USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=28 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 26 MET CE :methyl -168:sc= -19.4! (180deg=-7.49!) USER MOD Set 1.2: A 74 GLN : amide:sc= -70.8! C(o=-90!,f=-91!) USER MOD Set 2.1: A 65 LYS NZ :NH3+ -156:sc= -19.1! (180deg=-2.43!) USER MOD Set 2.2: A 67 GLN : amide:sc= -40.6! C(o=-60!,f=-42!) USER MOD Set 3.1: A 20 HIS : no HE2:sc= -79.2! C(o=-1.6e+02!,f=-1.7e+02!) USER MOD Set 3.2: A 38 HIS : no HE2:sc= -78.1! C(o=-1.6e+02!,f=-1.7e+02!) USER MOD Set 4.1: A 21 SER OG : rot 95:sc= -0.506 USER MOD Set 4.2: A 95 GLN : amide:sc= -2.52! K(o=-3!,f=-0.54) USER MOD Single : A 4 GLN : amide:sc= -1.73! K(o=-1.7!,f=-0.27) USER MOD Single : A 6 TYR OH : rot -38:sc= -11.7! USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 64:sc= -3.52! USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= -5.95! (180deg=-7.21!) USER MOD Single : A 30 LYS NZ :NH3+ -177:sc= -13.5! (180deg=-14.2!) USER MOD Single : A 35 ASN : amide:sc= -28.4! C(o=-28!,f=-56!) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.27) USER MOD Single : A 44 ASN : amide:sc= -56.4! C(o=-56!,f=-58!) 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 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -165:sc= -4.81! (180deg=-6.03!) USER MOD Single : A 62 THR OG1 : rot -152:sc= -0.203! USER MOD Single : A 63 HIS : no HE2:sc= -31.1! C(o=-31!,f=-40!) USER MOD Single : A 72 LYS NZ :NH3+ 142:sc= -0.544 (180deg=-3.23!) 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= -0.999 K(o=-1,f=-0.2) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -1.05 K(o=-1,f=-0.24) USER MOD Single : A 89 LYS NZ :NH3+ -118:sc= -5.99! (180deg=-8.11!) USER MOD Single : A 91 SER OG : rot 100:sc= -3.58! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= -0.714 K(o=-0.71,f=-1.7) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HD1:sc= 0.135 K(o=0.14,f=-2.7!) USER MOD Single : A 121 SER OG : rot 180:sc= 0.00652 USER MOD Single : A 122 LYS NZ :NH3+ 149:sc= -1.04! (180deg=-3.78!) USER MOD ----------------------------------------------------------------- ATOM 26 N GLN A 4 -2.130 -3.057 8.299 1.00 1.00 N ATOM 27 CA GLN A 4 -2.037 -1.630 7.878 1.00 1.00 C ATOM 28 C GLN A 4 -2.484 -1.474 6.422 1.00 1.00 C ATOM 29 O GLN A 4 -2.932 -2.412 5.795 1.00 1.00 O ATOM 30 CB GLN A 4 -0.560 -1.268 8.021 1.00 1.00 C ATOM 31 CG GLN A 4 0.003 -0.872 6.655 1.00 1.00 C ATOM 32 CD GLN A 4 1.494 -1.210 6.597 1.00 1.00 C ATOM 33 OE1 GLN A 4 2.088 -1.209 5.537 1.00 1.00 O ATOM 34 NE2 GLN A 4 2.128 -1.503 7.700 1.00 1.00 N ATOM 0 HA GLN A 4 -2.677 -0.984 8.479 1.00 1.00 H new ATOM 0 HB2 GLN A 4 -0.443 -0.446 8.727 1.00 1.00 H new ATOM 0 HB3 GLN A 4 -0.004 -2.115 8.424 1.00 1.00 H new ATOM 0 HG2 GLN A 4 -0.531 -1.399 5.864 1.00 1.00 H new ATOM 0 HG3 GLN A 4 -0.145 0.194 6.484 1.00 1.00 H new ATOM 0 HE21 GLN A 4 1.630 -1.504 8.590 1.00 1.00 H new ATOM 0 HE22 GLN A 4 3.122 -1.731 7.672 1.00 1.00 H new ATOM 43 N ILE A 5 -2.352 -0.295 5.878 1.00 1.00 N ATOM 44 CA ILE A 5 -2.753 -0.075 4.460 1.00 1.00 C ATOM 45 C ILE A 5 -1.505 0.153 3.603 1.00 1.00 C ATOM 46 O ILE A 5 -1.046 1.266 3.441 1.00 1.00 O ATOM 47 CB ILE A 5 -3.629 1.179 4.489 1.00 1.00 C ATOM 48 CG1 ILE A 5 -4.991 0.863 3.869 1.00 1.00 C ATOM 49 CG2 ILE A 5 -2.953 2.294 3.690 1.00 1.00 C ATOM 50 CD1 ILE A 5 -5.363 1.955 2.866 1.00 1.00 C ATOM 0 H ILE A 5 -1.983 0.527 6.356 1.00 1.00 H new ATOM 0 HA ILE A 5 -3.284 -0.926 4.034 1.00 1.00 H new ATOM 0 HB ILE A 5 -3.764 1.503 5.521 1.00 1.00 H new ATOM 0 HG12 ILE A 5 -4.959 -0.106 3.372 1.00 1.00 H new ATOM 0 HG13 ILE A 5 -5.750 0.797 4.648 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -3.578 3.187 3.711 1.00 1.00 H new ATOM 0 HG22 ILE A 5 -1.982 2.520 4.131 1.00 1.00 H new ATOM 0 HG23 ILE A 5 -2.817 1.971 2.658 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -6.334 1.729 2.425 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -5.412 2.917 3.377 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -4.609 1.999 2.080 1.00 1.00 H new ATOM 62 N TYR A 6 -0.943 -0.896 3.063 1.00 1.00 N ATOM 63 CA TYR A 6 0.286 -0.739 2.230 1.00 1.00 C ATOM 64 C TYR A 6 -0.060 -0.162 0.853 1.00 1.00 C ATOM 65 O TYR A 6 -1.204 -0.126 0.449 1.00 1.00 O ATOM 66 CB TYR A 6 0.857 -2.150 2.087 1.00 1.00 C ATOM 67 CG TYR A 6 -0.017 -3.133 2.831 1.00 1.00 C ATOM 68 CD1 TYR A 6 -0.394 -2.874 4.154 1.00 1.00 C ATOM 69 CD2 TYR A 6 -0.448 -4.304 2.196 1.00 1.00 C ATOM 70 CE1 TYR A 6 -1.203 -3.786 4.842 1.00 1.00 C ATOM 71 CE2 TYR A 6 -1.255 -5.217 2.885 1.00 1.00 C ATOM 72 CZ TYR A 6 -1.633 -4.958 4.207 1.00 1.00 C ATOM 73 OH TYR A 6 -2.430 -5.858 4.885 1.00 1.00 O ATOM 0 H TYR A 6 -1.281 -1.853 3.162 1.00 1.00 H new ATOM 0 HA TYR A 6 0.998 -0.052 2.688 1.00 1.00 H new ATOM 0 HB2 TYR A 6 0.914 -2.424 1.034 1.00 1.00 H new ATOM 0 HB3 TYR A 6 1.873 -2.183 2.480 1.00 1.00 H new ATOM 0 HD1 TYR A 6 -0.061 -1.971 4.644 1.00 1.00 H new ATOM 0 HD2 TYR A 6 -0.158 -4.503 1.175 1.00 1.00 H new ATOM 0 HE1 TYR A 6 -1.496 -3.586 5.862 1.00 1.00 H new ATOM 0 HE2 TYR A 6 -1.586 -6.121 2.396 1.00 1.00 H new ATOM 0 HH TYR A 6 -2.139 -5.914 5.819 1.00 1.00 H new ATOM 83 N SER A 7 0.934 0.280 0.131 1.00 1.00 N ATOM 84 CA SER A 7 0.684 0.848 -1.226 1.00 1.00 C ATOM 85 C SER A 7 1.414 0.016 -2.284 1.00 1.00 C ATOM 86 O SER A 7 2.441 -0.578 -2.017 1.00 1.00 O ATOM 87 CB SER A 7 1.249 2.268 -1.171 1.00 1.00 C ATOM 88 OG SER A 7 0.315 3.167 -1.754 1.00 1.00 O ATOM 0 H SER A 7 1.911 0.272 0.423 1.00 1.00 H new ATOM 0 HA SER A 7 -0.373 0.843 -1.491 1.00 1.00 H new ATOM 0 HB2 SER A 7 1.449 2.553 -0.138 1.00 1.00 H new ATOM 0 HB3 SER A 7 2.198 2.315 -1.704 1.00 1.00 H new ATOM 0 HG SER A 7 0.673 4.079 -1.719 1.00 1.00 H new ATOM 94 N ALA A 8 0.898 -0.035 -3.481 1.00 1.00 N ATOM 95 CA ALA A 8 1.572 -0.834 -4.547 1.00 1.00 C ATOM 96 C ALA A 8 1.304 -0.223 -5.925 1.00 1.00 C ATOM 97 O ALA A 8 0.348 0.500 -6.121 1.00 1.00 O ATOM 98 CB ALA A 8 0.949 -2.227 -4.449 1.00 1.00 C ATOM 0 H ALA A 8 0.042 0.440 -3.768 1.00 1.00 H new ATOM 0 HA ALA A 8 2.654 -0.858 -4.419 1.00 1.00 H new ATOM 0 HB1 ALA A 8 1.393 -2.878 -5.203 1.00 1.00 H new ATOM 0 HB2 ALA A 8 1.135 -2.640 -3.458 1.00 1.00 H new ATOM 0 HB3 ALA A 8 -0.126 -2.158 -4.617 1.00 1.00 H new ATOM 104 N ARG A 9 2.143 -0.513 -6.884 1.00 1.00 N ATOM 105 CA ARG A 9 1.940 0.046 -8.251 1.00 1.00 C ATOM 106 C ARG A 9 1.773 -1.090 -9.263 1.00 1.00 C ATOM 107 O ARG A 9 2.717 -1.774 -9.606 1.00 1.00 O ATOM 108 CB ARG A 9 3.209 0.845 -8.548 1.00 1.00 C ATOM 109 CG ARG A 9 3.793 0.395 -9.889 1.00 1.00 C ATOM 110 CD ARG A 9 3.698 1.542 -10.897 1.00 1.00 C ATOM 111 NE ARG A 9 2.455 2.273 -10.527 1.00 1.00 N ATOM 112 CZ ARG A 9 2.533 3.427 -9.922 1.00 1.00 C ATOM 113 NH1 ARG A 9 3.700 3.946 -9.654 1.00 1.00 N ATOM 114 NH2 ARG A 9 1.443 4.062 -9.586 1.00 1.00 N ATOM 0 H ARG A 9 2.961 -1.114 -6.779 1.00 1.00 H new ATOM 0 HA ARG A 9 1.046 0.666 -8.315 1.00 1.00 H new ATOM 0 HB2 ARG A 9 2.982 1.911 -8.577 1.00 1.00 H new ATOM 0 HB3 ARG A 9 3.940 0.696 -7.753 1.00 1.00 H new ATOM 0 HG2 ARG A 9 4.833 0.093 -9.762 1.00 1.00 H new ATOM 0 HG3 ARG A 9 3.252 -0.475 -10.260 1.00 1.00 H new ATOM 0 HD2 ARG A 9 4.571 2.192 -10.840 1.00 1.00 H new ATOM 0 HD3 ARG A 9 3.647 1.167 -11.919 1.00 1.00 H new ATOM 0 HE ARG A 9 1.543 1.872 -10.746 1.00 1.00 H new ATOM 0 HH11 ARG A 9 4.551 3.450 -9.917 1.00 1.00 H new ATOM 0 HH12 ARG A 9 3.761 4.848 -9.181 1.00 1.00 H new ATOM 0 HH21 ARG A 9 0.531 3.656 -9.796 1.00 1.00 H new ATOM 0 HH22 ARG A 9 1.503 4.964 -9.113 1.00 1.00 H new ATOM 127 N TYR A 10 0.578 -1.298 -9.746 1.00 1.00 N ATOM 128 CA TYR A 10 0.354 -2.391 -10.734 1.00 1.00 C ATOM 129 C TYR A 10 -0.686 -1.963 -11.772 1.00 1.00 C ATOM 130 O TYR A 10 -1.411 -1.007 -11.581 1.00 1.00 O ATOM 131 CB TYR A 10 -0.170 -3.568 -9.909 1.00 1.00 C ATOM 132 CG TYR A 10 0.953 -4.544 -9.649 1.00 1.00 C ATOM 133 CD1 TYR A 10 2.277 -4.177 -9.916 1.00 1.00 C ATOM 134 CD2 TYR A 10 0.668 -5.817 -9.140 1.00 1.00 C ATOM 135 CE1 TYR A 10 3.316 -5.084 -9.674 1.00 1.00 C ATOM 136 CE2 TYR A 10 1.707 -6.723 -8.897 1.00 1.00 C ATOM 137 CZ TYR A 10 3.031 -6.357 -9.164 1.00 1.00 C ATOM 138 OH TYR A 10 4.057 -7.249 -8.926 1.00 1.00 O ATOM 0 H TYR A 10 -0.252 -0.759 -9.499 1.00 1.00 H new ATOM 0 HA TYR A 10 1.263 -2.645 -11.280 1.00 1.00 H new ATOM 0 HB2 TYR A 10 -0.580 -3.209 -8.965 1.00 1.00 H new ATOM 0 HB3 TYR A 10 -0.982 -4.065 -10.440 1.00 1.00 H new ATOM 0 HD1 TYR A 10 2.497 -3.195 -10.308 1.00 1.00 H new ATOM 0 HD2 TYR A 10 -0.354 -6.100 -8.935 1.00 1.00 H new ATOM 0 HE1 TYR A 10 4.338 -4.802 -9.881 1.00 1.00 H new ATOM 0 HE2 TYR A 10 1.487 -7.704 -8.503 1.00 1.00 H new ATOM 0 HH TYR A 10 3.688 -8.085 -8.572 1.00 1.00 H new ATOM 148 N SER A 11 -0.767 -2.667 -12.867 1.00 1.00 N ATOM 149 CA SER A 11 -1.764 -2.306 -13.916 1.00 1.00 C ATOM 150 C SER A 11 -1.563 -0.856 -14.369 1.00 1.00 C ATOM 151 O SER A 11 -2.504 -0.170 -14.714 1.00 1.00 O ATOM 152 CB SER A 11 -3.123 -2.474 -13.238 1.00 1.00 C ATOM 153 OG SER A 11 -3.700 -1.193 -13.018 1.00 1.00 O ATOM 0 H SER A 11 -0.186 -3.477 -13.082 1.00 1.00 H new ATOM 0 HA SER A 11 -1.670 -2.928 -14.806 1.00 1.00 H new ATOM 0 HB2 SER A 11 -3.781 -3.080 -13.861 1.00 1.00 H new ATOM 0 HB3 SER A 11 -3.007 -3.001 -12.291 1.00 1.00 H new ATOM 0 HG SER A 11 -3.877 -0.761 -13.880 1.00 1.00 H new ATOM 159 N GLY A 12 -0.344 -0.388 -14.379 1.00 1.00 N ATOM 160 CA GLY A 12 -0.087 1.014 -14.817 1.00 1.00 C ATOM 161 C GLY A 12 -0.582 1.992 -13.749 1.00 1.00 C ATOM 162 O GLY A 12 -0.344 3.181 -13.827 1.00 1.00 O ATOM 0 H GLY A 12 0.484 -0.915 -14.103 1.00 1.00 H new ATOM 0 HA2 GLY A 12 0.979 1.160 -14.991 1.00 1.00 H new ATOM 0 HA3 GLY A 12 -0.593 1.208 -15.763 1.00 1.00 H new ATOM 166 N VAL A 13 -1.266 1.503 -12.753 1.00 1.00 N ATOM 167 CA VAL A 13 -1.772 2.410 -11.682 1.00 1.00 C ATOM 168 C VAL A 13 -1.438 1.838 -10.303 1.00 1.00 C ATOM 169 O VAL A 13 -1.525 0.646 -10.079 1.00 1.00 O ATOM 170 CB VAL A 13 -3.286 2.462 -11.890 1.00 1.00 C ATOM 171 CG1 VAL A 13 -3.721 3.910 -12.116 1.00 1.00 C ATOM 172 CG2 VAL A 13 -3.660 1.622 -13.114 1.00 1.00 C ATOM 0 H VAL A 13 -1.497 0.517 -12.633 1.00 1.00 H new ATOM 0 HA VAL A 13 -1.320 3.401 -11.732 1.00 1.00 H new ATOM 0 HB VAL A 13 -3.788 2.065 -11.007 1.00 1.00 H new ATOM 0 HG11 VAL A 13 -4.800 3.947 -12.264 1.00 1.00 H new ATOM 0 HG12 VAL A 13 -3.454 4.510 -11.246 1.00 1.00 H new ATOM 0 HG13 VAL A 13 -3.220 4.307 -12.999 1.00 1.00 H new ATOM 0 HG21 VAL A 13 -4.739 1.658 -13.264 1.00 1.00 H new ATOM 0 HG22 VAL A 13 -3.158 2.020 -13.996 1.00 1.00 H new ATOM 0 HG23 VAL A 13 -3.350 0.589 -12.955 1.00 1.00 H new ATOM 182 N ASP A 14 -1.051 2.673 -9.378 1.00 1.00 N ATOM 183 CA ASP A 14 -0.707 2.168 -8.018 1.00 1.00 C ATOM 184 C ASP A 14 -1.976 1.954 -7.190 1.00 1.00 C ATOM 185 O ASP A 14 -3.033 2.458 -7.512 1.00 1.00 O ATOM 186 CB ASP A 14 0.159 3.265 -7.397 1.00 1.00 C ATOM 187 CG ASP A 14 0.064 3.186 -5.872 1.00 1.00 C ATOM 188 OD1 ASP A 14 -1.034 2.995 -5.375 1.00 1.00 O ATOM 189 OD2 ASP A 14 1.091 3.318 -5.226 1.00 1.00 O ATOM 0 H ASP A 14 -0.958 3.681 -9.504 1.00 1.00 H new ATOM 0 HA ASP A 14 -0.190 1.209 -8.055 1.00 1.00 H new ATOM 0 HB2 ASP A 14 1.195 3.149 -7.714 1.00 1.00 H new ATOM 0 HB3 ASP A 14 -0.172 4.244 -7.743 1.00 1.00 H new ATOM 194 N VAL A 15 -1.874 1.205 -6.128 1.00 1.00 N ATOM 195 CA VAL A 15 -3.067 0.947 -5.274 1.00 1.00 C ATOM 196 C VAL A 15 -2.633 0.725 -3.824 1.00 1.00 C ATOM 197 O VAL A 15 -1.460 0.735 -3.509 1.00 1.00 O ATOM 198 CB VAL A 15 -3.696 -0.325 -5.845 1.00 1.00 C ATOM 199 CG1 VAL A 15 -4.411 0.003 -7.157 1.00 1.00 C ATOM 200 CG2 VAL A 15 -2.601 -1.360 -6.108 1.00 1.00 C ATOM 0 H VAL A 15 -1.012 0.759 -5.813 1.00 1.00 H new ATOM 0 HA VAL A 15 -3.767 1.782 -5.275 1.00 1.00 H new ATOM 0 HB VAL A 15 -4.414 -0.727 -5.130 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -4.859 -0.904 -7.564 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -5.191 0.742 -6.972 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -3.693 0.405 -7.872 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -3.048 -2.267 -6.515 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -1.883 -0.957 -6.823 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -2.090 -1.595 -5.174 1.00 1.00 H new ATOM 210 N TYR A 16 -3.568 0.510 -2.940 1.00 1.00 N ATOM 211 CA TYR A 16 -3.207 0.269 -1.515 1.00 1.00 C ATOM 212 C TYR A 16 -3.468 -1.200 -1.173 1.00 1.00 C ATOM 213 O TYR A 16 -4.449 -1.775 -1.595 1.00 1.00 O ATOM 214 CB TYR A 16 -4.131 1.186 -0.710 1.00 1.00 C ATOM 215 CG TYR A 16 -4.132 2.565 -1.326 1.00 1.00 C ATOM 216 CD1 TYR A 16 -3.184 2.897 -2.301 1.00 1.00 C ATOM 217 CD2 TYR A 16 -5.080 3.513 -0.920 1.00 1.00 C ATOM 218 CE1 TYR A 16 -3.185 4.175 -2.872 1.00 1.00 C ATOM 219 CE2 TYR A 16 -5.080 4.791 -1.491 1.00 1.00 C ATOM 220 CZ TYR A 16 -4.132 5.122 -2.467 1.00 1.00 C ATOM 221 OH TYR A 16 -4.132 6.383 -3.029 1.00 1.00 O ATOM 0 H TYR A 16 -4.567 0.491 -3.143 1.00 1.00 H new ATOM 0 HA TYR A 16 -2.158 0.474 -1.301 1.00 1.00 H new ATOM 0 HB2 TYR A 16 -5.143 0.781 -0.698 1.00 1.00 H new ATOM 0 HB3 TYR A 16 -3.796 1.239 0.326 1.00 1.00 H new