 0 HB3 LYS A 97 -9.042 0.156 13.500 1.00 1.00 H new ATOM 0 HG2 LYS A 97 -10.868 -2.041 12.809 1.00 1.00 H new ATOM 0 HG3 LYS A 97 -10.941 -0.935 14.166 1.00 1.00 H new ATOM 0 HD2 LYS A 97 -11.580 0.344 11.555 1.00 1.00 H new ATOM 0 HD3 LYS A 97 -12.701 -0.926 12.003 1.00 1.00 H new ATOM 0 HE2 LYS A 97 -12.460 1.760 13.144 1.00 1.00 H new ATOM 0 HE3 LYS A 97 -13.708 0.566 13.438 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 -12.463 0.925 15.472 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 -12.111 -0.636 14.904 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 -10.989 0.620 14.687 1.00 1.00 H new ATOM 1558 N PRO A 98 -7.367 0.578 10.918 1.00 1.00 N ATOM 1559 CA PRO A 98 -6.053 1.189 10.597 1.00 1.00 C ATOM 1560 C PRO A 98 -6.102 1.881 9.231 1.00 1.00 C ATOM 1561 O PRO A 98 -5.870 3.067 9.116 1.00 1.00 O ATOM 1562 CB PRO A 98 -5.092 0.001 10.567 1.00 1.00 C ATOM 1563 CG PRO A 98 -5.954 -1.205 10.361 1.00 1.00 C ATOM 1564 CD PRO A 98 -7.316 -0.886 10.916 1.00 1.00 C ATOM 0 HA PRO A 98 -5.755 1.952 11.316 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -4.364 0.105 9.762 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -4.530 -0.073 11.498 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -6.020 -1.453 9.302 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -5.528 -2.072 10.865 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -8.107 -1.312 10.299 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -7.442 -1.291 11.920 1.00 1.00 H new ATOM 1572 N LEU A 99 -6.403 1.146 8.194 1.00 1.00 N ATOM 1573 CA LEU A 99 -6.467 1.763 6.837 1.00 1.00 C ATOM 1574 C LEU A 99 -7.202 3.103 6.899 1.00 1.00 C ATOM 1575 O LEU A 99 -6.853 4.046 6.218 1.00 1.00 O ATOM 1576 CB LEU A 99 -7.246 0.761 5.984 1.00 1.00 C ATOM 1577 CG LEU A 99 -8.022 1.510 4.900 1.00 1.00 C ATOM 1578 CD1 LEU A 99 -7.457 1.149 3.525 1.00 1.00 C ATOM 1579 CD2 LEU A 99 -9.498 1.110 4.963 1.00 1.00 C ATOM 0 H LEU A 99 -6.607 0.147 8.227 1.00 1.00 H new ATOM 0 HA LEU A 99 -5.477 1.964 6.427 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -6.562 0.046 5.528 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -7.933 0.191 6.610 1.00 1.00 H new ATOM 0 HG LEU A 99 -7.927 2.584 5.062 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -8.010 1.683 2.753 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -6.405 1.431 3.478 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -7.552 0.075 3.363 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -10.053 1.643 4.191 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -9.591 