ATOM 0 HD1 TYR A 16 -2.452 2.167 -2.613 1.00 1.00 H new ATOM 0 HD2 TYR A 16 -5.811 3.258 -0.167 1.00 1.00 H new ATOM 0 HE1 TYR A 16 -2.455 4.430 -3.625 1.00 1.00 H new ATOM 0 HE2 TYR A 16 -5.811 5.522 -1.179 1.00 1.00 H new ATOM 0 HH TYR A 16 -4.855 6.916 -2.637 1.00 1.00 H new ATOM 231 N GLU A 17 -2.599 -1.820 -0.424 1.00 1.00 N ATOM 232 CA GLU A 17 -2.817 -3.255 -0.085 1.00 1.00 C ATOM 233 C GLU A 17 -2.929 -3.447 1.428 1.00 1.00 C ATOM 234 O GLU A 17 -1.990 -3.226 2.166 1.00 1.00 O ATOM 235 CB GLU A 17 -1.585 -3.981 -0.626 1.00 1.00 C ATOM 236 CG GLU A 17 -0.609 -2.964 -1.220 1.00 1.00 C ATOM 237 CD GLU A 17 -0.422 -3.248 -2.712 1.00 1.00 C ATOM 238 OE1 GLU A 17 -1.315 -2.915 -3.473 1.00 1.00 O ATOM 239 OE2 GLU A 17 0.610 -3.793 -3.067 1.00 1.00 O ATOM 0 H GLU A 17 -1.755 -1.400 -0.035 1.00 1.00 H new ATOM 0 HA GLU A 17 -3.743 -3.637 -0.515 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -1.100 -4.541 0.174 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -1.881 -4.703 -1.387 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -0.989 -1.952 -1.076 1.00 1.00 H new ATOM 0 HG3 GLU A 17 0.350 -3.021 -0.705 1.00 1.00 H new ATOM 246 N PHE A 18 -4.073 -3.869 1.889 1.00 1.00 N ATOM 247 CA PHE A 18 -4.257 -4.093 3.352 1.00 1.00 C ATOM 248 C PHE A 18 -4.967 -5.428 3.582 1.00 1.00 C ATOM 249 O PHE A 18 -5.884 -5.783 2.869 1.00 1.00 O ATOM 250 CB PHE A 18 -5.128 -2.931 3.829 1.00 1.00 C ATOM 251 CG PHE A 18 -5.764 -3.292 5.150 1.00 1.00 C ATOM 252 CD1 PHE A 18 -5.018 -3.969 6.123 1.00 1.00 C ATOM 253 CD2 PHE A 18 -7.098 -2.951 5.403 1.00 1.00 C ATOM 254 CE1 PHE A 18 -5.606 -4.306 7.348 1.00 1.00 C ATOM 255 CE2 PHE A 18 -7.687 -3.288 6.628 1.00 1.00 C ATOM 256 CZ PHE A 18 -6.941 -3.965 7.601 1.00 1.00 C ATOM 0 H PHE A 18 -4.892 -4.069 1.315 1.00 1.00 H new ATOM 0 HA PHE A 18 -3.310 -4.132 3.891 1.00 1.00 H new ATOM 0 HB2 PHE A 18 -4.524 -2.030 3.937 1.00 1.00 H new ATOM 0 HB3 PHE A 18 -5.898 -2.712 3.090 1.00 1.00 H new ATOM 0 HD1 PHE A 18 -3.989 -4.231 5.928 1.00 1.00 H new ATOM 0 HD2 PHE A 18 -7.673 -2.428 4.653 1.00 1.00 H new ATOM 0 HE1 PHE A 18 -5.031 -4.829 8.098 1.00 1.00 H new ATOM 0 HE2 PHE A 18 -8.717 -3.026 6.822 1.00 1.00 H new ATOM 0 HZ PHE A 18 -7.395 -4.224 8.546 1.00 1.00 H new ATOM 266 N ILE A 19 -4.555 -6.173 4.571 1.00 1.00 N ATOM 267 CA ILE A 19 -5.213 -7.484 4.838 1.00 1.00 C ATOM 268 C ILE A 19 -6.533 -7.267 5.577 1.00 1.00 C ATOM 269 O ILE A 19 -6.605 -6.523 6.534 1.00 1.00 O ATOM 270 CB ILE A 19 -4.225 -8.253 5.713 1.00 1.00 C ATOM 271 CG1 ILE A 19 -2.842 -8.233 5.056 1.00 1.00 C ATOM 272 CG2 ILE A 19 -4.694 -9.701 5.865 1.00 1.00 C ATOM 273 CD1 ILE A 19 -2.632 -9.530 4.272 1.00 1.00 C ATOM 0 H ILE A 19 -3.793 -5.932 5.205 1.00 1.00 H new ATOM 0 HA ILE A 19 -5.448 -8.025 3.921 1.00 1.00 H new ATOM 0 HB ILE A 19 -4.170 -7.785 6.696 1.00 1.00 H new ATOM 0 HG12 ILE A 19 -2.756 -7.375 4.390 1.00 1.00 H new ATOM 0 HG13 ILE A 19 -2.068 -8.125 5.816 1.00 1.00 H new ATOM 0 HG21 ILE A 19 -3.988 -10.248 6.490 1.00 1.00 H new ATOM 0 HG22 ILE A 19 -5.679 -9.717 6.331 1.00 1.00 H new ATOM 0 HG23 ILE A 19 -4.749 -10.171 4.883 1.00 1.00 H new ATOM 0 HD11 ILE A 19 -1.648 -9.517 3.804 1.00 1.00 H new ATOM 0 HD12 ILE A 19 -2.700 -10.380 4.951 1.00 1.00 H new ATOM 0 HD13 ILE A 19 -3.399 -9.618 3.502 1.00 1.00 H new ATOM 285 N HIS A 20 -7.578 -7.915 5.143 1.00 1.00 N ATOM 286 CA HIS A 20 -8.892 -7.748 5.826 1.00 1.00 C ATOM 287 C HIS A 20 -9.720 -9.027 5.690 1.00 1.00 C ATOM 288 O HIS A 20 -9.207 -10.124 5.785 1.00 1.00 O ATOM 289 CB HIS A 20 -9.572 -6.585 5.104 1.00 1.00 C ATOM 290 CG HIS A 20 -10.113 -5.617 6.119 1.00 1.00 C ATOM 291 ND1 HIS A 20 -10.423 -4.305 5.798 1.00 1.00 N ATOM 292 CD2 HIS A 20 -10.401 -5.755 7.454 1.00 1.00 C ATOM 293 CE1 HIS A 20 -10.876 -3.710 6.918 1.00 1.00 C ATOM 294 NE2 HIS A 20 -10.883 -4.550 7.956 1.00 1.00 N ATOM 0 H HIS A 20 -7.580 -8.552 4.346 1.00 1.00 H new ATOM 0 HA HIS A 20 -8.783 -7.552 6.893 1.00 1.00 H new ATOM 0 HB2 HIS A 20 -8.860 -6.083 4.449 1.00 1.00 H new ATOM 0 HB3 HIS A 20 -10.379 -6.956 4.472 1.00 1.00 H new ATOM 0 HD1 HIS A 20 -10.326 -3.869 4.881 1.00 1.00 H new ATOM 0 HD2 HIS A 20 -10.273 -6.661 8.028 1.00 1.00 H new ATOM 0 HE1 HIS A 20 -11.195 -2.679 6.970 1.00 1.00 H new ATOM 302 N SER A 21 -10.997 -8.896 5.455 1.00 1.00 N ATOM 303 CA SER A 21 -11.851 -10.108 5.304 1.00 1.00 C ATOM 304 C SER A 21 -11.407 -10.901 4.073 1.00 1.00 C ATOM 305 O SER A 21 -11.367 -12.116 4.085 1.00 1.00 O ATOM 306 CB SER A 21 -13.270 -9.574 5.117 1.00 1.00 C ATOM 307 OG SER A 21 -13.857 -9.347 6.391 1.00 1.00 O ATOM 0 H SER A 21 -11.485 -8.005 5.361 1.00 1.00 H new ATOM 0 HA SER A 21 -11.783 -10.777 6.161 1.00 1.00 H new ATOM 0 HB2 SER A 21 -13.250 -8.648 4.543 1.00 1.00 H new ATOM 0 HB3 SER A 21 -13.868 -10.288 4.550 1.00 1.00 H new ATOM 0 HG SER A 21 -13.732 -8.409 6.646 1.00 1.00 H new ATOM 313 N THR A 22 -11.059 -10.220 3.016 1.00 1.00 N ATOM 314 CA THR A 22 -10.602 -10.927 1.788 1.00 1.00 C ATOM 315 C THR A 22 -9.077 -10.998 1.779 1.00 1.00 C ATOM 316 O THR A 22 -8.462 -11.313 0.780 1.00 1.00 O ATOM 317 CB THR A 22 -11.112 -10.075 0.625 1.00 1.00 C ATOM 318 OG1 THR A 22 -11.454 -10.921 -0.465 1.00 1.00 O ATOM 319 CG2 THR A 22 -10.022 -9.096 0.190 1.00 1.00 C ATOM 0 H THR A 22 -11.072 -9.202 2.950 1.00 1.00 H new ATOM 0 HA THR A 22 -10.974 -11.950 1.727 1.00 1.00 H new ATOM 0 HB THR A 22 -11.992 -9.516 0.943 1.00 1.00 H new ATOM 0 HG1 THR A 22 -11.783 -10.377 -1.211 1.00 1.00 H new ATOM 0 HG21 THR A 22 -10.387 -8.490 -0.639 1.00 1.00 H new ATOM 0 HG22 THR A 22 -9.760 -8.448 1.026 1.00 1.00 H new ATOM 0 HG23 THR A 22 -9.140 -9.652 -0.128 1.00 1.00 H new ATOM 327 N GLY A 23 -8.461 -10.690 2.888 1.00 1.00 N ATOM 328 CA GLY A 23 -6.975 -10.722 2.947 1.00 1.00 C ATOM 329 C GLY A 23 -6.435 -9.328 2.629 1.00 1.00 C ATOM 330 O GLY A 23 -6.712 -8.373 3.326 1.00 1.00 O ATOM 0 H GLY A 23 -8.924 -10.418 3.755 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -6.644 -11.037 3.937 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.585 -11.449 2.234 1.00 1.00 H new ATOM 334 N SER A 24 -5.671 -9.201 1.580 1.00 1.00 N ATOM 335 CA SER A 24 -5.116 -7.865 1.217 1.00 1.00 C ATOM 336 C SER A 24 -6.109 -7.096 0.343 1.00 1.00 C ATOM 337 O SER A 24 -6.768 -7.660 -0.508 1.00 1.00 O ATOM 338 CB SER A 24 -3.836 -8.166 0.438 1.00 1.00 C ATOM 339 OG SER A 24 -3.168 -6.946 0.142 1.00 1.00 O ATOM 0 H SER A 24 -5.406 -9.964 0.957 1.00 1.00 H new ATOM 0 HA SER A 24 -4.924 -7.247 2.094 1.00 1.00 H new ATOM 0 HB2 SER A 24 -3.186 -8.817 1.022 1.00 1.00 H new ATOM 0 HB3 SER A 24 -4.074 -8.697 -0.484 1.00 1.00 H new ATOM 0 HG SER A 24 -2.346 -7.136 -0.356 1.00 1.00 H new ATOM 345 N ILE A 25 -6.219 -5.813 0.547 1.00 1.00 N ATOM 346 CA ILE A 25 -7.166 -5.005 -0.272 1.00 1.00 C ATOM 347 C ILE A 25 -6.391 -3.997 -1.124 1.00 1.00 C ATOM 348 O ILE A 25 -5.608 -3.216 -0.620 1.00 1.00 O ATOM 349 CB ILE A 25 -8.050 -4.279 0.744 1.00 1.00 C ATOM 350 CG1 ILE A 25 -9.143 -5.229 1.239 1.00 1.00 C ATOM 351 CG2 ILE A 25 -8.696 -3.063 0.079 1.00 1.00 C ATOM 352 CD1 ILE A 25 -8.703 -6.677 1.016 1.00 1.00 C ATOM 0 H ILE A 25 -5.694 -5.288 1.246 1.00 1.00 H new ATOM 0 HA ILE A 25 -7.753 -5.619 -0.955 1.00 1.00 H new ATOM 0 HB ILE A 25 -7.442 -3.953 1.588 1.00 1.00 H new ATOM 0 HG12 ILE A 25 -9.337 -5.056 2.298 1.00 1.00 H new ATOM 0 HG13 ILE A 25 -10.075 -5.036 0.708 1.00 1.00 H new ATOM 0 HG21 ILE A 25 -9.326 -2.545 0.802 1.00 1.00 H new ATOM 0 HG22 ILE A 25 -7.919 -2.386 -0.275 1.00 1.00 H new ATOM 0 HG23 ILE A 25 -9.305 -3.390 -0.764 1.00 1.00 H new ATOM 0 HD11 ILE A 25 -9.482 -7.353 1.369 1.00 1.00 H new ATOM 0 HD12 ILE A 25 -8.531 -6.845 -0.047 1.00 1.00 H new ATOM 0 HD13 ILE A 25 -7.782 -6.866 1.567 1.00 1.00 H new ATOM 364 N MET A 26 -6.600 -4.010 -2.413 1.00 1.00 N ATOM 365 CA MET A 26 -5.871 -3.052 -3.293 1.00 1.00 C ATOM 366 C MET A 26 -6.859 -2.131 -4.015 1.00 1.00 C ATOM 367 O MET A 26 -7.778 -2.579 -4.672 1.00 1.00 O ATOM 368 CB MET A 26 -5.125 -3.928 -4.300 1.00 1.00 C ATOM 369 CG MET A 26 -3.618 -3.811 -4.060 1.00 1.00 C ATOM 370 SD MET A 26 -2.772 -3.570 -5.642 1.00 1.00 S ATOM 371 CE MET A 26 -4.066 -4.260 -6.702 1.00 1.00 C ATOM 0 H MET A 26 -7.242 -4.640 -2.893 1.00 1.00 H new ATOM 0 HA MET A 26 -5.195 -2.410 -2.728 1.00 1.00 H new ATOM 0 HB2 MET A 26 -5.441 -4.966 -4.199 1.00 1.00 H new ATOM 0 HB3 MET A 26 -5.367 -3.619 -5.317 1.00 1.00 H new ATOM 0 HG2 MET A 26 -3.409 -2.975 -3.393 1.00 1.00 H new ATOM 0 HG3 MET A 26 -3.246 -4.711 -3.570 1.00 1.00 H new ATOM 0 HE1 MET A 26 -3.672 -4.408 -7.707 1.00 1.00 H new ATOM 0 HE2 MET A 26 -4.397 -5.216 -6.297 1.00 1.00 H new ATOM 0 HE3 MET A 26 -4.910 -3.571 -6.741 1.00 1.00 H new ATOM 381 N LYS A 27 -6.675 -0.843 -3.897 1.00 1.00 N ATOM 382 CA LYS A 27 -7.602 0.109 -4.576 1.00 1.00 C ATOM 383 C LYS A 27 -6.913 0.749 -5.784 1.00 1.00 C ATOM 384 O LYS A 27 -5.713 0.662 -5.943 1.00 1.00 O ATOM 385 CB LYS A 27 -7.926 1.166 -3.519 1.00 1.00 C ATOM 386 CG LYS A 27 -6.755 1.291 -2.542 1.00 1.00 C ATOM 387 CD LYS A 27 -7.239 1.941 -1.245 1.00 1.00 C ATOM 388 CE LYS A 27 -8.373 1.105 -0.646 1.00 1.00 C ATOM 389 NZ LYS A 27 -9.086 2.031 0.277 1.00 1.00 N ATOM 0 H LYS A 27 -5.924 -0.409 -3.360 1.00 1.00 H new ATOM 0 HA LYS A 27 -8.500 -0.383 -4.949 1.00 1.00 H new ATOM 0 HB2 LYS A 27 -8.118 2.126 -3.997 1.00 1.00 H new ATOM 0 HB3 LYS A 27 -8.833 0.891 -2.981 1.00 1.00 H new ATOM 0 HG2 LYS A 27 -6.335 0.307 -2.333 1.00 1.00 H new ATOM 0 HG3 LYS A 27 -5.959 1.889 -2.986 1.00 1.00 H new ATOM 0 HD2 LYS A 27 -6.415 2.018 -0.535 1.00 1.00 H new ATOM 0 HD3 LYS A 27 -7.586 2.955 -1.442 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -9.040 0.730 -1.422 1.00 1.00 H new ATOM 0 HE3 LYS A 27 -7.985 0.237 -0.113 1.00 1.00 H new ATOM 0 HZ1 LYS A 27 -9.879 1.530 0.727 1.00 1.00 H new ATOM 0 HZ2 LYS A 27 -8.428 2.366 1.009 1.00 1.00 H new ATOM 0 HZ3 LYS A 27 -9.450 2.844 -0.260 1.00 1.00 H new ATOM 402 N ARG A 28 -7.665 1.393 -6.636 1.00 1.00 N ATOM 403 CA ARG A 28 -7.050 2.038 -7.833 1.00 1.00 C ATOM 404 C ARG A 28 -6.476 3.406 -7.457 1.00 1.00 C ATOM 405 O ARG A 28 -7.144 4.231 -6.865 1.00 1.00 O ATOM 406 CB ARG A 28 -8.194 2.191 -8.835 1.00 1.00 C ATOM 407 CG ARG A 28 -7.958 1.260 -10.026 1.00 1.00 C ATOM 408 CD ARG A 28 -6.489 1.327 -10.445 1.00 1.00 C ATOM 409 NE ARG A 28 -6.278 0.126 -11.301 1.00 1.00 N ATOM 410 CZ ARG A 28 -6.929 0.003 -12.426 1.00 1.00 C ATOM 411 NH1 ARG A 28 -7.764 0.933 -12.801 1.00 1.00 N ATOM 412 NH2 ARG A 28 -6.744 -1.049 -13.175 1.00 1.00 N ATOM 0 H ARG A 28 -8.676 1.500 -6.556 1.00 1.00 H new ATOM 0 HA ARG A 28 -6.229 1.451 -8.243 1.00 1.00 H new ATOM 0 HB2 ARG A 28 -9.144 1.953 -8.357 1.00 1.00 H new ATOM 0 HB3 ARG A 28 -8.258 3.225 -9.175 1.00 1.00 H new ATOM 0 HG2 ARG A 28 -8.225 0.237 -9.760 1.00 1.00 H new ATOM 0 HG3 ARG A 28 -8.598 1.549 -10.859 1.00 1.00 H new ATOM 0 HD2 ARG A 28 -6.276 2.245 -10.993 1.00 1.00 H new ATOM 0 HD3 ARG A 28 -5.830 1.314 -9.577 1.00 1.00 H new ATOM 0 HE ARG A 28 -5.625 -0.600 -11.008 1.00 1.00 H new ATOM 0 HH11 ARG A 28 -7.908 1.756 -12.215 1.00 1.00 H new ATOM 0 HH12 ARG A 28 -8.273 0.837 -13.680 1.00 1.00 H new ATOM 0 HH21 ARG A 28 -6.091 -1.775 -12.882 1.00 1.00 H new ATOM 0 HH22 ARG A 28 -7.253 -1.145 -14.054 1.00 1.00 H new ATOM 425 N LYS A 29 -5.240 3.654 -7.795 1.00 1.00 N ATOM 426 CA LYS A 29 -4.620 4.967 -7.457 1.00 1.00 C ATOM 427 C LYS A 29 -5.280 6.092 -8.260 1.00 1.00 C ATOM 428 O LYS A 29 -5.601 7.138 -7.733 1.00 1.00 O ATOM 429 CB LYS A 29 -3.150 4.820 -7.851 1.00 1.00 C ATOM 430 CG LYS A 29 -2.773 5.920 -8.844 1.00 1.00 C ATOM 431 CD LYS A 29 -1.252 6.090 -8.867 1.00 1.00 C ATOM 432 CE LYS A 29 -0.781 6.291 -10.308 1.00 1.00 C ATOM 433 NZ LYS A 29 -2.025 6.535 -11.088 1.00 1.00 N ATOM 0 H LYS A 29 -4.632 3.003 -8.291 1.00 1.00 H new ATOM 0 HA LYS A 29 -4.740 5.220 -6.404 1.00 1.00 H new ATOM 0 HB2 LYS A 29 -2.518 4.883 -6.965 1.00 1.00 H new ATOM 0 HB3 LYS A 29 -2.979 3.840 -8.296 1.00 1.00 H new ATOM 0 HG2 LYS A 29 -3.136 5.665 -9.840 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -3.250 6.858 -8.561 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -0.962 6.945 -8.256 1.00 1.00 H new ATOM 0 HD3 LYS A 29 -0.771 5.212 -8.435 1.00 1.00 H new ATOM 0 HE2 LYS A 29 -0.095 7.134 -10.385 1.00 1.00 H new ATOM 0 HE3 LYS A 29 -0.250 5.413 -10.676 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 -1.785 6.991 -11.991 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 -2.502 5.629 -11.273 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 -2.659 7.155 -10.545 1.00 1.00 H new ATOM 446 N LYS A 30 -5.480 5.885 -9.533 1.00 1.00 N ATOM 447 CA LYS A 30 -6.116 6.943 -10.371 1.00 1.00 C ATOM 448 C LYS A 30 -7.327 7.540 -9.651 1.00 1.00 C ATOM 449 O LYS A 30 -7.421 8.738 -9.463 1.00 1.00 O ATOM 450 CB LYS A 30 -6.552 6.226 -11.649 1.00 1.00 C ATOM 451 CG LYS A 30 -7.018 4.809 -11.307 1.00 1.00 C ATOM 452 CD LYS A 30 -7.789 4.224 -12.492 1.00 1.00 C ATOM 453 CE LYS A 30 -6.971 3.098 -13.127 1.00 1.00 C ATOM 454 NZ LYS A 30 -7.937 2.356 -13.984 1.00 1.00 N ATOM 0 H LYS A 30 -5.231 5.030 -10.030 1.00 1.00 H new ATOM 0 HA LYS A 30 -5.435 7.769 -10.577 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -7.358 6.779 -12.131 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -5.724 6.187 -12.357 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -6.160 4.180 -11.072 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -7.652 4.828 -10.421 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -8.755 3.843 -12.159 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -7.990 5.002 -13.229 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -6.144 3.495 -13.716 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -6.538 2.448 -12.367 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -7.462 1.537 -14.414 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -8.735 2.028 -13.404 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -8.290 2.984 -14.734 1.00 1.00 H new ATOM 467 N ASP A 31 -8.257 6.719 -9.248 1.00 1.00 N ATOM 468 CA ASP A 31 -9.461 7.244 -8.543 1.00 1.00 C ATOM 469 C ASP A 31 -9.506 6.717 -7.106 1.00 1.00 C ATOM 470 O ASP A 31 -10.484 6.882 -6.405 1.00 1.00 O ATOM 471 CB ASP A 31 -10.652 6.721 -9.347 1.00 1.00 C ATOM 472 CG ASP A 31 -11.518 7.898 -9.799 1.00 1.00 C ATOM 473 OD1 ASP A 31 -11.508 8.912 -9.120 1.00 1.00 O ATOM 474 OD2 ASP A 31 -12.179 7.765 -10.817 1.00 1.00 O ATOM 0 H ASP A 31 -8.236 5.707 -9.376 1.00 1.00 H new ATOM 0 HA ASP A 31 -9.460 8.332 -8.480 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -10.301 6.160 -10.213 1.00 1.00 H new ATOM 0 HB3 ASP A 31 -11.241 6.034 -8.739 1.00 1.00 H new ATOM 479 N ASP A 32 -8.454 6.084 -6.664 1.00 1.00 N ATOM 480 CA ASP A 32 -8.437 5.548 -5.272 1.00 1.00 C ATOM 481 C ASP A 32 -9.639 4.627 -5.044 1.00 1.00 C ATOM 482 O ASP A 32 -10.347 4.747 -4.064 1.00 1.00 O ATOM 483 CB ASP A 32 -8.526 6.781 -4.373 1.00 1.00 C ATOM 484 CG ASP A 32 -9.948 7.343 -4.416 1.00 1.00 C ATOM 485 OD1 ASP A 32 -10.853 6.588 -4.729 1.00 1.00 O ATOM 486 OD2 ASP A 32 -10.108 8.520 -4.136 1.00 1.00 O ATOM 0 H ASP A 32 -7.606 5.915 -7.205 1.00 1.00 H new ATOM 0 HA ASP A 32 -7.544 4.958 -5.067 1.00 1.00 H new ATOM 0 HB2 ASP A 32 -8.258 6.518 -3.350 1.00 1.00 H new ATOM 0 HB3 ASP A 32 -7.815 7.538 -4.704 1.00 1.00 H new ATOM 491 N TRP A 33 -9.871 3.708 -5.940 1.00 1.00 N ATOM 492 CA TRP A 33 -11.024 2.779 -5.773 1.00 1.00 C ATOM 493 C TRP A 33 -10.676 1.686 -4.759 1.00 1.00 C ATOM 494 O TRP A 33 -9.520 1.422 -4.492 1.00 1.00 O ATOM 495 CB TRP A 33 -11.249 2.175 -7.159 1.00 1.00 C ATOM 496 CG TRP A 33 -11.037 3.229 -8.199 1.00 1.00 C ATOM 497 CD1 TRP A 33 -9.844 3.786 -8.507 1.00 1.00 C ATOM 498 CD2 TRP A 33 -12.021 3.862 -9.066 1.00 1.00 C ATOM 499 NE1 TRP A 33 -10.033 4.718 -9.511 1.00 1.00 N ATOM 500 CE2 TRP A 33 -11.358 4.802 -9.889 1.00 1.00 C ATOM 501 CE3 TRP A 33 -13.411 3.711 -9.217 1.00 1.00 C ATOM 502 CZ2 TRP A 33 -12.049 5.567 -10.830 1.00 1.00 C ATOM 503 CZ3 TRP A 33 -14.111 4.480 -10.162 1.00 1.00 C ATOM 504 CH2 TRP A 33 -13.430 5.406 -10.967 1.00 1.00 C ATOM 0 H TRP A 33 -9.312 3.560 -6.780 1.00 1.00 H new ATOM 0 HA TRP A 33 -11.915 3.286 -5.401 1.00 1.00 H new ATOM 0 HB2 TRP A 33 -10.562 1.344 -7.322 1.00 1.00 H new ATOM 0 HB3 TRP A 33 -12.259 1.773 -7.233 1.00 1.00 H new ATOM 0 HD1 TRP A 33 -8.899 3.543 -8.045 1.00 1.00 H new ATOM 0 HE1 TRP A 33 -9.284 5.276 -9.922 1.00 1.00 H new ATOM 0 HE3 TRP A 33 -13.944 3.000 -8.603 1.00 1.00 H new ATOM 0 HZ2 TRP A 33 -11.520 6.278 -11.447 1.00 1.00 H new ATOM 0 HZ3 TRP A 33 -15.179 4.358 -10.269 1.00 1.00 H new ATOM 0 HH2 TRP A 33 -13.973 5.994 -11.692 1.00 1.00 H new ATOM 515 N VAL A 34 -11.663 1.051 -4.188 1.00 1.00 N ATOM 516 CA VAL A 34 -11.381 -0.021 -3.191 1.00 1.00 C ATOM 517 C VAL A 34 -12.176 -1.284 -3.533 1.00 1.00 C ATOM 518 O VAL A 34 -13.267 -1.218 -4.064 1.00 1.00 O ATOM 519 CB VAL A 34 -11.842 0.555 -1.852 1.00 1.00 C ATOM 520 CG1 VAL A 34 -13.302 0.996 -1.963 1.00 1.00 C ATOM 521 CG2 VAL A 34 -11.716 -0.517 -0.768 1.00 1.00 C ATOM 0 H VAL A 34 -12.651 1.228 -4.368 1.00 1.00 H new ATOM 0 HA VAL A 34 -10.328 -0.303 -3.174 1.00 1.00 H new ATOM 0 HB VAL A 34 -11.222 1.413 -1.591 1.00 1.00 H new ATOM 0 HG11 VAL A 34 -13.632 1.407 -1.009 1.00 1.00 H new ATOM 0 HG12 VAL A 34 -13.394 1.758 -2.737 1.00 1.00 H new ATOM 0 HG13 VAL A 34 -13.922 0.138 -2.222 1.00 1.00 H new ATOM 0 HG21 VAL A 34 -12.044 -0.108 0.188 1.00 1.00 H new ATOM 0 HG22 VAL A 34 -12.338 -1.373 -1.029 1.00 1.00 H new ATOM 0 HG23 VAL A 34 -10.676 -0.834 -0.689 1.00 1.00 H new ATOM 531 N ASN A 35 -11.637 -2.433 -3.232 1.00 1.00 N ATOM 532 CA ASN A 35 -12.362 -3.700 -3.540 1.00 1.00 C ATOM 533 C ASN A 35 -13.671 -3.767 -2.747 1.00 1.00 C ATOM 534 O ASN A 35 -13.684 -4.112 -1.582 1.00 1.00 O ATOM 535 CB ASN A 35 -11.416 -4.816 -3.101 1.00 1.00 C ATOM 536 CG ASN A 35 -12.208 -5.893 -2.357 1.00 1.00 C ATOM 537 OD1 ASN A 35 -13.412 -5.792 -2.223 1.00 1.00 O ATOM 538 ND2 ASN A 35 -11.581 -6.925 -1.865 1.00 1.00 N ATOM 0 H ASN A 35 -10.727 -2.550 -2.787 1.00 1.00 H new ATOM 0 HA ASN A 35 -12.624 -3.778 -4.595 1.00 1.00 H new ATOM 0 HB2 ASN A 35 -10.920 -5.249 -3.969 1.00 1.00 H new ATOM 0 HB3 ASN A 35 -10.635 -4.413 -2.456 1.00 1.00 H new ATOM 0 HD21 ASN A 35 -12.101 -7.648 -1.367 1.00 1.00 H new ATOM 0 HD22 ASN A 35 -10.571 -7.009 -1.978 1.00 1.00 H new ATOM 545 N ALA A 36 -14.770 -3.438 -3.367 1.00 1.00 N ATOM 546 CA ALA A 36 -16.075 -3.483 -2.646 1.00 1.00 C ATOM 547 C ALA A 36 -16.173 -4.753 -1.793 1.00 1.00 C ATOM 548 O ALA A 36 -16.898 -4.800 -0.820 1.00 1.00 O ATOM 549 CB ALA A 36 -17.136 -3.493 -3.746 1.00 1.00 C ATOM 0 H ALA A 36 -14.822 -3.140 -4.341 1.00 1.00 H new ATOM 0 HA ALA A 36 -16.197 -2.639 -1.968 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -18.128 -3.526 -3.295 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -17.042 -2.591 -4.350 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -16.996 -4.370 -4.378 1.00 1.00 H new ATOM 555 N THR A 37 -15.443 -5.780 -2.141 1.00 1.00 N ATOM 556 CA THR A 37 -15.501 -7.034 -1.334 1.00 1.00 C ATOM 557 C THR A 37 -14.996 -6.754 0.082 1.00 1.00 C ATOM 558 O THR A 37 -15.656 -7.049 1.058 1.00 1.00 O ATOM 559 CB THR A 37 -14.576 -8.021 -2.046 1.00 1.00 C ATOM 560 OG1 THR A 37 -14.988 -8.165 -3.398 1.00 1.00 O ATOM 561 CG2 THR A 37 -14.643 -9.377 -1.342 1.00 1.00 C ATOM 0 H THR A 37 -14.813 -5.805 -2.943 1.00 1.00 H new ATOM 0 HA THR A 37 -16.514 -7.427 -1.250 1.00 1.00 H new ATOM 0 HB THR A 37 -13.552 -7.648 -2.018 1.00 1.00 H new ATOM 0 HG1 THR A 37 -14.394 -8.796 -3.855 1.00 1.00 H new ATOM 0 HG21 THR A 37 -13.984 -10.083 -1.848 1.00 1.00 H new ATOM 0 HG22 THR A 37 -14.327 -9.265 -0.305 1.00 1.00 H new ATOM 0 HG23 THR A 37 -15.666 -9.752 -1.370 1.00 1.00 H new ATOM 569 N HIS A 38 -13.837 -6.169 0.197 1.00 1.00 N ATOM 570 CA HIS A 38 -13.301 -5.850 1.548 1.00 1.00 C ATOM 571 C HIS A 38 -14.301 -4.954 2.279 1.00 1.00 C ATOM 572 O HIS A 38 -14.400 -4.963 3.489 1.00 1.00 O ATOM 573 CB HIS A 38 -11.988 -5.109 1.293 1.00 1.00 C ATOM 574 CG HIS A 38 -11.631 -4.286 2.500 1.00 1.00 C ATOM 575 ND1 HIS A 38 -10.727 -3.239 2.439 1.00 1.00 N ATOM 576 CD2 HIS A 38 -12.050 -4.345 3.806 1.00 1.00 C ATOM 577 CE1 HIS A 38 -10.631 -2.714 3.674 1.00 1.00 C ATOM 578 NE2 HIS A 38 -11.416 -3.350 4.545 1.00 1.00 N ATOM 0 H HIS A 38 -13.239 -5.899 -0.584 1.00 1.00 H new ATOM 0 HA HIS A 38 -13.140 -6.735 2.164 1.00 1.00 H new ATOM 0 HB2 HIS A 38 -11.192 -5.822 1.078 1.00 1.00 H new ATOM 0 HB3 HIS A 38 -12.085 -4.466 0.418 1.00 1.00 H new ATOM 0 HD1 HIS A 38 -10.225 -2.923 1.609 1.00 1.00 H new ATOM 0 HD2 HIS A 38 -12.762 -5.055 4.200 1.00 1.00 H new ATOM 0 HE1 HIS A 38 -9.995 -1.879 3.929 1.00 1.00 H new ATOM 586 N ILE A 39 -15.053 -4.189 1.535 1.00 1.00 N ATOM 587 CA ILE A 39 -16.068 -3.293 2.154 1.00 1.00 C ATOM 588 C ILE A 39 -17.402 -4.034 2.268 1.00 1.00 C ATOM 589 O ILE A 39 -18.041 -4.038 3.302 1.00 1.00 O ATOM 590 CB ILE A 39 -16.192 -2.118 1.186 1.00 1.00 C ATOM 591 CG1 ILE A 39 -15.191 -1.028 1.574 1.00 1.00 C ATOM 592 CG2 ILE A 39 -17.611 -1.552 1.240 1.00 1.00 C ATOM 593 CD1 ILE A 39 -14.037 -1.021 0.572 1.00 1.00 C ATOM 0 H ILE A 39 -15.006 -4.147 0.517 1.00 1.00 H new ATOM 0 HA ILE A 39 -15.789 -2.967 3.156 1.00 1.00 H new ATOM 0 HB ILE A 39 -15.980 -2.462 0.174 1.00 1.00 H new ATOM 0 HG12 ILE A 39 -15.682 -0.055 1.587 1.00 1.00 H new ATOM 0 HG13 ILE A 39 -14.813 -1.207 2.580 1.00 1.00 H new ATOM 0 HG21 ILE A 39 -17.695 -0.714 0.548 1.00 1.00 H new ATOM 0 HG22 ILE A 39 -18.323 -2.328 0.959 1.00 1.00 H new ATOM 0 HG23 ILE A 39 -17.828 -1.210 2.252 1.00 1.00 H new ATOM 0 HD11 ILE A 39 -13.322 -0.245 0.846 1.00 1.00 H new ATOM 0 HD12 ILE A 39 -13.541 -1.991 0.582 1.00 1.00 H new ATOM 0 HD13 ILE A 39 -14.424 -0.821 -0.427 1.00 1.00 H new ATOM 605 N LEU A 40 -17.819 -4.669 1.205 1.00 1.00 N ATOM 606 CA LEU A 40 -19.104 -5.423 1.237 1.00 1.00 C ATOM 607 C LEU A 40 -18.848 -6.872 1.658 1.00 1.00 C ATOM 608 O LEU A 40 -19.485 -7.392 2.553 1.00 1.00 O ATOM 609 CB LEU A 40 -19.633 -5.365 -0.197 1.00 1.00 C ATOM 610 CG LEU A 40 -20.161 -3.960 -0.489 1.00 1.00 C ATOM 611 CD1 LEU A 40 -20.089 -3.113 0.783 1.00 1.00 C ATOM 612 CD2 LEU A 40 -19.306 -3.313 -1.581 1.00 1.00 C ATOM 0 H LEU A 40 -17.323 -4.697 0.314 1.00 1.00 H new ATOM 0 HA LEU A 40 -19.815 -5.004 1.949 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -18.839 -5.620 -0.899 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -20.427 -6.099 -0.333 1.00 1.00 H new ATOM 0 HG LEU A 40 -21.196 -4.023 -0.825 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -20.465 -2.111 0.575 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -20.696 -3.574 1.562 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -19.054 -3.049 1.120 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -19.681 -2.311 -1.791 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -18.271 -3.250 -1.244 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -19.356 -3.916 -2.487 1.00 1.00 H new ATOM 624 N LYS A 41 -17.909 -7.524 1.026 1.00 1.00 N ATOM 625 CA LYS A 41 -17.603 -8.936 1.396 1.00 1.00 C ATOM 626 C LYS A 41 -17.019 -8.984 2.808 1.00 1.00 C ATOM 627 O LYS A 41 -17.109 -9.980 3.498 1.00 1.00 O ATOM 628 CB LYS A 41 -16.572 -9.404 0.369 1.00 1.00 C ATOM 629 CG LYS A 41 -15.614 -10.401 1.023 1.00 1.00 C ATOM 630 CD LYS A 41 -16.417 -11.527 1.679 1.00 1.00 C ATOM 631 CE LYS A 41 -15.648 -12.845 1.551 1.00 1.00 C ATOM 632 NZ LYS A 41 -14.436 -12.665 2.398 1.00 1.00 N ATOM 0 H LYS A 41 -17.341 -7.140 0.270 1.00 1.00 H new ATOM 0 HA LYS A 41 -18.489 -9.570 1.392 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -17.074 -9.869 -0.479 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -16.016 -8.550 -0.018 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -14.935 -10.812 0.276 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -15.000 -9.896 1.769 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -16.594 -11.297 2.730 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -17.394 -11.616 1.204 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -16.248 -13.688 1.894 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -15.379 -13.046 0.514 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -14.011 -13.593 2.598 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -13.747 -12.070 1.896 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -14.703 -12.206 3.292 1.00 1.00 H new ATOM 645 N ALA A 42 -16.427 -7.906 3.243 1.00 1.00 N ATOM 646 CA ALA A 42 -15.844 -7.880 4.613 1.00 1.00 C ATOM 647 C ALA A 42 -16.960 -8.012 5.650 1.00 1.00 C ATOM 648 O ALA A 42 -16.746 -8.469 6.756 1.00 1.00 O ATOM 649 CB ALA A 42 -15.161 -6.516 4.729 1.00 1.00 C ATOM 0 H ALA A 42 -16.322 -7.043 2.709 1.00 1.00 H new ATOM 0 HA ALA A 42 -15.144 -8.697 4.785 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -14.706 -6.420 5.715 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -14.390 -6.429 3.963 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -15.900 -5.726 4.592 1.00 1.00 H new ATOM 655 N ALA A 43 -18.153 -7.612 5.299 1.00 1.00 N ATOM 656 CA ALA A 43 -19.284 -7.711 6.264 1.00 1.00 C ATOM 657 C ALA A 43 -20.368 -8.649 5.724 1.00 1.00 C ATOM 658 O ALA A 43 -21.430 -8.778 6.300 1.00 1.00 O ATOM 659 CB ALA A 43 -19.824 -6.286 6.387 1.00 1.00 C ATOM 0 H ALA A 43 -18.392 -7.222 4.387 1.00 1.00 H new ATOM 0 HA ALA A 43 -18.968 -8.115 7.226 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -20.663 -6.274 7.083 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -19.036 -5.629 6.756 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -20.158 -5.938 5.410 1.00 1.00 H new ATOM 665 N ASN A 44 -20.115 -9.305 4.623 1.00 1.00 N ATOM 666 CA ASN A 44 -21.142 -10.228 4.058 1.00 1.00 C ATOM 667 C ASN A 44 -20.498 -11.545 3.615 1.00 1.00 C ATOM 668 O ASN A 44 -21.054 -12.609 3.799 1.00 1.00 O ATOM 669 CB ASN A 44 -21.722 -9.485 2.855 1.00 1.00 C ATOM 670 CG ASN A 44 -20.697 -9.471 1.720 1.00 1.00 C ATOM 671 OD1 ASN A 44 -20.009 -10.448 1.496 1.00 1.00 O ATOM 672 ND2 ASN A 44 -20.563 -8.399 0.990 1.00 1.00 N ATOM 0 H ASN A 44 -19.246 -9.242 4.093 1.00 1.00 H new ATOM 0 HA ASN A 44 -21.907 -10.485 4.790 1.00 