0.036 4.801 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -9.903 1.365 5.942 1.00 1.00 H new ATOM 1591 N PHE A 100 -8.217 3.196 7.714 1.00 1.00 N ATOM 1592 CA PHE A 100 -8.972 4.476 7.822 1.00 1.00 C ATOM 1593 C PHE A 100 -8.366 5.356 8.918 1.00 1.00 C ATOM 1594 O PHE A 100 -8.542 6.558 8.933 1.00 1.00 O ATOM 1595 CB PHE A 100 -10.398 4.066 8.190 1.00 1.00 C ATOM 1596 CG PHE A 100 -11.342 4.485 7.088 1.00 1.00 C ATOM 1597 CD1 PHE A 100 -11.791 5.809 7.017 1.00 1.00 C ATOM 1598 CD2 PHE A 100 -11.767 3.549 6.137 1.00 1.00 C ATOM 1599 CE1 PHE A 100 -12.666 6.198 5.995 1.00 1.00 C ATOM 1600 CE2 PHE A 100 -12.641 3.938 5.115 1.00 1.00 C ATOM 1601 CZ PHE A 100 -13.090 5.263 5.044 1.00 1.00 C ATOM 0 H PHE A 100 -8.556 2.441 8.310 1.00 1.00 H new ATOM 0 HA PHE A 100 -8.940 5.053 6.898 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -10.451 2.987 8.338 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -10.691 4.532 9.131 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -11.463 6.531 7.750 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -11.421 2.528 6.192 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -13.013 7.219 5.941 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -12.969 3.217 4.381 1.00 1.00 H new ATOM 0 HZ PHE A 100 -13.764 5.563 4.255 1.00 1.00 H new ATOM 1611 N ASP A 101 -7.656 4.764 9.840 1.00 1.00 N ATOM 1612 CA ASP A 101 -7.041 5.564 10.938 1.00 1.00 C ATOM 1613 C ASP A 101 -5.767 6.255 10.447 1.00 1.00 C ATOM 1614 O ASP A 101 -5.202 7.090 11.127 1.00 1.00 O ATOM 1615 CB ASP A 101 -6.712 4.547 12.031 1.00 1.00 C ATOM 1616 CG ASP A 101 -7.901 4.420 12.985 1.00 1.00 C ATOM 1617 OD1 ASP A 101 -8.791 3.639 12.690 1.00 1.00 O ATOM 1618 OD2 ASP A 101 -7.901 5.103 13.996 1.00 1.00 O ATOM 0 H ASP A 101 -7.475 3.761 9.880 1.00 1.00 H new ATOM 0 HA ASP A 101 -7.706 6.350 11.296 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -6.485 3.579 11.585 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -5.824 4.861 12.580 1.00 1.00 H new ATOM 1805 N LYS A 116 9.829 -6.742 2.334 1.00 1.00 N ATOM 1806 CA LYS A 116 10.754 -6.738 1.164 1.00 1.00 C ATOM 1807 C LYS A 116 11.730 -7.914 1.256 1.00 1.00 C ATOM 1808 O LYS A 116 12.106 -8.338 2.330 1.00 1.00 O ATOM 1809 CB LYS A 116 11.503 -5.409 1.256 1.00 1.00 C ATOM 1810 CG LYS A 116 11.557 -4.756 -0.126 1.00 1.00 C ATOM 1811 CD LYS A 116 12.500 -3.552 -0.088 1.00 1.00 C ATOM 1812 CE LYS A 116 11.715 -2.300 0.312 1.00 1.00 C ATOM 1813 NZ LYS A 116 12.746 -1.337 0.789 1.00 1.00 N ATOM 0 HA LYS A 116 