1.00 H new ATOM 0 HB2 ASN A 44 -22.641 -9.969 2.524 1.00 1.00 H new ATOM 0 HB3 ASN A 44 -21.983 -8.465 3.136 1.00 1.00 H new ATOM 0 HD21 ASN A 44 -19.881 -8.380 0.232 1.00 1.00 H new ATOM 0 HD22 ASN A 44 -21.140 -7.579 1.177 1.00 1.00 H new ATOM 679 N PHE A 45 -19.336 -11.482 3.027 1.00 1.00 N ATOM 680 CA PHE A 45 -18.665 -12.735 2.569 1.00 1.00 C ATOM 681 C PHE A 45 -18.977 -12.977 1.090 1.00 1.00 C ATOM 682 O PHE A 45 -19.978 -12.520 0.575 1.00 1.00 O ATOM 683 CB PHE A 45 -19.265 -13.843 3.434 1.00 1.00 C ATOM 684 CG PHE A 45 -18.391 -15.071 3.357 1.00 1.00 C ATOM 685 CD1 PHE A 45 -18.536 -15.969 2.292 1.00 1.00 C ATOM 686 CD2 PHE A 45 -17.435 -15.314 4.351 1.00 1.00 C ATOM 687 CE1 PHE A 45 -17.726 -17.108 2.221 1.00 1.00 C ATOM 688 CE2 PHE A 45 -16.625 -16.453 4.279 1.00 1.00 C ATOM 689 CZ PHE A 45 -16.770 -17.351 3.214 1.00 1.00 C ATOM 0 H PHE A 45 -18.821 -10.621 2.843 1.00 1.00 H new ATOM 0 HA PHE A 45 -17.580 -12.689 2.666 1.00 1.00 H new ATOM 0 HB2 PHE A 45 -19.348 -13.507 4.468 1.00 1.00 H new ATOM 0 HB3 PHE A 45 -20.273 -14.079 3.093 1.00 1.00 H new ATOM 0 HD1 PHE A 45 -19.273 -15.782 1.525 1.00 1.00 H new ATOM 0 HD2 PHE A 45 -17.323 -14.623 5.173 1.00 1.00 H new ATOM 0 HE1 PHE A 45 -17.839 -17.800 1.399 1.00 1.00 H new ATOM 0 HE2 PHE A 45 -15.887 -16.640 5.045 1.00 1.00 H new ATOM 0 HZ PHE A 45 -16.145 -18.230 3.159 1.00 1.00 H new ATOM 699 N ALA A 46 -18.127 -13.687 0.398 1.00 1.00 N ATOM 700 CA ALA A 46 -18.384 -13.942 -1.050 1.00 1.00 C ATOM 701 C ALA A 46 -19.424 -15.051 -1.222 1.00 1.00 C ATOM 702 O ALA A 46 -19.106 -16.222 -1.284 1.00 1.00 O ATOM 703 CB ALA A 46 -17.035 -14.373 -1.625 1.00 1.00 C ATOM 0 H ALA A 46 -17.271 -14.099 0.769 1.00 1.00 H new ATOM 0 HA ALA A 46 -18.779 -13.062 -1.557 1.00 1.00 H new ATOM 0 HB1 ALA A 46 -17.143 -14.579 -2.690 1.00 1.00 H new ATOM 0 HB2 ALA A 46 -16.307 -13.575 -1.482 1.00 1.00 H new ATOM 0 HB3 ALA A 46 -16.692 -15.273 -1.114 1.00 1.00 H new ATOM 709 N LYS A 47 -20.665 -14.673 -1.313 1.00 1.00 N ATOM 710 CA LYS A 47 -21.758 -15.669 -1.497 1.00 1.00 C ATOM 711 C LYS A 47 -22.850 -15.036 -2.356 1.00 1.00 C ATOM 712 O LYS A 47 -22.650 -13.990 -2.944 1.00 1.00 O ATOM 713 CB LYS A 47 -22.276 -15.964 -0.089 1.00 1.00 C ATOM 714 CG LYS A 47 -21.222 -16.758 0.686 1.00 1.00 C ATOM 715 CD LYS A 47 -21.373 -16.478 2.184 1.00 1.00 C ATOM 716 CE LYS A 47 -20.819 -17.660 2.982 1.00 1.00 C ATOM 717 NZ LYS A 47 -21.012 -17.284 4.409 1.00 1.00 N ATOM 0 H LYS A 47 -20.975 -13.702 -1.267 1.00 1.00 H new ATOM 0 HA LYS A 47 -21.429 -16.583 -1.992 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -22.500 -15.032 0.430 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -23.206 -16.530 -0.143 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -21.338 -17.824 0.491 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -20.223 -16.479 0.352 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -20.841 -15.565 2.450 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -22.423 -16.319 2.431 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -21.349 -18.582 2.741 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -19.766 -17.829 2.757 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -20.656 -18.046 5.020 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -20.491 -16.407 4.610 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -22.024 -17.136 4.595 1.00 1.00 H new ATOM 730 N ALA A 48 -24.008 -15.629 -2.428 1.00 1.00 N ATOM 731 CA ALA A 48 -25.078 -15.002 -3.247 1.00 1.00 C ATOM 732 C ALA A 48 -25.219 -13.552 -2.798 1.00 1.00 C ATOM 733 O ALA A 48 -25.644 -12.690 -3.542 1.00 1.00 O ATOM 734 CB ALA A 48 -26.348 -15.797 -2.939 1.00 1.00 C ATOM 0 H ALA A 48 -24.256 -16.503 -1.965 1.00 1.00 H new ATOM 0 HA ALA A 48 -24.871 -15.012 -4.317 1.00 1.00 H new ATOM 0 HB1 ALA A 48 -27.181 -15.388 -3.511 1.00 1.00 H new ATOM 0 HB2 ALA A 48 -26.199 -16.842 -3.212 1.00 1.00 H new ATOM 0 HB3 ALA A 48 -26.571 -15.729 -1.874 1.00 1.00 H new ATOM 740 N LYS A 49 -24.822 -13.276 -1.586 1.00 1.00 N ATOM 741 CA LYS A 49 -24.879 -11.880 -1.078 1.00 1.00 C ATOM 742 C LYS A 49 -23.850 -11.031 -1.827 1.00 1.00 C ATOM 743 O LYS A 49 -24.161 -9.981 -2.355 1.00 1.00 O ATOM 744 CB LYS A 49 -24.523 -11.979 0.406 1.00 1.00 C ATOM 745 CG LYS A 49 -25.780 -11.756 1.249 1.00 1.00 C ATOM 746 CD LYS A 49 -25.883 -10.279 1.635 1.00 1.00 C ATOM 747 CE LYS A 49 -25.107 -10.033 2.931 1.00 1.00 C ATOM 748 NZ LYS A 49 -26.149 -9.724 3.949 1.00 1.00 N ATOM 0 H LYS A 49 -24.459 -13.962 -0.924 1.00 1.00 H new ATOM 0 HA LYS A 49 -25.855 -11.416 -1.222 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -24.095 -12.958 0.624 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -23.766 -11.237 0.659 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -26.665 -12.058 0.688 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -25.744 -12.375 2.145 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -25.483 -9.655 0.836 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -26.928 -9.999 1.766 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -24.525 -10.910 3.215 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -24.405 -9.206 2.820 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -25.695 -9.543 4.867 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -26.683 -8.881 3.655 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -26.798 -10.532 4.037 1.00 1.00 H new ATOM 761 N ARG A 50 -22.620 -11.485 -1.884 1.00 1.00 N ATOM 762 CA ARG A 50 -21.573 -10.708 -2.601 1.00 1.00 C ATOM 763 C ARG A 50 -21.957 -10.551 -4.072 1.00 1.00 C ATOM 764 O ARG A 50 -21.566 -9.604 -4.726 1.00 1.00 O ATOM 765 CB ARG A 50 -20.297 -11.540 -2.464 1.00 1.00 C ATOM 766 CG ARG A 50 -19.176 -10.668 -1.897 1.00 1.00 C ATOM 767 CD ARG A 50 -19.750 -9.720 -0.842 1.00 1.00 C ATOM 768 NE ARG A 50 -19.208 -8.379 -1.195 1.00 1.00 N ATOM 769 CZ ARG A 50 -19.197 -7.986 -2.440 1.00 1.00 C ATOM 770 NH1 ARG A 50 -19.663 -8.768 -3.375 1.00 1.00 N ATOM 771 NH2 ARG A 50 -18.720 -6.812 -2.750 1.00 1.00 N ATOM 0 H ARG A 50 -22.302 -12.358 -1.464 1.00 1.00 H new ATOM 0 HA ARG A 50 -21.447 -9.705 -2.194 1.00 1.00 H new ATOM 0 HB2 ARG A 50 -20.475 -12.393 -1.809 1.00 1.00 H new ATOM 0 HB3 ARG A 50 -20.005 -11.940 -3.435 1.00 1.00 H new ATOM 0 HG2 ARG A 50 -18.402 -11.295 -1.455 1.00 1.00 H new ATOM 0 HG3 ARG A 50 -18.705 -10.097 -2.697 1.00 1.00 H new ATOM 0 HD2 ARG A 50 -20.840 -9.723 -0.860 1.00 1.00 H new ATOM 0 HD3 ARG A 50 -19.447 -10.017 0.162 1.00 1.00 H new ATOM 0 HE ARG A 50 -18.845 -7.767 -0.464 1.00 1.00 H new ATOM 0 HH11 ARG A 50 -20.036 -9.686 -3.133 1.00 1.00 H new ATOM 0 HH12 ARG A 50 -19.654 -8.461 -4.348 1.00 1.00 H new ATOM 0 HH21 ARG A 50 -18.355 -6.201 -2.020 1.00 1.00 H new ATOM 0 HH22 ARG A 50 -18.712 -6.506 -3.723 1.00 1.00 H new ATOM 784 N THR A 51 -22.736 -11.460 -4.594 1.00 1.00 N ATOM 785 CA THR A 51 -23.155 -11.343 -6.018 1.00 1.00 C ATOM 786 C THR A 51 -24.081 -10.138 -6.171 1.00 1.00 C ATOM 787 O THR A 51 -24.021 -9.411 -7.143 1.00 1.00 O ATOM 788 CB THR A 51 -23.901 -12.642 -6.326 1.00 1.00 C ATOM 789 OG1 THR A 51 -24.041 -12.783 -7.733 1.00 1.00 O ATOM 790 CG2 THR A 51 -25.284 -12.606 -5.674 1.00 1.00 C ATOM 0 H THR A 51 -23.098 -12.274 -4.098 1.00 1.00 H new ATOM 0 HA THR A 51 -22.314 -11.199 -6.696 1.00 1.00 H new ATOM 0 HB THR A 51 -23.338 -13.487 -5.930 1.00 1.00 H new ATOM 0 HG1 THR A 51 -24.517 -13.616 -7.933 1.00 1.00 H new ATOM 0 HG21 THR A 51 -25.814 -13.532 -5.894 1.00 1.00 H new ATOM 0 HG22 THR A 51 -25.175 -12.498 -4.595 1.00 1.00 H new ATOM 0 HG23 THR A 51 -25.850 -11.762 -6.067 1.00 1.00 H new ATOM 798 N ARG A 52 -24.927 -9.912 -5.203 1.00 1.00 N ATOM 799 CA ARG A 52 -25.847 -8.742 -5.273 1.00 1.00 C ATOM 800 C ARG A 52 -25.203 -7.554 -4.557 1.00 1.00 C ATOM 801 O ARG A 52 -25.027 -6.492 -5.121 1.00 1.00 O ATOM 802 CB ARG A 52 -27.116 -9.187 -4.546 1.00 1.00 C ATOM 803 CG ARG A 52 -28.248 -9.372 -5.557 1.00 1.00 C ATOM 804 CD ARG A 52 -29.523 -9.799 -4.826 1.00 1.00 C ATOM 805 NE ARG A 52 -30.603 -8.960 -5.415 1.00 1.00 N ATOM 806 CZ ARG A 52 -31.280 -8.141 -4.657 1.00 1.00 C ATOM 807 NH1 ARG A 52 -31.009 -8.056 -3.384 1.00 1.00 N ATOM 808 NH2 ARG A 52 -32.228 -7.409 -5.173 1.00 1.00 N ATOM 0 H ARG A 52 -25.021 -10.488 -4.366 1.00 1.00 H new ATOM 0 HA ARG A 52 -26.062 -8.433 -6.296 1.00 1.00 H new ATOM 0 HB2 ARG A 52 -26.934 -10.121 -4.014 1.00 1.00 H new ATOM 0 HB3 ARG A 52 -27.399 -8.445 -3.800 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -28.421 -8.442 -6.099 1.00 1.00 H new ATOM 0 HG3 ARG A 52 -27.971 -10.124 -6.295 1.00 1.00 H new ATOM 0 HD2 ARG A 52 -29.724 -10.860 -4.971 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -29.436 -9.634 -3.752 1.00 1.00 H new ATOM 0 HE ARG A 52 -30.814 -9.025 -6.411 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -30.268 -8.630 -2.981 1.00 1.00 H new ATOM 0 HH12 ARG A 52 -31.538 -7.416 -2.792 1.00 1.00 H new ATOM 0 HH21 ARG A 52 -32.440 -7.477 -6.168 1.00 1.00 H new ATOM 0 HH22 ARG A 52 -32.757 -6.769 -4.581 1.00 1.00 H new ATOM 821 N ILE A 53 -24.844 -7.735 -3.317 1.00 1.00 N ATOM 822 CA ILE A 53 -24.203 -6.624 -2.560 1.00 1.00 C ATOM 823 C ILE A 53 -23.121 -5.977 -3.426 1.00 1.00 C ATOM 824 O ILE A 53 -23.110 -4.779 -3.633 1.00 1.00 O ATOM 825 CB ILE A 53 -23.584 -7.286 -1.329 1.00 1.00 C ATOM 826 CG1 ILE A 53 -24.232 -6.719 -0.064 1.00 1.00 C ATOM 827 CG2 ILE A 53 -22.081 -7.008 -1.299 1.00 1.00 C ATOM 828 CD1 ILE A 53 -24.028 -7.695 1.096 1.00 1.00 C ATOM 0 H ILE A 53 -24.966 -8.603 -2.795 1.00 1.00 H new ATOM 0 HA ILE A 53 -24.909 -5.842 -2.281 1.00 1.00 H new ATOM 0 HB ILE A 53 -23.753 -8.362 -1.374 1.00 1.00 H new ATOM 0 HG12 ILE A 53 -23.793 -5.751 0.180 1.00 1.00 H new ATOM 0 HG13 ILE A 53 -25.296 -6.553 -0.231 1.00 1.00 H new ATOM 0 HG21 ILE A 53 -21.641 -7.481 -0.421 1.00 1.00 H new ATOM 0 HG22 ILE A 53 -21.618 -7.413 -2.199 1.00 1.00 H new ATOM 0 HG23 ILE A 53 -21.911 -5.932 -1.256 1.00 1.00 H new ATOM 0 HD11 ILE A 53 -24.490 -7.291 1.997 1.00 1.00 H new ATOM 0 HD12 ILE A 53 -24.488 -8.653 0.851 1.00 1.00 H new ATOM 0 HD13 ILE A 53 -22.961 -7.838 1.268 1.00 1.00 H new ATOM 840 N LEU A 54 -22.221 -6.763 -3.953 1.00 1.00 N ATOM 841 CA LEU A 54 -21.156 -6.195 -4.826 1.00 1.00 C ATOM 842 C LEU A 54 -21.783 -5.670 -6.121 1.00 1.00 C ATOM 843 O LEU A 54 -21.649 -4.514 -6.469 1.00 1.00 O ATOM 844 CB LEU A 54 -20.213 -7.363 -5.117 1.00 1.00 C ATOM 845 CG LEU A 54 -19.466 -7.103 -6.427 1.00 1.00 C ATOM 846 CD1 LEU A 54 -20.462 -7.074 -7.588 1.00 1.00 C ATOM 847 CD2 LEU A 54 -18.745 -5.755 -6.342 1.00 1.00 C ATOM 0 H LEU A 54 -22.178 -7.773 -3.816 1.00 1.00 H new ATOM 0 HA LEU A 54 -20.629 -5.363 -4.359 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -19.503 -7.483 -4.299 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -20.779 -8.292 -5.187 1.00 1.00 H new ATOM 0 HG LEU A 54 -18.738 -7.897 -6.593 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -19.929 -6.889 -8.520 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -20.978 -8.032 -7.649 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -21.190 -6.280 -7.423 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -18.212 -5.568 -7.274 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -19.474 -4.962 -6.175 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -18.035 -5.774 -5.516 1.00 1.00 H new ATOM 859 N GLU A 55 -22.471 -6.522 -6.831 1.00 1.00 N ATOM 860 CA GLU A 55 -23.116 -6.089 -8.104 1.00 1.00 C ATOM 861 C GLU A 55 -23.988 -4.855 -7.854 1.00 1.00 C ATOM 862 O GLU A 55 -23.872 -3.855 -8.534 1.00 1.00 O ATOM 863 CB GLU A 55 -23.976 -7.276 -8.538 1.00 1.00 C ATOM 864 CG GLU A 55 -23.714 -7.586 -10.013 1.00 1.00 C ATOM 865 CD GLU A 55 -25.033 -7.547 -10.786 1.00 1.00 C ATOM 866 OE1 GLU A 55 -25.952 -6.895 -10.318 1.00 1.00 O ATOM 867 OE2 GLU A 55 -25.104 -8.170 -11.832 1.00 1.00 O ATOM 0 H GLU A 55 -22.615 -7.501 -6.584 1.00 1.00 H new ATOM 0 HA GLU A 55 -22.387 -5.817 -8.868 1.00 1.00 H new ATOM 0 HB2 GLU A 55 -23.746 -8.148 -7.926 1.00 1.00 H new ATOM 0 HB3 GLU A 55 -25.031 -7.049 -8.385 1.00 1.00 H new ATOM 0 HG2 GLU A 55 -23.015 -6.861 -10.429 1.00 1.00 H new ATOM 0 HG3 GLU A 55 -23.251 -8.568 -10.112 1.00 1.00 H new ATOM 874 N LYS A 56 -24.855 -4.914 -6.880 1.00 1.00 N ATOM 875 CA LYS A 56 -25.724 -3.740 -6.587 1.00 1.00 C ATOM 876 C LYS A 56 -24.873 -2.583 -6.061 1.00 1.00 C ATOM 877 O LYS A 56 -25.156 -1.427 -6.308 1.00 1.00 O ATOM 878 CB LYS A 56 -26.698 -4.223 -5.512 1.00 1.00 C ATOM 879 CG LYS A 56 -26.085 -3.997 -4.128 1.00 1.00 C ATOM 880 CD LYS A 56 -27.069 -3.214 -3.255 1.00 1.00 C ATOM 881 CE LYS A 56 -27.195 -3.896 -1.891 1.00 1.00 C ATOM 882 NZ LYS A 56 -27.591 -2.809 -0.953 1.00 1.00 N ATOM 0 H LYS A 56 -24.999 -5.723 -6.276 1.00 1.00 H new ATOM 0 HA LYS A 56 -26.247 -3.378 -7.472 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -27.643 -3.686 -5.595 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -26.919 -5.281 -5.655 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -25.851 -4.954 -3.662 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -25.147 -3.449 -4.219 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -26.724 -2.188 -3.130 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -28.044 -3.165 -3.741 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -27.942 -4.690 -1.914 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -26.253 -4.354 -1.590 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -27.697 -3.199 0.005 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -26.858 -2.071 -0.947 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -28.495 -2.397 -1.261 1.00 1.00 H new ATOM 895 N GLU A 57 -23.827 -2.886 -5.343 1.00 1.00 N ATOM 896 CA GLU A 57 -22.950 -1.807 -4.809 1.00 1.00 C ATOM 897 C GLU A 57 -21.906 -1.424 -5.860 1.00 1.00 C ATOM 898 O GLU A 57 -21.713 -0.264 -6.165 1.00 1.00 O ATOM 899 CB GLU A 57 -22.275 -2.412 -3.577 1.00 1.00 C ATOM 900 CG GLU A 57 -23.176 -2.218 -2.355 1.00 1.00 C ATOM 901 CD GLU A 57 -23.059 -3.437 -1.436 1.00 1.00 C ATOM 902 OE1 GLU A 57 -23.475 -4.506 -1.849 1.00 1.00 O ATOM 903 OE2 GLU A 57 -22.556 -3.279 -0.337 1.00 1.00 O ATOM 0 H GLU A 57 -23.542 -3.835 -5.103 1.00 1.00 H new ATOM 0 HA GLU A 57 -23.506 -0.903 -4.560 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -22.085 -3.473 -3.737 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -21.308 -1.937 -3.409 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -22.888 -1.315 -1.817 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -24.211 -2.085 -2.670 1.00 1.00 H new ATOM 910 N VAL A 58 -21.235 -2.394 -6.418 1.00 1.00 N ATOM 911 CA VAL A 58 -20.208 -2.092 -7.454 1.00 1.00 C ATOM 912 C VAL A 58 -20.882 -1.836 -8.804 1.00 1.00 C ATOM 913 O VAL A 58 -20.558 -0.896 -9.501 1.00 1.00 O ATOM 914 CB VAL A 58 -19.331 -3.341 -7.520 1.00 1.00 C ATOM 915 CG1 VAL A 58 -19.710 -4.169 -8.750 1.00 1.00 C ATOM 916 CG2 VAL A 58 -17.861 -2.927 -7.620 1.00 1.00 C ATOM 0 H VAL A 58 -21.354 -3.383 -6.201 1.00 1.00 H new ATOM 0 HA VAL A 58 -19.628 -1.201 -7.214 1.00 1.00 H new ATOM 0 HB VAL A 58 -19.482 -3.937 -6.620 1.00 1.00 H new ATOM 0 HG11 VAL A 58 -19.084 -5.060 -8.796 1.00 1.00 H new ATOM 0 HG12 VAL A 58 -20.757 -4.465 -8.681 1.00 1.00 H new ATOM 0 HG13 VAL A 58 -19.560 -3.573 -9.650 1.00 1.00 H new ATOM 0 HG21 VAL A 58 -17.235 -3.818 -7.667 1.00 1.00 H new ATOM 0 HG22 VAL A 58 -17.711 -2.330 -8.520 1.00 1.00 H new ATOM 0 HG23 VAL A 58 -17.589 -2.338 -6.744 1.00 1.00 H new ATOM 926 N LEU A 59 -21.823 -2.662 -9.179 1.00 1.00 N ATOM 927 CA LEU A 59 -22.513 -2.453 -10.484 1.00 1.00 C ATOM 928 C LEU A 59 -22.859 -0.974 -10.653 1.00 1.00 C ATOM 929 O LEU A 59 -22.631 -0.387 -11.692 1.00 1.00 O ATOM 930 CB LEU A 59 -23.785 -3.297 -10.402 1.00 1.00 C ATOM 931 CG LEU A 59 -24.518 -3.242 -11.743 1.00 1.00 C ATOM 932 CD1 LEU A 59 -25.113 -1.849 -11.944 1.00 1.00 C ATOM 933 CD2 LEU A 59 -23.529 -3.541 -12.873 1.00 1.00 C ATOM 0 H LEU A 59 -22.142 -3.468 -8.641 1.00 1.00 H new ATOM 0 HA LEU A 59 -21.894 -2.739 -11.334 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -23.535 -4.328 -10.154 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -24.431 -2.925 -9.606 1.00 1.00 H new ATOM 0 HG LEU A 59 -25.318 -3.982 -11.751 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -25.635 -1.811 -12.900 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -25.815 -1.633 -11.138 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -24.314 -1.108 -11.937 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -24.048 -3.503 -13.831 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -22.730 -2.799 -12.863 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -23.103 -4.534 -12.731 1.00 1.00 H new ATOM 945 N LYS A 60 -23.396 -0.364 -9.632 1.00 1.00 N ATOM 946 CA LYS A 60 -23.743 1.082 -9.726 1.00 1.00 C ATOM 947 C LYS A 60 -22.509 1.923 -9.401 1.00 1.00 C ATOM 948 O LYS A 60 -22.364 3.039 -9.859 1.00 1.00 O ATOM 949 CB LYS A 60 -24.835 1.298 -8.680 1.00 1.00 C ATOM 950 CG LYS A 60 -25.118 2.795 -8.539 1.00 1.00 C ATOM 951 CD LYS A 60 -26.338 3.166 -9.383 1.00 1.00 C ATOM 952 CE LYS A 60 -25.882 3.601 -10.777 1.00 1.00 C ATOM 953 NZ LYS A 60 -24.466 4.030 -10.602 1.00 1.00 N ATOM 0 H LYS A 60 -23.609 -0.804 -8.737 1.00 1.00 H new ATOM 0 HA LYS A 60 -24.080 1.371 -10.721 1.00 1.00 H new ATOM 0 HB2 LYS A 60 -25.743 0.771 -8.973 1.00 1.00 H new ATOM 0 HB3 LYS A 60 -24.522 0.884 -7.721 1.00 1.00 H new ATOM 0 HG2 LYS A 60 -25.297 3.045 -7.493 1.00 1.00 H new ATOM 0 HG3 LYS A 60 -24.251 3.372 -8.861 1.00 1.00 H new ATOM 0 HD2 LYS A 60 -27.013 2.314 -9.459 1.00 1.00 H new ATOM 0 HD3 LYS A 60 -26.894 3.971 -8.903 1.00 1.00 H new ATOM 0 HE2 LYS A 60 -25.961 2.782 -11.492 1.00 1.00 H new ATOM 0 HE3 LYS A 60 -26.497 4.416 -11.157 1.00 1.00 H new ATOM 0 HZ1 LYS A 60 -24.162 4.573 -11.436 1.00 1.00 H new ATOM 0 HZ2 LYS A 60 -24.386 4.626 -9.753 1.00 1.00 H new ATOM 0 HZ3 LYS A 60 -23.860 3.192 -10.495 1.00 1.00 H new ATOM 966 N GLU A 61 -21.614 1.386 -8.617 1.00 1.00 N ATOM 967 CA GLU A 61 -20.379 2.140 -8.261 1.00 1.00 C ATOM 968 C GLU A 61 -19.180 1.564 -9.019 1.00 1.00 C ATOM 969 O GLU A 61 -18.916 0.380 -8.974 1.00 1.00 O ATOM 970 CB GLU A 61 -20.211 1.939 -6.755 1.00 1.00 C ATOM 971 CG GLU A 61 -19.561 3.182 -6.143 1.00 1.00 C ATOM 972 CD GLU A 61 -18.972 2.830 -4.776 1.00 1.00 C ATOM 973 OE1 GLU A 61 -19.742 2.684 -3.840 1.00 1.00 O ATOM 974 OE2 GLU A 61 -17.761 2.711 -4.686 1.00 1.00 O ATOM 0 H GLU A 61 -21.686 0.455 -8.207 1.00 1.00 H new ATOM 0 HA GLU A 61 -20.446 3.196 -8.523 1.00 1.00 H new ATOM 0 HB2 GLU A 61 -21.181 1.757 -6.291 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -19.595 1.061 -6.561 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -18.778 3.558 -6.802 1.00 1.00 H new ATOM 0 HG3 GLU A 61 -20.299 3.977 -6.039 1.00 1.00 H new ATOM 981 N THR A 62 -18.454 2.393 -9.715 1.00 1.00 N ATOM 982 CA THR A 62 -17.274 1.893 -10.479 1.00 1.00 C ATOM 983 C THR A 62 -16.824 0.535 -9.934 1.00 1.00 C ATOM 984 O THR A 62 -15.901 0.444 -9.149 1.00 1.00 O ATOM 985 CB THR A 62 -16.186 2.945 -10.263 1.00 1.00 C ATOM 986 OG1 THR A 62 -16.491 4.103 -11.029 1.00 1.00 O ATOM 987 CG2 THR A 62 -14.834 2.381 -10.702 1.00 1.00 C ATOM 0 H THR A 62 -18.625 3.396 -9.789 1.00 1.00 H new ATOM 0 HA THR A 62 -17.499 1.750 -11.536 1.00 1.00 H new ATOM 0 HB THR A 62 -16.140 3.210 -9.207 1.00 1.00 H new ATOM 0 HG1 THR A 62 -15.661 4.572 -11.258 1.00 1.00 H new ATOM 0 HG21 THR A 62 -14.059 3.132 -10.548 1.00 1.00 H new ATOM 0 HG22 THR A 62 -14.602 1.493 -10.114 1.00 1.00 H new ATOM 0 HG23 THR A 62 -14.876 2.115 -11.758 1.00 1.00 H new ATOM 995 N HIS A 63 -17.466 -0.523 -10.349 1.00 1.00 N ATOM 996 CA HIS A 63 -17.073 -1.877 -9.861 1.00 1.00 C ATOM 997 C HIS A 63 -16.259 -2.604 -10.934 1.00 1.00 C ATOM 998 O HIS A 63 -16.678 -2.721 -12.069 1.00 1.00 O ATOM 999 CB HIS A 63 -18.394 -2.603 -9.603 1.00 1.00 C ATOM 1000 CG HIS A 63 -19.272 -2.491 -10.818 1.00 1.00 C ATOM 1001 ND1 HIS A 63 -19.957 -1.326 -11.132 1.00 1.00 N ATOM 1002 CD2 HIS A 63 -19.585 -3.388 -11.810 1.00 1.00 C ATOM 1003 CE1 HIS A 63 -20.642 -1.552 -12.267 1.00 1.00 C ATOM 1004 NE2 HIS A 63 -20.450 -2.793 -12.723 1.00 1.00 N ATOM 0 H HIS A 63 -18.246 -0.509 -11.006 1.00 1.00 H new ATOM 0 HA HIS A 63 -16.453 -1.833 -8.966 1.00 1.00 H new ATOM 0 HB2 HIS A 63 -18.206 -3.652 -9.372 1.00 1.00 H new ATOM 0 HB3 HIS A 63 -18.896 -2.171 -8.737 1.00 1.00 H new ATOM 0 HD1 HIS A 63 -19.943 -0.456 -10.599 1.00 1.00 H new ATOM 0 HD2 HIS A 63 -19.216 -4.401 -11.872 1.00 1.00 H new ATOM 0 HE1 HIS A 63 -21.271 -0.819 -12.751 1.00 1.00 H new ATOM 1012 N GLU A 64 -15.098 -3.090 -10.590 1.00 1.00 N ATOM 1013 CA GLU A 64 -14.262 -3.802 -11.599 1.00 1.00 C ATOM 1014 C GLU A 64 -13.667 -5.079 -11.000 1.00 1.00 C ATOM 1015 O GLU A 64 -13.342 -5.134 -9.831 1.00 1.00 O ATOM 1016 CB GLU A 64 -13.148 -2.817 -11.954 1.00 1.00 C ATOM 1017 CG GLU A 64 -13.629 -1.883 -13.066 1.00 1.00 C ATOM 1018 CD GLU A 64 -13.355 -0.431 -12.670 1.00 1.00 C ATOM 1019 OE1 GLU A 64 -12.194 -0.056 -12.636 1.00 1.00 O ATOM 1020 OE2 GLU A 64 -14.309 0.282 -12.406 1.00 1.00 O ATOM 0 H GLU A 64 -14.692 -3.025 -9.656 1.00 1.00 H new ATOM 0 HA GLU A 64 -14.843 -4.102 -12.471 1.00 1.00 H new ATOM 0 HB2 GLU A 64 -12.866 -2.238 -11.075 1.00 1.00 H new ATOM 0 HB3 GLU A 64 -12.259 -3.358 -12.278 1.00 1.00 H new ATOM 0 HG2 GLU A 64 -13.118 -2.119 -13.999 1.00 1.00 H new ATOM 0 HG3 GLU A 64 -14.695 -2.028 -13.241 1.00 1.00 H new ATOM 1027 N LYS A 65 -13.514 -6.101 -11.796 1.00 1.00 N ATOM 1028 CA LYS A 65 -12.933 -7.372 -11.280 1.00 1.00 C ATOM 1029 C LYS A 65 -11.453 -7.459 -11.669 1.00 1.00 C ATOM 1030 O LYS A 65 -11.093 -7.269 -12.814 1.00 1.00 O ATOM 1031 CB LYS A 65 -13.736 -8.480 -11.962 1.00 1.00 C ATOM 1032 CG LYS A 65 -13.170 -9.844 -11.564 1.00 1.00 C ATOM 1033 CD LYS A 65 -14.072 -10.952 -12.109 1.00 1.00 C ATOM 1034 CE LYS A 65 -13.719 -12.278 -11.432 1.00 1.00 C ATOM 1035 NZ LYS A 65 -12.248 -12.213 -11.206 1.00 1.00 N ATOM 0 H LYS A 65 -13.767 -6.111 -12.784 1.00 1.00 H new ATOM 0 HA LYS A 65 -12.985 -7.446 -10.194 1.00 1.00 H new ATOM 0 HB2 LYS A 65 -14.785 -8.412 -11.674 1.00 1.00 H new ATOM 0 HB3 LYS A 65 -13.694 -8.360 -13.045 1.00 1.00 H new ATOM 0 HG2 LYS A 65 -12.159 -9.958 -11.956 1.00 1.00 H new ATOM 0 HG3 LYS A 65 -13.101 -9.918 -10.479 1.00 1.00 H new ATOM 0 HD2 LYS A 65 -15.118 -10.706 -11.927 1.00 1.00 H new ATOM 0 HD3 LYS A 65 -13.948 -11.038 -13.188 1.00 1.00 H new ATOM 0 HE2 LYS A 65 -14.258 -12.398 -10.492 1.00 1.00 H new ATOM 0 HE3 LYS A 65 -13.985 -13.127 -12.062 1.00 1.00 H new ATOM 0 HZ1 LYS A 65 -11.864 -13.177 -11.137 1.00 1.00 H new ATOM 0 HZ2 LYS A 65 -11.796 -11.717 -12.001 1.00 1.00 H new ATOM 0 HZ3 LYS A 65 -12.055 -11.699 -10.323 1.00 1.00 H new ATOM 1048 N VAL A 66 -10.592 -7.734 -10.728 1.00 1.00 N ATOM 1049 CA VAL A 66 -9.138 -7.820 -11.051 1.00 1.00 C ATOM 1050 C VAL A 66 -8.761 -9.246 -11.464 1.00 1.00 C ATOM 1051 O VAL A 66 -9.001 -10.196 -10.746 1.00 1.00 O ATOM 1052 CB VAL A 66 -8.424 -7.431 -9.758 1.00 1.00 C ATOM 1053 CG1 VAL A 66 -8.889 -6.043 -9.314 1.00 1.00 C ATOM 1054 CG2 VAL A 66 -8.756 -8.452 -8.666 1.00 1.00 C ATOM 0 H VAL A 66 -10.831 -7.903 -9.751 1.00 1.00 H new ATOM 0 HA VAL A 66 -8.864 -7.171 -11.883 1.00 1.00 H new ATOM 0 HB VAL A 66 -7.348 -7.416 -9.929 1.00 1.00 H new ATOM 0 HG11 VAL A 66 -8.379 -5.766 -8.391 1.00 1.00 H new ATOM 0 HG12 VAL A 66 -8.654 -5.315 -10.091 1.00 1.00 H new ATOM 0 HG13 VAL A 66 -9.965 -6.057 -9.143 1.00 1.00 H new ATOM 0 HG21 VAL A 66 -8.247 -8.176 -7.743 1.00 1.00 H new ATOM 0 HG22 VAL A 66 -9.833 -8.466 -8.497 1.00 1.00 H new ATOM 0 HG23 VAL A 66 -8.425 -9.442 -8.980 1.00 1.00 H new ATOM 1064 N GLN A 67 -8.166 -9.398 -12.616 1.00 1.00 N ATOM 1065 CA GLN A 67 -7.766 -10.759 -13.078 1.00 1.00 C ATOM 1066 C GLN A 67 -6.427 -10.692 -13.818 1.00 1.00 C ATOM 1067 O GLN A 67 -6.061 -9.672 -14.369 1.00 1.00 O ATOM 1068 CB GLN A 67 -8.883 -11.199 -14.025 1.00 1.00 C ATOM 1069 CG GLN A 67 -10.183 -11.371 -13.236 1.00 1.00 C ATOM 1070 CD GLN A 67 -9.854 -11.655 -11.769 1.00 1.00 C ATOM 1071 OE1 GLN A 67 -8.882 -12.318 -11.470 1.00 1.00 O ATOM 1072 NE2 GLN A 67 -10.631 -11.178 -10.836 1.00 1.00 N ATOM 0 H GLN A 67 -7.939 -8.638 -13.258 1.00 1.00 H new ATOM 0 HA GLN A 67 -7.636 -11.456 -12.250 1.00 1.00 H new ATOM 0 HB2 GLN A 67 -9.019 -10.458 -14.813 1.00 1.00 H new ATOM 0 HB3 GLN A 67 -8.614 -12.136 -14.511 1.00 1.00 H new ATOM 0 HG2 GLN A 67 -10.791 -10.470 -13.316 1.00 1.00 H new ATOM 0 HG3 GLN A 67 -10.769 -12.190 -13.654 1.00 1.00 H new ATOM 0 HE21 GLN A 67 -11.448 -10.621 -11.088 1.00 1.00 H new ATOM 0 HE22 GLN A 67 -10.422 -11.362 -9.855 1.00 1.00 H new ATOM 1081 N GLY A 68 -5.692 -11.771 -13.836 1.00 1.00 N ATOM 1082 CA GLY A 68 -4.379 -11.768 -14.541 1.00 1.00 C ATOM 1083 C GLY A 68 -3.265 -11.425 -13.550 1.00 1.00 C ATOM 1084 O GLY A 68 -2.097 -11.455 -13.881 1.00 1.00 O ATOM 0 H GLY A 68 -5.944 -12.654 -13.393 1.00 1.00 H new ATOM 0 HA2 GLY A 68 -4.193 -12.744 -14.989 1.00 1.00 H new ATOM 0 HA3 GLY A 68 -4.393 -11.042 -15.354 1.00 1.00 H new ATOM 1088 N GLY A 69 -3.616 -11.099 -12.337 1.00 1.00 N ATOM 1089 CA GLY A 69 -2.575 -10.756 -11.326 1.00 1.00 C ATOM 1090 C GLY A 69 -2.493 -9.237 -11.165 1.00 1.00 C ATOM 1091 O GLY A 69 -1.758 -8.730 -10.340 1.00 1.00 O ATOM 0 H GLY A 69 -4.578 -11.055 -12.001 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -2.816 -11.220 -10.370 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -1.608 -11.151 -11.637 1.00 1.00 H new ATOM 1095 N PHE A 70 -3.244 -8.504 -11.942 1.00 1.00 N ATOM 1096 CA PHE A 70 -3.208 -7.018 -11.828 1.00 1.00 C ATOM 1097 C PHE A 70 -4.407 -6.523 -11.015 1.00 1.00 C ATOM 1098 O PHE A 70 -5.431 -6.161 -11.559 1.00 1.00 O ATOM 1099 CB PHE A 70 -3.289 -6.509 -13.267 1.00 1.00 C ATOM 1100 CG PHE A 70 -2.778 -7.574 -14.207 1.00 1.00 C ATOM 1101 CD1 PHE A 70 -1.401 -7.726 -14.410 1.00 1.00 C ATOM 1102 CD2 PHE A 70 -3.681 -8.409 -14.876 1.00 1.00 C ATOM 1103 CE1 PHE A 70 -0.927 -8.714 -15.282 1.00 1.00 C ATOM 1104 CE2 PHE A 70 -3.207 -9.397 -15.748 1.00 1.00 C ATOM 1105 CZ PHE A 70 -1.829 -9.549 -15.951 1.00 1.00 C ATOM 0 H PHE A 70 -3.880 -8.870 -12.650 1.00 1.00 H