10.223 -6.841 0.218 1.00 1.00 H new ATOM 0 HB2 LYS A 116 11.004 -4.747 1.963 1.00 1.00 H new ATOM 0 HB3 LYS A 116 12.513 -5.574 1.632 1.00 1.00 H new ATOM 0 HG2 LYS A 116 11.902 -5.477 -0.867 1.00 1.00 H new ATOM 0 HG3 LYS A 116 10.559 -4.440 -0.429 1.00 1.00 H new ATOM 0 HD2 LYS A 116 13.307 -3.731 0.623 1.00 1.00 H new ATOM 0 HD3 LYS A 116 12.962 -3.408 -1.065 1.00 1.00 H new ATOM 0 HE2 LYS A 116 11.158 -1.896 -0.533 1.00 1.00 H new ATOM 0 HE3 LYS A 116 10.990 -2.522 1.095 1.00 1.00 H new ATOM 0 HZ1 LYS A 116 12.285 -0.452 1.082 1.00 1.00 H new ATOM 0 HZ2 LYS A 116 13.255 -1.746 1.598 1.00 1.00 H new ATOM 0 HZ3 LYS A 116 13.419 -1.140 0.021 1.00 1.00 H new ATOM 1826 N HIS A 117 12.144 -8.441 0.136 1.00 1.00 N ATOM 1827 CA HIS A 117 13.096 -9.588 0.159 1.00 1.00 C ATOM 1828 C HIS A 117 14.530 -9.082 0.338 1.00 1.00 C ATOM 1829 O HIS A 117 14.895 -8.035 -0.160 1.00 1.00 O ATOM 1830 CB HIS A 117 12.933 -10.265 -1.202 1.00 1.00 C ATOM 1831 CG HIS A 117 11.528 -10.060 -1.699 1.00 1.00 C ATOM 1832 ND1 HIS A 117 10.424 -10.550 -1.019 1.00 1.00 N ATOM 1833 CD2 HIS A 117 11.033 -9.419 -2.807 1.00 1.00 C ATOM 1834 CE1 HIS A 117 9.330 -10.200 -1.718 1.00 1.00 C ATOM 1835 NE2 HIS A 117 9.644 -9.509 -2.818 1.00 1.00 N ATOM 0 H HIS A 117 11.864 -8.127 -0.793 1.00 1.00 H new ATOM 0 HA HIS A 117 12.896 -10.274 0.982 1.00 1.00 H new ATOM 0 HB2 HIS A 117 13.646 -9.850 -1.914 1.00 1.00 H new ATOM 0 HB3 HIS A 117 13.149 -11.330 -1.118 1.00 1.00 H new ATOM 0 HD2 HIS A 117 11.630 -8.921 -3.556 1.00 1.00 H new ATOM 0 HE1 HIS A 117 8.320 -10.447 -1.426 1.00 1.00 H new ATOM 0 HE2 HIS A 117 9.004 -9.129 -3.515 1.00 1.00 H new ATOM 1843 N HIS A 118 15.344 -9.816 1.046 1.00 1.00 N ATOM 1844 CA HIS A 118 16.753 -9.375 1.256 1.00 1.00 C ATOM 1845 C HIS A 118 17.393 -8.990 -0.081 1.00 1.00 C ATOM 1846 O HIS A 118 17.185 -9.637 -1.089 1.00 1.00 O ATOM 1847 CB HIS A 118 17.461 -10.589 1.859 1.00 1.00 C ATOM 1848 CG HIS A 118 16.785 -11.848 1.388 1.00 1.00 C ATOM 1849 ND1 HIS A 118 16.377 -12.840 2.265 1.00 1.00 N ATOM 1850 CD2 HIS A 118 16.438 -12.290 0.134 1.00 1.00 C ATOM 1851 CE1 HIS A 118 15.813 -13.820 1.536 1.00 1.00 C ATOM 1852 NE2 HIS A 118 15.825 -13.535 0.230 1.00 1.00 N ATOM 0 H HIS A 118 15.095 -10.701 1.488 1.00 1.00 H new ATOM 0 HA HIS A 118 16.820 -8.500 1.903 1.00 1.00 H new ATOM 0 HB2 HIS A 118 18.510 -10.595 1.565 1.00 1.00 H new ATOM 0 HB3 HIS A 118 17.436 -10.535 2.947 1.00 1.00 H new ATOM 0 HD2 HIS A 118 16.614 -11.753 -0.786 1.00 1.00 H new ATOM 0 HE1 HIS A 118 15.401 -14.726 1.955 1.00 1.00 H new