new ATOM 0 HA PHE A 70 -2.311 -6.663 -11.320 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -4.319 -6.253 -13.516 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -2.699 -5.599 -13.376 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -0.705 -7.081 -13.894 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -4.743 -8.291 -14.720 1.00 1.00 H new ATOM 0 HE1 PHE A 70 0.135 -8.832 -15.438 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -3.903 -10.042 -16.264 1.00 1.00 H new ATOM 0 HZ PHE A 70 -1.463 -10.311 -16.624 1.00 1.00 H new ATOM 1115 N GLY A 71 -4.290 -6.506 -9.714 1.00 1.00 N ATOM 1116 CA GLY A 71 -5.427 -6.037 -8.872 1.00 1.00 C ATOM 1117 C GLY A 71 -6.296 -7.233 -8.480 1.00 1.00 C ATOM 1118 O GLY A 71 -7.465 -7.091 -8.172 1.00 1.00 O ATOM 0 H GLY A 71 -3.458 -6.796 -9.200 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -5.051 -5.538 -7.979 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -6.021 -5.305 -9.419 1.00 1.00 H new ATOM 1122 N LYS A 72 -5.734 -8.412 -8.482 1.00 1.00 N ATOM 1123 CA LYS A 72 -6.534 -9.614 -8.117 1.00 1.00 C ATOM 1124 C LYS A 72 -6.808 -9.607 -6.617 1.00 1.00 C ATOM 1125 O LYS A 72 -7.618 -10.364 -6.118 1.00 1.00 O ATOM 1126 CB LYS A 72 -5.656 -10.808 -8.493 1.00 1.00 C ATOM 1127 CG LYS A 72 -5.829 -11.917 -7.453 1.00 1.00 C ATOM 1128 CD LYS A 72 -5.526 -11.365 -6.058 1.00 1.00 C ATOM 1129 CE LYS A 72 -4.687 -12.380 -5.278 1.00 1.00 C ATOM 1130 NZ LYS A 72 -3.544 -12.704 -6.175 1.00 1.00 N ATOM 0 H LYS A 72 -4.759 -8.593 -8.720 1.00 1.00 H new ATOM 0 HA LYS A 72 -7.497 -9.646 -8.626 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -5.929 -11.176 -9.482 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -4.611 -10.503 -8.544 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -6.846 -12.306 -7.488 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -5.161 -12.749 -7.679 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -4.990 -10.419 -6.138 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -6.455 -11.161 -5.526 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -4.341 -11.963 -4.332 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -5.267 -13.272 -5.040 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -2.679 -12.814 -5.609 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -3.741 -13.590 -6.682 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -3.413 -11.934 -6.862 1.00 1.00 H new ATOM 1143 N TYR A 73 -6.161 -8.737 -5.898 1.00 1.00 N ATOM 1144 CA TYR A 73 -6.409 -8.661 -4.436 1.00 1.00 C ATOM 1145 C TYR A 73 -7.659 -7.815 -4.192 1.00 1.00 C ATOM 1146 O TYR A 73 -8.335 -7.959 -3.193 1.00 1.00 O ATOM 1147 CB TYR A 73 -5.171 -7.981 -3.851 1.00 1.00 C ATOM 1148 CG TYR A 73 -4.527 -8.899 -2.840 1.00 1.00 C ATOM 1149 CD1 TYR A 73 -5.326 -9.660 -1.978 1.00 1.00 C ATOM 1150 CD2 TYR A 73 -3.133 -8.990 -2.764 1.00 1.00 C ATOM 1151 CE1 TYR A 73 -4.730 -10.512 -1.040 1.00 1.00 C ATOM 1152 CE2 TYR A 73 -2.536 -9.842 -1.827 1.00 1.00 C ATOM 1153 CZ TYR A 73 -3.335 -10.603 -0.964 1.00 1.00 C ATOM 1154 OH TYR A 73 -2.748 -11.443 -0.040 1.00 1.00 O ATOM 0 H TYR A 73 -5.473 -8.077 -6.259 1.00 1.00 H new ATOM 0 HA TYR A 73 -6.573 -9.637 -3.980 1.00 1.00 H new ATOM 0 HB2 TYR A 73 -4.464 -7.743 -4.645 1.00 1.00 H new ATOM 0 HB3 TYR A 73 -5.449 -7.039 -3.378 1.00 1.00 H new ATOM 0 HD1 TYR A 73 -6.402 -9.590 -2.037 1.00 1.00 H new ATOM 0 HD2 TYR A 73 -2.517 -8.403 -3.429 1.00 1.00 H new ATOM 0 HE1 TYR A 73 -5.346 -11.099 -0.375 1.00 1.00 H new ATOM 0 HE2 TYR A 73 -1.460 -9.912 -1.770 1.00 1.00 H new ATOM 0 HH TYR A 73 -1.773 -11.388 -0.121 1.00 1.00 H new ATOM 1164 N GLN A 74 -7.974 -6.934 -5.108 1.00 1.00 N ATOM 1165 CA GLN A 74 -9.185 -6.083 -4.935 1.00 1.00 C ATOM 1166 C GLN A 74 -10.381 -6.717 -5.650 1.00 1.00 C ATOM 1167 O GLN A 74 -11.468 -6.807 -5.112 1.00 1.00 O ATOM 1168 CB GLN A 74 -8.822 -4.744 -5.578 1.00 1.00 C ATOM 1169 CG GLN A 74 -7.401 -4.350 -5.171 1.00 1.00 C ATOM 1170 CD GLN A 74 -6.446 -5.513 -5.453 1.00 1.00 C ATOM 1171 OE1 GLN A 74 -6.128 -6.281 -4.567 1.00 1.00 O ATOM 1172 NE2 GLN A 74 -5.971 -5.675 -6.658 1.00 1.00 N ATOM 0 H GLN A 74 -7.445 -6.769 -5.965 1.00 1.00 H new ATOM 0 HA GLN A 74 -9.465 -5.969 -3.888 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -8.893 -4.819 -6.663 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -9.528 -3.975 -5.264 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -7.086 -3.465 -5.723 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -7.373 -4.092 -4.112 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -6.238 -5.030 -7.402 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -5.333 -6.446 -6.855 1.00 1.00 H new ATOM 1181 N GLY A 75 -10.192 -7.155 -6.864 1.00 1.00 N ATOM 1182 CA GLY A 75 -11.319 -7.778 -7.607 1.00 1.00 C ATOM 1183 C GLY A 75 -12.307 -6.687 -8.011 1.00 1.00 C ATOM 1184 O GLY A 75 -12.174 -6.069 -9.048 1.00 1.00 O ATOM 0 H GLY A 75 -9.308 -7.108 -7.371 1.00 1.00 H new ATOM 0 HA2 GLY A 75 -10.947 -8.296 -8.491 1.00 1.00 H new ATOM 0 HA3 GLY A 75 -11.814 -8.524 -6.985 1.00 1.00 H new ATOM 1188 N THR A 76 -13.295 -6.444 -7.196 1.00 1.00 N ATOM 1189 CA THR A 76 -14.293 -5.389 -7.527 1.00 1.00 C ATOM 1190 C THR A 76 -14.035 -4.138 -6.684 1.00 1.00 C ATOM 1191 O THR A 76 -14.765 -3.838 -5.761 1.00 1.00 O ATOM 1192 CB THR A 76 -15.650 -6.003 -7.175 1.00 1.00 C ATOM 1193 OG1 THR A 76 -15.727 -7.316 -7.713 1.00 1.00 O ATOM 1194 CG2 THR A 76 -16.769 -5.141 -7.760 1.00 1.00 C ATOM 0 H THR A 76 -13.455 -6.931 -6.314 1.00 1.00 H new ATOM 0 HA THR A 76 -14.243 -5.085 -8.572 1.00 1.00 H new ATOM 0 HB THR A 76 -15.760 -6.048 -6.091 1.00 1.00 H new ATOM 0 HG1 THR A 76 -16.595 -7.712 -7.487 1.00 1.00 H new ATOM 0 HG21 THR A 76 -17.735 -5.579 -7.509 1.00 1.00 H new ATOM 0 HG22 THR A 76 -16.708 -4.135 -7.345 1.00 1.00 H new ATOM 0 HG23 THR A 76 -16.663 -5.094 -8.844 1.00 1.00 H new ATOM 1202 N TRP A 77 -13.000 -3.405 -6.993 1.00 1.00 N ATOM 1203 CA TRP A 77 -12.697 -2.175 -6.207 1.00 1.00 C ATOM 1204 C TRP A 77 -13.659 -1.050 -6.592 1.00 1.00 C ATOM 1205 O TRP A 77 -14.302 -1.093 -7.623 1.00 1.00 O ATOM 1206 CB TRP A 77 -11.260 -1.800 -6.574 1.00 1.00 C ATOM 1207 CG TRP A 77 -10.934 -2.312 -7.941 1.00 1.00 C ATOM 1208 CD1 TRP A 77 -11.841 -2.588 -8.906 1.00 1.00 C ATOM 1209 CD2 TRP A 77 -9.627 -2.613 -8.510 1.00 1.00 C ATOM 1210 NE1 TRP A 77 -11.174 -3.038 -10.032 1.00 1.00 N ATOM 1211 CE2 TRP A 77 -9.808 -3.070 -9.837 1.00 1.00 C ATOM 1212 CE3 TRP A 77 -8.315 -2.532 -8.009 1.00 1.00 C ATOM 1213 CZ2 TRP A 77 -8.724 -3.436 -10.638 1.00 1.00 C ATOM 1214 CZ3 TRP A 77 -7.223 -2.900 -8.813 1.00 1.00 C ATOM 1215 CH2 TRP A 77 -7.428 -3.350 -10.124 1.00 1.00 C ATOM 0 H TRP A 77 -12.352 -3.604 -7.755 1.00 1.00 H new ATOM 0 HA TRP A 77 -12.810 -2.339 -5.135 1.00 1.00 H new ATOM 0 HB2 TRP A 77 -11.138 -0.717 -6.543 1.00 1.00 H new ATOM 0 HB3 TRP A 77 -10.568 -2.220 -5.844 1.00 1.00 H new ATOM 0 HD1 TRP A 77 -12.911 -2.476 -8.813 1.00 1.00 H new ATOM 0 HE1 TRP A 77 -11.635 -3.312 -10.899 1.00 1.00 H new ATOM 0 HE3 TRP A 77 -8.146 -2.185 -7.000 1.00 1.00 H new ATOM 0 HZ2 TRP A 77 -8.887 -3.783 -11.648 1.00 1.00 H new ATOM 0 HZ3 TRP A 77 -6.220 -2.836 -8.418 1.00 1.00 H new ATOM 0 HH2 TRP A 77 -6.584 -3.630 -10.737 1.00 1.00 H new ATOM 1226 N VAL A 78 -13.758 -0.040 -5.773 1.00 1.00 N ATOM 1227 CA VAL A 78 -14.672 1.094 -6.089 1.00 1.00 C ATOM 1228 C VAL A 78 -14.021 2.417 -5.680 1.00 1.00 C ATOM 1229 O VAL A 78 -13.061 2.432 -4.936 1.00 1.00 O ATOM 1230 CB VAL A 78 -15.929 0.834 -5.258 1.00 1.00 C ATOM 1231 CG1 VAL A 78 -17.017 0.238 -6.152 1.00 1.00 C ATOM 1232 CG2 VAL A 78 -15.600 -0.150 -4.133 1.00 1.00 C ATOM 0 H VAL A 78 -13.244 0.049 -4.896 1.00 1.00 H new ATOM 0 HA VAL A 78 -14.897 1.163 -7.153 1.00 1.00 H new ATOM 0 HB VAL A 78 -16.283 1.772 -4.831 1.00 1.00 H new ATOM 0 HG11 VAL A 78 -17.913 0.052 -5.560 1.00 1.00 H new ATOM 0 HG12 VAL A 78 -17.251 0.937 -6.955 1.00 1.00 H new ATOM 0 HG13 VAL A 78 -16.663 -0.701 -6.579 1.00 1.00 H new ATOM 0 HG21 VAL A 78 -16.495 -0.337 -3.539 1.00 1.00 H new ATOM 0 HG22 VAL A 78 -15.247 -1.088 -4.562 1.00 1.00 H new ATOM 0 HG23 VAL A 78 -14.823 0.273 -3.495 1.00 1.00 H new ATOM 1242 N PRO A 79 -14.570 3.489 -6.182 1.00 1.00 N ATOM 1243 CA PRO A 79 -14.035 4.834 -5.861 1.00 1.00 C ATOM 1244 C PRO A 79 -13.948 5.017 -4.343 1.00 1.00 C ATOM 1245 O PRO A 79 -14.949 5.051 -3.656 1.00 1.00 O ATOM 1246 CB PRO A 79 -15.057 5.792 -6.469 1.00 1.00 C ATOM 1247 CG PRO A 79 -15.790 4.992 -7.501 1.00 1.00 C ATOM 1248 CD PRO A 79 -15.725 3.547 -7.081 1.00 1.00 C ATOM 0 HA PRO A 79 -13.030 4.999 -6.250 1.00 1.00 H new ATOM 0 HB2 PRO A 79 -15.740 6.172 -5.709 1.00 1.00 H new ATOM 0 HB3 PRO A 79 -14.567 6.656 -6.917 1.00 1.00 H new ATOM 0 HG2 PRO A 79 -16.826 5.323 -7.579 1.00 1.00 H new ATOM 0 HG3 PRO A 79 -15.338 5.127 -8.484 1.00 1.00 H new ATOM 0 HD2 PRO A 79 -16.640 3.237 -6.576 1.00 1.00 H new ATOM 0 HD3 PRO A 79 -15.596 2.888 -7.939 1.00 1.00 H new ATOM 1256 N LEU A 80 -12.760 5.133 -3.814 1.00 1.00 N ATOM 1257 CA LEU A 80 -12.616 5.309 -2.341 1.00 1.00 C ATOM 1258 C LEU A 80 -13.540 6.424 -1.845 1.00 1.00 C ATOM 1259 O LEU A 80 -14.021 6.392 -0.728 1.00 1.00 O ATOM 1260 CB LEU A 80 -11.152 5.694 -2.130 1.00 1.00 C ATOM 1261 CG LEU A 80 -11.066 6.855 -1.139 1.00 1.00 C ATOM 1262 CD1 LEU A 80 -10.799 6.311 0.266 1.00 1.00 C ATOM 1263 CD2 LEU A 80 -9.926 7.791 -1.548 1.00 1.00 C ATOM 0 H LEU A 80 -11.885 5.114 -4.337 1.00 1.00 H new ATOM 0 HA LEU A 80 -12.885 4.407 -1.791 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -10.591 4.839 -1.754 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -10.700 5.979 -3.080 1.00 1.00 H new ATOM 0 HG LEU A 80 -12.008 7.404 -1.142 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -10.738 7.140 0.971 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -11.610 5.645 0.558 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -9.858 5.761 0.270 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -9.864 8.619 -0.842 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -8.985 7.241 -1.546 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -10.116 8.180 -2.548 1.00 1.00 H new ATOM 1275 N ASN A 81 -13.801 7.405 -2.667 1.00 1.00 N ATOM 1276 CA ASN A 81 -14.703 8.513 -2.240 1.00 1.00 C ATOM 1277 C ASN A 81 -16.125 7.979 -2.061 1.00 1.00 C ATOM 1278 O ASN A 81 -16.850 8.393 -1.177 1.00 1.00 O ATOM 1279 CB ASN A 81 -14.651 9.532 -3.380 1.00 1.00 C ATOM 1280 CG ASN A 81 -14.254 10.901 -2.825 1.00 1.00 C ATOM 1281 OD1 ASN A 81 -14.720 11.919 -3.297 1.00 1.00 O ATOM 1282 ND2 ASN A 81 -13.406 10.969 -1.835 1.00 1.00 N ATOM 0 H ASN A 81 -13.430 7.487 -3.613 1.00 1.00 H new ATOM 0 HA ASN A 81 -14.401 8.955 -1.291 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -13.933 9.212 -4.135 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -15.623 9.595 -3.870 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -13.134 11.877 -1.458 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -13.015 10.114 -1.439 1.00 1.00 H new ATOM 1289 N ILE A 82 -16.522 7.052 -2.887 1.00 1.00 N ATOM 1290 CA ILE A 82 -17.888 6.473 -2.764 1.00 1.00 C ATOM 1291 C ILE A 82 -17.805 5.115 -2.068 1.00 1.00 C ATOM 1292 O ILE A 82 -18.673 4.741 -1.302 1.00 1.00 O ATOM 1293 CB ILE A 82 -18.385 6.314 -4.201 1.00 1.00 C ATOM 1294 CG1 ILE A 82 -18.233 7.644 -4.944 1.00 1.00 C ATOM 1295 CG2 ILE A 82 -19.859 5.906 -4.190 1.00 1.00 C ATOM 1296 CD1 ILE A 82 -19.524 7.956 -5.701 1.00 1.00 C ATOM 0 H ILE A 82 -15.957 6.669 -3.645 1.00 1.00 H new ATOM 0 HA ILE A 82 -18.559 7.099 -2.176 1.00 1.00 H new ATOM 0 HB ILE A 82 -17.798 5.546 -4.704 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -18.011 8.444 -4.238 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -17.395 7.591 -5.639 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -20.213 5.793 -5.215 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -19.971 4.960 -3.661 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -20.445 6.674 -3.686 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -19.416 8.903 -6.230 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -19.726 7.161 -6.418 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -20.352 8.027 -4.995 1.00 1.00 H new ATOM 1308 N ALA A 83 -16.760 4.376 -2.324 1.00 1.00 N ATOM 1309 CA ALA A 83 -16.611 3.044 -1.675 1.00 1.00 C ATOM 1310 C ALA A 83 -16.482 3.214 -0.159 1.00 1.00 C ATOM 1311 O ALA A 83 -17.265 2.682 0.601 1.00 1.00 O ATOM 1312 CB ALA A 83 -15.329 2.457 -2.263 1.00 1.00 C ATOM 0 H ALA A 83 -16.003 4.638 -2.955 1.00 1.00 H new ATOM 0 HA ALA A 83 -17.470 2.396 -1.852 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -15.149 1.472 -1.833 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -15.432 2.367 -3.344 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -14.489 3.112 -2.032 1.00 1.00 H new ATOM 1318 N LYS A 84 -15.499 3.951 0.288 1.00 1.00 N ATOM 1319 CA LYS A 84 -15.329 4.148 1.755 1.00 1.00 C ATOM 1320 C LYS A 84 -16.585 4.789 2.350 1.00 1.00 C ATOM 1321 O LYS A 84 -16.931 4.555 3.491 1.00 1.00 O ATOM 1322 CB LYS A 84 -14.130 5.086 1.893 1.00 1.00 C ATOM 1323 CG LYS A 84 -13.187 4.555 2.974 1.00 1.00 C ATOM 1324 CD LYS A 84 -11.804 5.186 2.801 1.00 1.00 C ATOM 1325 CE LYS A 84 -11.205 5.492 4.175 1.00 1.00 C ATOM 1326 NZ LYS A 84 -10.564 6.827 4.024 1.00 1.00 N ATOM 0 H LYS A 84 -14.810 4.423 -0.298 1.00 1.00 H new ATOM 0 HA LYS A 84 -15.172 3.208 2.283 1.00 1.00 H new ATOM 0 HB2 LYS A 84 -13.603 5.162 0.942 1.00 1.00 H new ATOM 0 HB3 LYS A 84 -14.468 6.090 2.152 1.00 1.00 H new ATOM 0 HG2 LYS A 84 -13.583 4.787 3.963 1.00 1.00 H new ATOM 0 HG3 LYS A 84 -13.114 3.470 2.906 1.00 1.00 H new ATOM 0 HD2 LYS A 84 -11.150 4.509 2.251 1.00 1.00 H new ATOM 0 HD3 LYS A 84 -11.881 6.102 2.215 1.00 1.00 H new ATOM 0 HE2 LYS A 84 -11.974 5.508 4.947 1.00 1.00 H new ATOM 0 HE3 LYS A 84 -10.477 4.735 4.466 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 -10.130 7.108 4.926 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 -9.832 6.779 3.287 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 -11.282 7.528 3.753 1.00 1.00 H new ATOM 1339 N GLN A 85 -17.274 5.593 1.589 1.00 1.00 N ATOM 1340 CA GLN A 85 -18.507 6.239 2.119 1.00 1.00 C ATOM 1341 C GLN A 85 -19.614 5.195 2.272 1.00 1.00 C ATOM 1342 O GLN A 85 -20.492 5.322 3.102 1.00 1.00 O ATOM 1343 CB GLN A 85 -18.891 7.285 1.075 1.00 1.00 C ATOM 1344 CG GLN A 85 -20.127 8.051 1.548 1.00 1.00 C ATOM 1345 CD GLN A 85 -21.338 7.632 0.714 1.00 1.00 C ATOM 1346 OE1 GLN A 85 -22.433 7.515 1.226 1.00 1.00 O ATOM 1347 NE2 GLN A 85 -21.188 7.400 -0.561 1.00 1.00 N ATOM 0 H GLN A 85 -17.038 5.830 0.626 1.00 1.00 H new ATOM 0 HA GLN A 85 -18.353 6.689 3.100 1.00 1.00 H new ATOM 0 HB2 GLN A 85 -18.062 7.975 0.915 1.00 1.00 H new ATOM 0 HB3 GLN A 85 -19.094 6.802 0.119 1.00 1.00 H new ATOM 0 HG2 GLN A 85 -20.311 7.849 2.603 1.00 1.00 H new ATOM 0 HG3 GLN A 85 -19.961 9.124 1.453 1.00 1.00 H new ATOM 0 HE21 GLN A 85 -20.269 7.498 -0.993 1.00 1.00 H new ATOM 0 HE22 GLN A 85 -21.990 7.121 -1.126 1.00 1.00 H new ATOM 1356 N LEU A 86 -19.567 4.156 1.486 1.00 1.00 N ATOM 1357 CA LEU A 86 -20.606 3.094 1.596 1.00 1.00 C ATOM 1358 C LEU A 86 -20.174 2.065 2.642 1.00 1.00 C ATOM 1359 O LEU A 86 -20.971 1.589 3.427 1.00 1.00 O ATOM 1360 CB LEU A 86 -20.677 2.459 0.210 1.00 1.00 C ATOM 1361 CG LEU A 86 -22.141 2.248 -0.179 1.00 1.00 C ATOM 1362 CD1 LEU A 86 -22.273 2.256 -1.704 1.00 1.00 C ATOM 1363 CD2 LEU A 86 -22.626 0.902 0.366 1.00 1.00 C ATOM 0 H LEU A 86 -18.855 3.996 0.773 1.00 1.00 H new ATOM 0 HA LEU A 86 -21.575 3.484 1.906 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -20.184 3.100 -0.521 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -20.148 1.506 0.207 1.00 1.00 H new ATOM 0 HG LEU A 86 -22.746 3.051 0.242 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -23.317 2.106 -1.980 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -21.929 3.214 -2.094 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -21.667 1.454 -2.126 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -23.669 0.752 0.089 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -22.020 0.100 -0.054 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -22.535 0.895 1.452 1.00 1.00 H new ATOM 1375 N ALA A 87 -18.916 1.722 2.657 1.00 1.00 N ATOM 1376 CA ALA A 87 -18.424 0.726 3.651 1.00 1.00 C ATOM 1377 C ALA A 87 -18.041 1.424 4.960 1.00 1.00 C ATOM 1378 O ALA A 87 -18.582 1.135 6.008 1.00 1.00 O ATOM 1379 CB ALA A 87 -17.192 0.094 3.002 1.00 1.00 C ATOM 0 H ALA A 87 -18.206 2.089 2.023 1.00 1.00 H new ATOM 0 HA ALA A 87 -19.182 -0.017 3.899 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -16.770 -0.653 3.674 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -17.479 -0.382 2.064 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -16.448 0.866 2.805 1.00 1.00 H new ATOM 1385 N GLU A 88 -17.108 2.337 4.910 1.00 1.00 N ATOM 1386 CA GLU A 88 -16.685 3.046 6.147 1.00 1.00 C ATOM 1387 C GLU A 88 -17.877 3.259 7.080 1.00 1.00 C ATOM 1388 O GLU A 88 -17.721 3.395 8.277 1.00 1.00 O ATOM 1389 CB GLU A 88 -16.135 4.381 5.658 1.00 1.00 C ATOM 1390 CG GLU A 88 -17.166 5.484 5.908 1.00 1.00 C ATOM 1391 CD GLU A 88 -16.446 6.785 6.271 1.00 1.00 C ATOM 1392 OE1 GLU A 88 -15.356 6.997 5.765 1.00 1.00 O ATOM 1393 OE2 GLU A 88 -16.997 7.546 7.048 1.00 1.00 O ATOM 0 H GLU A 88 -16.620 2.622 4.061 1.00 1.00 H new ATOM 0 HA GLU A 88 -15.947 2.481 6.716 1.00 1.00 H new ATOM 0 HB2 GLU A 88 -15.205 4.614 6.176 1.00 1.00 H new ATOM 0 HB3 GLU A 88 -15.901 4.322 4.595 1.00 1.00 H new ATOM 0 HG2 GLU A 88 -17.779 5.631 5.019 1.00 1.00 H new ATOM 0 HG3 GLU A 88 -17.839 5.191 6.714 1.00 1.00 H new ATOM 1400 N LYS A 89 -19.068 3.278 6.549 1.00 1.00 N ATOM 1401 CA LYS A 89 -20.259 3.467 7.421 1.00 1.00 C ATOM 1402 C LYS A 89 -20.449 2.232 8.302 1.00 1.00 C ATOM 1403 O LYS A 89 -19.808 2.079 9.323 1.00 1.00 O ATOM 1404 CB LYS A 89 -21.438 3.631 6.459 1.00 1.00 C ATOM 1405 CG LYS A 89 -22.705 3.068 7.106 1.00 1.00 C ATOM 1406 CD LYS A 89 -23.841 4.085 6.977 1.00 1.00 C ATOM 1407 CE LYS A 89 -23.341 5.468 7.403 1.00 1.00 C ATOM 1408 NZ LYS A 89 -22.667 6.020 6.196 1.00 1.00 N ATOM 0 H LYS A 89 -19.267 3.171 5.554 1.00 1.00 H new ATOM 0 HA LYS A 89 -20.161 4.327 8.084 1.00 1.00 H new ATOM 0 HB2 LYS A 89 -21.578 4.684 6.215 1.00 1.00 H new ATOM 0 HB3 LYS A 89 -21.233 3.111 5.523 1.00 1.00 H new ATOM 0 HG2 LYS A 89 -22.986 2.131 6.625 1.00 1.00 H new ATOM 0 HG3 LYS A 89 -22.521 2.844 8.157 1.00 1.00 H new ATOM 0 HD2 LYS A 89 -24.199 4.117 5.948 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -24.684 3.784 7.599 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -24.166 6.106 7.721 1.00 1.00 H new ATOM 0 HE3 LYS A 89 -22.650 5.397 8.243 1.00 1.00 H new ATOM 0 HZ1 LYS A 89 -21.661 6.183 6.404 1.00 1.00 H new ATOM 0 HZ2 LYS A 89 -22.753 5.344 5.411 1.00 1.00 H new ATOM 0 HZ3 LYS A 89 -23.116 6.919 5.929 1.00 1.00 H new ATOM 1421 N PHE A 90 -21.320 1.346 7.907 1.00 1.00 N ATOM 1422 CA PHE A 90 -21.548 0.111 8.711 1.00 1.00 C ATOM 1423 C PHE A 90 -20.993 -1.108 7.969 1.00 1.00 C ATOM 1424 O PHE A 90 -21.116 -2.230 8.418 1.00 1.00 O ATOM 1425 CB PHE A 90 -23.066 0.008 8.858 1.00 1.00 C ATOM 1426 CG PHE A 90 -23.405 -0.397 10.272 1.00 1.00 C ATOM 1427 CD1 PHE A 90 -23.353 0.549 11.302 1.00 1.00 C ATOM 1428 CD2 PHE A 90 -23.770 -1.720 10.552 1.00 1.00 C ATOM 1429 CE1 PHE A 90 -23.666 0.174 12.613 1.00 1.00 C ATOM 1430 CE2 PHE A 90 -24.082 -2.095 11.864 1.00 1.00 C ATOM 1431 CZ PHE A 90 -24.031 -1.149 12.895 1.00 1.00 C ATOM 0 H PHE A 90 -21.885 1.423 7.061 1.00 1.00 H new ATOM 0 HA PHE A 90 -21.049 0.148 9.679 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -23.531 0.965 8.620 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -23.462 -0.723 8.153 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -23.071 1.569 11.085 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -23.811 -2.450 9.757 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -23.626 0.904 13.408 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -24.362 -3.115 12.081 1.00 1.00 H new ATOM 0 HZ PHE A 90 -24.273 -1.439 13.907 1.00 1.00 H new ATOM 1441 N SER A 91 -20.391 -0.896 6.830 1.00 1.00 N ATOM 1442 CA SER A 91 -19.836 -2.039 6.054 1.00 1.00 C ATOM 1443 C SER A 91 -18.548 -2.555 6.700 1.00 1.00 C ATOM 1444 O SER A 91 -18.529 -3.598 7.322 1.00 1.00 O ATOM 1445 CB SER A 91 -19.547 -1.470 4.666 1.00 1.00 C ATOM 1446 OG SER A 91 -20.590 -0.579 4.297 1.00 1.00 O ATOM 0 H SER A 91 -20.260 0.021 6.404 1.00 1.00 H new ATOM 0 HA SER A 91 -20.526 -2.882 6.018 1.00 1.00 H new ATOM 0 HB2 SER A 91 -18.590 -0.948 4.667 1.00 1.00 H new ATOM 0 HB3 SER A 91 -19.469 -2.278 3.938 1.00 1.00 H new ATOM 0 HG SER A 91 -20.299 0.345 4.446 1.00 1.00 H new ATOM 1452 N VAL A 92 -17.468 -1.834 6.557 1.00 1.00 N ATOM 1453 CA VAL A 92 -16.183 -2.285 7.163 1.00 1.00 C ATOM 1454 C VAL A 92 -15.687 -1.253 8.180 1.00 1.00 C ATOM 1455 O VAL A 92 -14.570 -1.322 8.654 1.00 1.00 O ATOM 1456 CB VAL A 92 -15.208 -2.394 5.991 1.00 1.00 C ATOM 1457 CG1 VAL A 92 -14.764 -3.849 5.830 1.00 1.00 C ATOM 1458 CG2 VAL A 92 -15.900 -1.928 4.708 1.00 1.00 C ATOM 0 H VAL A 92 -17.421 -0.952 6.047 1.00 1.00 H new ATOM 0 HA VAL A 92 -16.287 -3.231 7.695 1.00 1.00 H new ATOM 0 HB VAL A 92 -14.337 -1.768 6.184 1.00 1.00 H new ATOM 0 HG11 VAL A 92 -14.069 -3.927 4.994 1.00 1.00 H new ATOM 0 HG12 VAL A 92 -14.272 -4.182 6.744 1.00 1.00 H new ATOM 0 HG13 VAL A 92 -15.635 -4.476 5.637 1.00 1.00 H new ATOM 0 HG21 VAL A 92 -15.206 -2.005 3.871 1.00 1.00 H new ATOM 0 HG22 VAL A 92 -16.771 -2.555 4.516 1.00 1.00 H new ATOM 0 HG23 VAL A 92 -16.217 -0.891 4.822 1.00 1.00 H new ATOM 1468 N TYR A 93 -16.508 -0.298 8.518 1.00 1.00 N ATOM 1469 CA TYR A 93 -16.083 0.736 9.505 1.00 1.00 C ATOM 1470 C TYR A 93 -15.266 0.091 10.627 1.00 1.00 C ATOM 1471 O TYR A 93 -14.403 0.711 11.218 1.00 1.00 O ATOM 1472 CB TYR A 93 -17.385 1.317 10.054 1.00 1.00 C ATOM 1473 CG TYR A 93 -17.498 0.998 11.525 1.00 1.00 C ATOM 1474 CD1 TYR A 93 -16.517 1.451 12.416 1.00 1.00 C ATOM 1475 CD2 TYR A 93 -18.582 0.249 11.999 1.00 1.00 C ATOM 1476 CE1 TYR A 93 -16.621 1.154 13.780 1.00 1.00 C ATOM 1477 CE2 TYR A 93 -18.686 -0.046 13.363 1.00 1.00 C ATOM 1478 CZ TYR A 93 -17.705 0.407 14.254 1.00 1.00 C ATOM 1479 OH TYR A 93 -17.807 0.115 15.599 1.00 1.00 O ATOM 0 H TYR A 93 -17.455 -0.188 8.154 1.00 1.00 H new ATOM 0 HA TYR A 93 -15.453 1.503 9.055 1.00 1.00 H new ATOM 0 HB2 TYR A 93 -17.406 2.396 9.902 1.00 1.00 H new ATOM 0 HB3 TYR A 93 -18.237 0.902 9.515 1.00 1.00 H new ATOM 0 HD1 TYR A 93 -15.681 2.029 12.051 1.00 1.00 H new ATOM 0 HD2 TYR A 93 -19.338 -0.101 11.312 1.00 1.00 H new ATOM 0 HE1 TYR A 93 -15.864 1.502 14.467 1.00 1.00 H new ATOM 0 HE2 TYR A 93 -19.523 -0.623 13.729 1.00 1.00 H new ATOM 0 HH TYR A 93 -18.619 -0.410 15.759 1.00 1.00 H new ATOM 1489 N ASP A 94 -15.528 -1.153 10.925 1.00 1.00 N ATOM 1490 CA ASP A 94 -14.765 -1.838 12.007 1.00 1.00 C ATOM 1491 C ASP A 94 -13.526 -2.526 11.427 1.00 1.00 C ATOM 1492 O ASP A 94 -12.411 -2.266 11.836 1.00 1.00 O ATOM 1493 CB ASP A 94 -15.734 -2.875 12.579 1.00 1.00 C ATOM 1494 CG ASP A 94 -14.943 -4.052 13.152 1.00 1.00 C ATOM 1495 OD1 ASP A 94 -13.734 -4.065 12.986 1.00 1.00 O ATOM 1496 OD2 ASP A 94 -15.559 -4.921 13.746 1.00 1.00 O ATOM 0 H ASP A 94 -16.237 -1.724 10.466 1.00 1.00 H new ATOM 0 HA ASP A 94 -14.415 -1.142 12.769 1.00 1.00 H new ATOM 0 HB2 ASP A 94 -16.349 -2.423 13.357 1.00 1.00 H new ATOM 0 HB3 ASP A 94 -16.412 -3.224 11.800 1.00 1.00 H new ATOM 1501 N GLN A 95 -13.712 -3.404 10.480 1.00 1.00 N ATOM 1502 CA GLN A 95 -12.547 -4.112 9.875 1.00 1.00 C ATOM 1503 C GLN A 95 -11.511 -3.104 9.368 1.00 1.00 C ATOM 1504 O GLN A 95 -10.367 -3.118 9.776 1.00 1.00 O ATOM 1505 CB GLN A 95 -13.134 -4.906 8.709 1.00 1.00 C ATOM 1506 CG GLN A 95 -13.090 -6.400 9.035 1.00 1.00 C ATOM 1507 CD GLN A 95 -14.494 -6.882 9.402 1.00 1.00 C ATOM 1508 OE1 GLN A 95 -14.867 -7.996 9.092 1.00 1.00 O ATOM 1509 NE2 GLN A 95 -15.294 -6.083 10.054 1.00 1.00 N ATOM 0 H GLN A 95 -14.622 -3.662 10.098 1.00 1.00 H new ATOM 0 HA GLN A 95 -12.036 -4.752 10.594 1.00 1.00 H new ATOM 0 HB2 GLN A 95 -14.162 -4.594 8.523 1.00 1.00 H new ATOM 0 HB3 GLN A 95 -12.570 -4.705 7.798 1.00 1.00 H new ATOM 0 HG2 GLN A 95 -12.714 -6.959 8.178 1.00 1.00 H new ATOM 0 HG3 GLN A 95 -12.403 -6.583 9.861 1.00 1.00 H new ATOM 0 HE21 GLN A 95 -14.980 -5.148 10.314 1.00 1.00 H new ATOM 0 HE22 GLN A 95 -16.233 -6.394 10.304 1.00 1.00 H new ATOM 1518 N LEU A 96 -11.904 -2.232 8.480 1.00 1.00 N ATOM 1519 CA LEU A 96 -10.937 -1.228 7.948 1.00 1.00 C ATOM 1520 C LEU A 96 -10.699 -0.123 8.978 1.00 1.00 C ATOM 1521 O LEU A 96 -10.488 1.024 8.633 1.00 1.00 O ATOM 1522 CB LEU A 96 -11.603 -0.658 6.696 1.00 1.00 C ATOM 1523 CG LEU A 96 -11.718 -1.751 5.632 1.00 1.00 C ATOM 1524 CD1 LEU A 96 -12.858 -2.702 5.997 1.00 1.00 C ATOM 1525 CD2 LEU A 96 -12.005 -1.109 4.273 1.00 1.00 C ATOM 0 H LEU A 96 -12.849 -2.171 8.101 1.00 1.00 H new ATOM 0 HA LEU A 96 -9.966 -1.670 7.727 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -12.592 -0.271 6.942 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -11.020 0.179 6.311 1.00 1.00 H new ATOM 0 HG LEU A 96 -10.783 -2.309 5.582 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -12.939 -3.480 5.238 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -12.655 -3.159 6.966 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -13.794 -2.146 6.048 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -12.087 -1.886 3.513 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -12.940 -0.551 4.324 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -11.192 -0.431 4.012 1.00 1.00 H new ATOM 1537 N LYS A 97 -10.727 -0.454 10.240 1.00 1.00 N ATOM 1538 CA LYS A 97 -10.497 0.585 11.283 1.00 1.00 C ATOM 1539 C LYS A 97 -9.147 1.267 11.048 1.00 1.00 C ATOM 1540 O LYS A 97 -9.026 2.470 11.177 1.00 1.00 O ATOM 1541 CB LYS A 97 -10.493 -0.176 12.610 1.00 1.00 C ATOM 1542 CG LYS A 97 -11.841 0.010 13.310 1.00 1.00 C ATOM 1543 CD LYS A 97 -12.131 -1.206 14.190 1.00 1.00 C ATOM 1544 CE LYS A 97 -13.629 -1.267 14.502 1.00 1.00 C ATOM 1545 NZ LYS A 