ATOM 0 HE2 HIS A 118 15.463 -14.108 -0.532 1.00 1.00 H new ATOM 1860 N HIS A 119 18.169 -7.942 -0.098 1.00 1.00 N ATOM 1861 CA HIS A 119 18.820 -7.516 -1.371 1.00 1.00 C ATOM 1862 C HIS A 119 20.277 -7.989 -1.404 1.00 1.00 C ATOM 1863 O HIS A 119 20.905 -8.166 -0.379 1.00 1.00 O ATOM 1864 CB HIS A 119 18.751 -5.990 -1.361 1.00 1.00 C ATOM 1865 CG HIS A 119 17.965 -5.515 -2.552 1.00 1.00 C ATOM 1866 ND1 HIS A 119 18.272 -4.341 -3.220 1.00 1.00 N ATOM 1867 CD2 HIS A 119 16.882 -6.047 -3.207 1.00 1.00 C ATOM 1868 CE1 HIS A 119 17.390 -4.205 -4.227 1.00 1.00 C ATOM 1869 NE2 HIS A 119 16.520 -5.217 -4.264 1.00 1.00 N ATOM 0 H HIS A 119 18.381 -7.362 0.714 1.00 1.00 H new ATOM 0 HA HIS A 119 18.329 -7.939 -2.247 1.00 1.00 H new ATOM 0 HB2 HIS A 119 18.282 -5.643 -0.440 1.00 1.00 H new ATOM 0 HB3 HIS A 119 19.756 -5.570 -1.385 1.00 1.00 H new ATOM 0 HD2 HIS A 119 16.386 -6.969 -2.942 1.00 1.00 H new ATOM 0 HE1 HIS A 119 17.386 -3.378 -4.921 1.00 1.00 H new ATOM 0 HE2 HIS A 119 15.755 -5.353 -4.925 1.00 1.00 H new ATOM 1877 N ALA A 120 20.817 -8.195 -2.574 1.00 1.00 N ATOM 1878 CA ALA A 120 22.232 -8.655 -2.670 1.00 1.00 C ATOM 1879 C ALA A 120 23.104 -7.903 -1.661 1.00 1.00 C ATOM 1880 O ALA A 120 23.033 -6.695 -1.543 1.00 1.00 O ATOM 1881 CB ALA A 120 22.660 -8.323 -4.100 1.00 1.00 C ATOM 0 H ALA A 120 20.341 -8.065 -3.467 1.00 1.00 H new ATOM 0 HA ALA A 120 22.336 -9.717 -2.449 1.00 1.00 H new ATOM 0 HB1 ALA A 120 23.694 -8.632 -4.251 1.00 1.00 H new ATOM 0 HB2 ALA A 120 22.017 -8.851 -4.804 1.00 1.00 H new ATOM 0 HB3 ALA A 120 22.574 -7.249 -4.265 1.00 1.00 H new ATOM 1887 N SER A 121 23.926 -8.607 -0.931 1.00 1.00 N ATOM 1888 CA SER A 121 24.801 -7.931 0.069 1.00 1.00 C ATOM 1889 C SER A 121 26.247 -7.896 -0.432 1.00 1.00 C ATOM 1890 O SER A 121 27.019 -8.804 -0.195 1.00 1.00 O ATOM 1891 CB SER A 121 24.691 -8.784 1.331 1.00 1.00 C ATOM 1892 OG SER A 121 25.698 -9.788 1.309 1.00 1.00 O ATOM 0 H SER A 121 24.029 -9.620 -0.984 1.00 1.00 H new ATOM 0 HA SER A 121 24.503 -6.898 0.248 1.00 1.00 H new ATOM 0 HB2 SER A 121 24.804 -8.159 2.217 1.00 1.00 H new ATOM 0 HB3 SER A 121 23.704 -9.244 1.388 1.00 1.00 H new ATOM 0 HG SER A 121 26.070 -9.859 0.405 1.00 1.00 H new ATOM 1898 N LYS A 122 26.621 -6.855 -1.124 1.00 1.00 N ATOM 1899 CA LYS A 122 28.017 -6.764 -1.640 1.00 1.00 C ATOM 1900 C LYS A 122 29.000 -6.599 -0.478 1.00 1.00 C ATOM 1901 O LYS A 122 29.029 -5.580 0.184 1.00 1.00 O ATOM 1902 CB LYS A 122 28.029 -5.523 -2.533 1.00 1.00 C ATOM 1903 CG LYS A 122 26.741 -5.472 -3.354 1.00 1.00 C ATOM 