97 -13.721 -1.080 15.977 1.00 1.00 N ATOM 0 H LYS A 97 -10.899 -1.395 10.593 1.00 1.00 H new ATOM 0 HA LYS A 97 -11.258 1.365 11.268 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -10.306 -1.235 12.433 1.00 1.00 H new ATOM 0 HB3 LYS A 97 -9.687 0.188 13.247 1.00 1.00 H new ATOM 0 HG2 LYS A 97 -11.826 0.916 13.916 1.00 1.00 H new ATOM 0 HG3 LYS A 97 -12.632 0.134 12.571 1.00 1.00 H new ATOM 0 HD2 LYS A 97 -11.817 -2.118 13.683 1.00 1.00 H new ATOM 0 HD3 LYS A 97 -11.559 -1.143 15.115 1.00 1.00 H new ATOM 0 HE2 LYS A 97 -14.175 -0.488 13.970 1.00 1.00 H new ATOM 0 HE3 LYS A 97 -14.058 -2.222 14.197 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 -14.719 -1.110 16.269 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 -13.197 -1.840 16.457 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 -13.311 -0.160 16.236 1.00 1.00 H new ATOM 1558 N PRO A 98 -8.176 0.467 10.706 1.00 1.00 N ATOM 1559 CA PRO A 98 -6.814 0.992 10.442 1.00 1.00 C ATOM 1560 C PRO A 98 -6.797 1.796 9.137 1.00 1.00 C ATOM 1561 O PRO A 98 -6.447 2.959 9.120 1.00 1.00 O ATOM 1562 CB PRO A 98 -5.955 -0.264 10.315 1.00 1.00 C ATOM 1563 CG PRO A 98 -6.908 -1.369 9.982 1.00 1.00 C ATOM 1564 CD PRO A 98 -8.255 -0.987 10.537 1.00 1.00 C ATOM 0 HA PRO A 98 -6.459 1.665 11.223 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -5.202 -0.147 9.536 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -5.423 -0.471 11.244 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -6.965 -1.514 8.903 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -6.569 -2.311 10.413 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -9.060 -1.266 9.856 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -8.452 -1.488 11.485 1.00 1.00 H new ATOM 1572 N LEU A 99 -7.173 1.185 8.046 1.00 1.00 N ATOM 1573 CA LEU A 99 -7.177 1.917 6.746 1.00 1.00 C ATOM 1574 C LEU A 99 -7.992 3.206 6.867 1.00 1.00 C ATOM 1575 O LEU A 99 -7.699 4.200 6.231 1.00 1.00 O ATOM 1576 CB LEU A 99 -7.836 0.957 5.754 1.00 1.00 C ATOM 1577 CG LEU A 99 -9.082 1.614 5.159 1.00 1.00 C ATOM 1578 CD1 LEU A 99 -8.665 2.626 4.089 1.00 1.00 C ATOM 1579 CD2 LEU A 99 -9.969 0.540 4.525 1.00 1.00 C ATOM 0 H LEU A 99 -7.477 0.213 7.998 1.00 1.00 H new ATOM 0 HA LEU A 99 -6.174 2.205 6.431 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -7.134 0.699 4.961 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -8.106 0.028 6.256 1.00 1.00 H new ATOM 0 HG LEU A 99 -9.634 2.126 5.947 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -9.553 3.094 3.665 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -8.031 3.391 4.539 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -8.113 2.115 3.300 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -10.858 1.006 4.100 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -9.415 0.029 3.737 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -10.266 -0.182 5.286 1.00 1.00 H new ATOM 1591 N PHE A 100 -9.011 3.198 7.681 1.00 1.00 N ATOM 1592 CA PHE A 100 -9.842 4.425 7.848 1.00 1.00 C ATOM 1593 C PHE A 100 -9.290 5.282 8.990 1.00 1.00 C ATOM 1594 O PHE A 100 -9.518 6.474 9.051 1.00 1.00 O ATOM 1595 CB PHE A 100 -11.241 3.914 8.188 1.00 1.00 C ATOM 1596 CG PHE A 100 -11.842 3.244 6.974 1.00 1.00 C ATOM 1597 CD1 PHE A 100 -11.143 3.239 5.762 1.00 1.00 C ATOM 1598 CD2 PHE A 100 -13.095 2.629 7.064 1.00 1.00 C ATOM 1599 CE1 PHE A 100 -11.700 2.618 4.636 1.00 1.00 C ATOM 1600 CE2 PHE A 100 -13.651 2.007 5.939 1.00 1.00 C ATOM 1601 CZ PHE A 100 -12.953 2.002 4.726 1.00 1.00 C ATOM 0 H PHE A 100 -9.305 2.396 8.238 1.00 1.00 H new ATOM 0 HA PHE A 100 -9.844 5.049 6.954 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -11.190 3.209 9.018 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -11.873 4.741 8.510 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -10.175 3.713 5.694 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -13.633 2.634 8.000 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -11.162 2.615 3.699 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -14.618 1.531 6.008 1.00 1.00 H new ATOM 0 HZ PHE A 100 -13.382 1.522 3.859 1.00 1.00 H new ATOM 1611 N ASP A 101 -8.571 4.681 9.898 1.00 1.00 N ATOM 1612 CA ASP A 101 -8.008 5.456 11.040 1.00 1.00 C ATOM 1613 C ASP A 101 -6.617 5.991 10.690 1.00 1.00 C ATOM 1614 O ASP A 101 -6.061 6.809 11.397 1.00 1.00 O ATOM 1615 CB ASP A 101 -7.923 4.454 12.192 1.00 1.00 C ATOM 1616 CG ASP A 101 -9.246 4.448 12.961 1.00 1.00 C ATOM 1617 OD1 ASP A 101 -9.767 5.521 13.214 1.00 1.00 O ATOM 1618 OD2 ASP A 101 -9.716 3.369 13.282 1.00 1.00 O ATOM 0 H ASP A 101 -8.349 3.685 9.898 1.00 1.00 H new ATOM 0 HA ASP A 101 -8.622 6.320 11.293 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -7.710 3.457 11.806 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -7.103 4.720 12.859 1.00 1.00 H new ATOM 1805 N LYS A 116 9.894 0.924 1.563 1.00 1.00 N ATOM 1806 CA LYS A 116 10.682 1.176 0.322 1.00 1.00 C ATOM 1807 C LYS A 116 11.184 -0.146 -0.264 1.00 1.00 C ATOM 1808 O LYS A 116 12.301 -0.558 -0.024 1.00 1.00 O ATOM 1809 CB LYS A 116 11.857 2.044 0.770 1.00 1.00 C ATOM 1810 CG LYS A 116 12.169 3.078 -0.314 1.00 1.00 C ATOM 1811 CD LYS A 116 10.862 3.655 -0.861 1.00 1.00 C ATOM 1812 CE LYS A 116 11.160 4.916 -1.673 1.00 1.00 C ATOM 1813 NZ LYS A 116 9.870 5.265 -2.329 1.00 1.00 N ATOM 0 HA LYS A 116 10.088 1.661 -0.453 1.00 1.00 H new ATOM 0 HB2 LYS A 116 11.616 2.545 1.707 1.00 1.00 H new ATOM 0 HB3 LYS A 116 12.732 1.422 0.957 1.00 1.00 H new ATOM 0 HG2 LYS A 116 12.787 3.876 0.097 1.00 1.00 H new ATOM 0 HG3 LYS A 116 12.740 2.615 -1.119 1.00 1.00 H new ATOM 0 HD2 LYS A 116 10.360 2.917 -1.487 1.00 1.00 H new ATOM 0 HD3 LYS A 116 10.184 3.890 -0.040 1.00 1.00 H new ATOM 0 HE2 LYS A 116 11.508 5.725 -1.031 1.00 1.00 H new ATOM 0 HE3 LYS A 116 11.942 4.735 -2.411 1.00 1.00 H new ATOM 0 HZ1 LYS A 116 9.994 6.122 -2.905 1.00 1.00 H new ATOM 0 HZ2 LYS A 116 9.567 4.479 -2.938 1.00 1.00 H new ATOM 0 HZ3 LYS A 116 9.147 5.439 -1.602 1.00 1.00 H new ATOM 1826 N HIS A 117 10.367 -0.811 -1.033 1.00 1.00 N ATOM 1827 CA HIS A 117 10.801 -2.104 -1.636 1.00 1.00 C ATOM 1828 C HIS A 117 10.653 -2.051 -3.159 1.00 1.00 C ATOM 1829 O HIS A 117 9.588 -1.782 -3.679 1.00 1.00 O ATOM 1830 CB HIS A 117 9.862 -3.154 -1.041 1.00 1.00 C ATOM 1831 CG HIS A 117 8.531 -3.088 -1.738 1.00 1.00 C ATOM 1832 ND1 HIS A 117 7.624 -2.067 -1.506 1.00 1.00 N ATOM 1833 CD2 HIS A 117 7.940 -3.911 -2.666 1.00 1.00 C ATOM 1834 CE1 HIS A 117 6.546 -2.298 -2.277 1.00 1.00 C ATOM 1835 NE2 HIS A 117 6.686 -3.410 -3.004 1.00 1.00 N ATOM 0 H HIS A 117 9.420 -0.517 -1.270 1.00 1.00 H new ATOM 0 HA HIS A 117 11.847 -2.328 -1.426 1.00 1.00 H new ATOM 0 HB2 HIS A 117 10.294 -4.149 -1.152 1.00 1.00 H new ATOM 0 HB3 HIS A 117 9.734 -2.980 0.027 1.00 1.00 H new ATOM 0 HD2 HIS A 117 8.381 -4.810 -3.071 1.00 1.00 H new ATOM 0 HE1 HIS A 117 5.674 -1.662 -2.305 1.00 1.00 H new ATOM 0 HE2 HIS A 117 6.018 -3.807 -3.665 1.00 1.00 H new ATOM 1843 N HIS A 118 11.712 -2.304 -3.877 1.00 1.00 N ATOM 1844 CA HIS A 118 11.629 -2.267 -5.365 1.00 1.00 C ATOM 1845 C HIS A 118 10.509 -3.189 -5.854 1.00 1.00 C ATOM 1846 O HIS A 118 10.292 -4.257 -5.317 1.00 1.00 O ATOM 1847 CB HIS A 118 12.989 -2.770 -5.850 1.00 1.00 C ATOM 1848 CG HIS A 118 14.013 -1.679 -5.697 1.00 1.00 C ATOM 1849 ND1 HIS A 118 14.911 -1.649 -4.641 1.00 1.00 N ATOM 1850 CD2 HIS A 118 14.295 -0.572 -6.460 1.00 1.00 C ATOM 1851 CE1 HIS A 118 15.683 -0.559 -4.796 1.00 1.00 C ATOM 1852 NE2 HIS A 118 15.350 0.134 -5.889 1.00 1.00 N ATOM 0 H HIS A 118 12.631 -2.535 -3.499 1.00 1.00 H new ATOM 0 HA HIS A 118 11.406 -1.269 -5.742 1.00 1.00 H new ATOM 0 HB2 HIS A 118 13.289 -3.647 -5.277 1.00 1.00 H new ATOM 0 HB3 HIS A 118 12.923 -3.078 -6.894 1.00 1.00 H new ATOM 0 HD2 HIS A 118 13.777 -0.292 -7.365 1.00 1.00 H new ATOM 0 HE1 HIS A 118 16.476 -0.278 -4.119 1.00 1.00 H new ATOM 0 HE2 HIS A 118 15.777 0.995 -6.231 1.00 1.00 H new ATOM 1860 N HIS A 119 9.794 -2.785 -6.869 1.00 1.00 N ATOM 1861 CA HIS A 119 8.689 -3.639 -7.390 1.00 1.00 C ATOM 1862 C HIS A 119 9.257 -4.929 -7.989 1.00 1.00 C ATOM 1863 O HIS A 119 9.873 -4.920 -9.037 1.00 1.00 O ATOM 1864 CB HIS A 119 8.014 -2.798 -8.472 1.00 1.00 C ATOM 1865 CG HIS A 119 8.563 -1.399 -8.438 1.00 1.00 C ATOM 1866 ND1 HIS A 119 9.785 -1.071 -9.003 1.00 1.00 N ATOM 1867 CD2 HIS A 119 8.069 -0.232 -7.910 1.00 1.00 C ATOM 1868 CE1 HIS A 119 9.983 0.246 -8.804 1.00 1.00 C ATOM 1869 NE2 HIS A 119 8.967 0.805 -8.141 1.00 1.00 N ATOM 0 H HIS A 119 9.927 -1.901 -7.360 1.00 1.00 H new ATOM 0 HA HIS A 119 7.989 -3.932 -6.607 1.00 1.00 H new ATOM 0 HB2 HIS A 119 8.185 -3.243 -9.452 1.00 1.00 H new ATOM 0 HB3 HIS A 119 6.936 -2.780 -8.314 1.00 1.00 H new ATOM 0 HD2 HIS A 119 7.126 -0.134 -7.393 1.00 1.00 H new ATOM 0 HE1 HIS A 119 10.857 0.785 -9.140 1.00 1.00 H new ATOM 0 HE2 HIS A 119 8.870 1.782 -7.864 1.00 1.00 H new ATOM 1877 N ALA A 120 9.053 -6.039 -7.334 1.00 1.00 N ATOM 1878 CA ALA A 120 9.579 -7.327 -7.869 1.00 1.00 C ATOM 1879 C ALA A 120 9.624 -7.283 -9.400 1.00 1.00 C ATOM 1880 O ALA A 120 8.689 -6.853 -10.045 1.00 1.00 O ATOM 1881 CB ALA A 120 8.589 -8.389 -7.392 1.00 1.00 C ATOM 0 H ALA A 120 8.545 -6.110 -6.452 1.00 1.00 H new ATOM 0 HA ALA A 120 10.593 -7.534 -7.526 1.00 1.00 H new ATOM 0 HB1 ALA A 120 8.908 -9.369 -7.747 1.00 1.00 H new ATOM 0 HB2 ALA A 120 8.554 -8.391 -6.303 1.00 1.00 H new ATOM 0 HB3 ALA A 120 7.598 -8.165 -7.786 1.00 1.00 H new ATOM 1887 N SER A 121 10.704 -7.723 -9.984 1.00 1.00 N ATOM 1888 CA SER A 121 10.806 -7.706 -11.472 1.00 1.00 C ATOM 1889 C SER A 121 10.396 -9.066 -12.044 1.00 1.00 C ATOM 1890 O SER A 121 11.166 -10.007 -12.045 1.00 1.00 O ATOM 1891 CB SER A 121 12.279 -7.422 -11.765 1.00 1.00 C ATOM 1892 OG SER A 121 12.836 -6.677 -10.690 1.00 1.00 O ATOM 0 H SER A 121 11.520 -8.093 -9.497 1.00 1.00 H new ATOM 0 HA SER A 121 10.151 -6.961 -11.923 1.00 1.00 H new ATOM 0 HB2 SER A 121 12.823 -8.358 -11.895 1.00 1.00 H new ATOM 0 HB3 SER A 121 12.376 -6.865 -12.697 1.00 1.00 H new ATOM 0 HG SER A 121 13.781 -6.494 -10.874 1.00 1.00 H new ATOM 1898 N LYS A 122 9.191 -9.177 -12.530 1.00 1.00 N ATOM 1899 CA LYS A 122 8.734 -10.477 -13.099 1.00 1.00 C ATOM 1900 C LYS A 122 8.769 -10.427 -14.630 1.00 1.00 C ATOM 1901 O LYS A 122 7.814 -10.034 -15.269 1.00 1.00 O ATOM 1902 CB LYS A 122 7.299 -10.646 -12.601 1.00 1.00 C ATOM 1903 CG LYS A 122 7.182 -11.954 -11.815 1.00 1.00 C ATOM 1904 CD LYS A 122 7.182 -11.651 -10.317 1.00 1.00 C ATOM 1905 CE LYS A 122 7.794 -12.829 -9.557 1.00 1.00 C ATOM 1906 NZ LYS A 122 8.971 -13.242 -10.371 1.00 1.00 N ATOM 0 H LYS A 122 8.503 -8.425 -12.558 1.00 1.00 H new ATOM 0 HA LYS A 122 9.371 -11.307 -12.794 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.021 -9.803 -11.968 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.609 -10.653 -13.444 1.00 1.00 H new ATOM 0 HG2 LYS A 122 6.266 -12.476 -12.091 1.00 1.00 H new ATOM 0 HG3 LYS A 122 8.012 -12.615 -12.063 1.00 1.00 H new ATOM 0 HD2 LYS A 122 7.751 -10.742 -10.119 1.00 1.00 H new ATOM 0 HD3 LYS A 122 6.164 -11.471 -9.972 1.00 1.00 H new ATOM 0 HE2 LYS A 122 8.093 -12.537 -8.550 1.00 1.00 H new ATOM 0 HE3 LYS A 122 7.080 -13.646 -9.453 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 9.708 -13.626 -9.746 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 8.682 -13.971 -11.054 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 9.346 -12.418 -10.882 1.00 1.00 H new ATOM 1919 N VAL A 123 9.863 -10.824 -15.219 1.00 1.00 N ATOM 1920 CA VAL A 123 9.959 -10.801 -16.708 1.00 1.00 C ATOM 1921 C VAL A 123 9.399 -12.101 -17.293 1.00 1.00 C ATOM 1922 O VAL A 123 9.503 -13.155 -16.699 1.00 1.00 O ATOM 1923 CB VAL A 123 11.453 -10.678 -17.007 1.00 1.00 C ATOM 1924 CG1 VAL A 123 11.650 -10.244 -18.459 1.00 1.00 C ATOM 1925 CG2 VAL A 123 12.073 -9.634 -16.075 1.00 1.00 C ATOM 0 H VAL A 123 10.695 -11.163 -14.735 1.00 1.00 H new ATOM 0 HA VAL A 123 9.388 -9.983 -17.147 1.00 1.00 H new ATOM 0 HB VAL A 123 11.936 -11.642 -16.848 1.00 1.00 H new ATOM 0 HG11 VAL A 123 12.716 -10.157 -18.671 1.00 1.00 H new ATOM 0 HG12 VAL A 123 11.207 -10.986 -19.124 1.00 1.00 H new ATOM 0 HG13 VAL A 123 11.168 -9.280 -18.619 1.00 1.00 H new ATOM 0 HG21 VAL A 123 13.139 -9.545 -16.286 1.00 1.00 H new ATOM 0 HG22 VAL A 123 11.589 -8.670 -16.235 1.00 1.00 H new ATOM 0 HG23 VAL A 123 11.933 -9.943 -15.039 1.00 1.00 H new ATOM 1935 N ASP A 124 8.805 -12.034 -18.453 1.00 1.00 N ATOM 1936 CA ASP A 124 8.241 -13.267 -19.074 1.00 1.00 C ATOM 1937 C ASP A 124 9.369 -14.198 -19.523 1.00 1.00 C ATOM 1938 O ASP A 124 9.837 -14.969 -18.701 1.00 1.00 O ATOM 1939 CB ASP A 124 7.439 -12.775 -20.279 1.00 1.00 C ATOM 1940 CG ASP A 124 6.713 -13.956 -20.926 1.00 1.00 C ATOM 1941 OD1 ASP A 124 7.301 -14.587 -21.789 1.00 1.00 O ATOM 1942 OD2 ASP A 124 5.581 -14.209 -20.549 1.00 1.00 O ATOM 0 H ASP A 124 8.686 -11.180 -18.998 1.00 1.00 H new ATOM 0 HA ASP A 124 7.622 -13.833 -18.377 1.00 1.00 H new ATOM 0 HB2 ASP A 124 6.719 -12.019 -19.966 1.00 1.00 H new ATOM 0 HB3 ASP A 124 8.103 -12.302 -21.003 1.00 1.00 H new