1904 CD LYS A 122 26.855 -4.380 -4.419 1.00 1.00 C ATOM 1905 CE LYS A 122 27.888 -4.796 -5.469 1.00 1.00 C ATOM 1906 NZ LYS A 122 28.114 -6.248 -5.230 1.00 1.00 N ATOM 0 H LYS A 122 26.021 -6.063 -1.355 1.00 1.00 H new ATOM 0 HA LYS A 122 28.316 -7.660 -2.184 1.00 1.00 H new ATOM 0 HB2 LYS A 122 28.120 -4.624 -1.923 1.00 1.00 H new ATOM 0 HB3 LYS A 122 28.894 -5.547 -3.196 1.00 1.00 H new ATOM 0 HG2 LYS A 122 26.560 -6.438 -3.826 1.00 1.00 H new ATOM 0 HG3 LYS A 122 25.890 -5.272 -2.703 1.00 1.00 H new ATOM 0 HD2 LYS A 122 25.887 -4.216 -4.891 1.00 1.00 H new ATOM 0 HD3 LYS A 122 27.149 -3.437 -3.958 1.00 1.00 H new ATOM 0 HE2 LYS A 122 27.520 -4.614 -6.479 1.00 1.00 H new ATOM 0 HE3 LYS A 122 28.813 -4.229 -5.360 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 28.676 -6.645 -6.010 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 28.625 -6.377 -4.334 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 27.198 -6.738 -5.179 1.00 1.00 H new ATOM 1919 N VAL A 123 29.806 -7.594 -0.225 1.00 1.00 N ATOM 1920 CA VAL A 123 30.786 -7.495 0.894 1.00 1.00 C ATOM 1921 C VAL A 123 32.187 -7.209 0.346 1.00 1.00 C ATOM 1922 O VAL A 123 32.550 -7.663 -0.720 1.00 1.00 O ATOM 1923 CB VAL A 123 30.746 -8.860 1.579 1.00 1.00 C ATOM 1924 CG1 VAL A 123 31.890 -8.960 2.589 1.00 1.00 C ATOM 1925 CG2 VAL A 123 29.409 -9.025 2.306 1.00 1.00 C ATOM 0 H VAL A 123 29.828 -8.471 -0.745 1.00 1.00 H new ATOM 0 HA VAL A 123 30.544 -6.687 1.584 1.00 1.00 H new ATOM 0 HB VAL A 123 30.854 -9.645 0.830 1.00 1.00 H new ATOM 0 HG11 VAL A 123 31.860 -9.934 3.077 1.00 1.00 H new ATOM 0 HG12 VAL A 123 32.843 -8.842 2.073 1.00 1.00 H new ATOM 0 HG13 VAL A 123 31.783 -8.176 3.338 1.00 1.00 H new ATOM 0 HG21 VAL A 123 29.379 -9.998 2.795 1.00 1.00 H new ATOM 0 HG22 VAL A 123 29.302 -8.239 3.054 1.00 1.00 H new ATOM 0 HG23 VAL A 123 28.593 -8.955 1.587 1.00 1.00 H new ATOM 1935 N ASP A 124 32.975 -6.460 1.067 1.00 1.00 N ATOM 1936 CA ASP A 124 34.352 -6.147 0.587 1.00 1.00 C ATOM 1937 C ASP A 124 35.147 -7.439 0.383 1.00 1.00 C ATOM 1938 O ASP A 124 36.067 -7.672 1.150 1.00 1.00 O ATOM 1939 CB ASP A 124 34.977 -5.302 1.697 1.00 1.00 C ATOM 1940 CG ASP A 124 34.018 -4.174 2.082 1.00 1.00 C ATOM 1941 OD1 ASP A 124 33.851 -3.267 1.283 1.00 1.00 O ATOM 1942 OD2 ASP A 124 33.466 -4.236 3.168 1.00 1.00 O ATOM 0 H ASP A 124 32.726 -6.051 1.968 1.00 1.00 H new ATOM 0 HA ASP A 124 34.347 -5.623 -0.369 1.00 1.00 H new ATOM 0 HB2 ASP A 124 35.190 -5.925 2.566 1.00 1.00 H new ATOM 0 HB3 ASP A 124 35.927 -4.887 1.361 1.00 1.00 H new