USER MOD reduce.3.24.130724 H: found=0, std=0, add=1453, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1455 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 56 SER OG : rot -70:sc= 0.714 USER MOD Set 1.2: B 60 GLN : amide:sc= 0.636 K(o=1.3,f=-1.6!) USER MOD Set 2.1: B 51 ASN : amide:sc= 1.13 K(o=1.9,f=-4.9!) USER MOD Set 2.2: B 53 THR OG1 : rot -73:sc= 0.815 USER MOD Set 2.3: B 54 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 48 THR OG1 : rot -85:sc= 0.994 USER MOD Set 3.2: B 50 MET CE :methyl -122:sc= -1.68 (180deg=-3.76!) USER MOD Set 4.1: A 48 THR OG1 : rot -87:sc= 1.31 USER MOD Set 4.2: A 50 MET CE :methyl 152:sc= -1.36 (180deg=-1.9!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN :FLIP amide:sc= -0.0989 F(o=-0.95!,f=-0.099) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.0428 K(o=-0.043,f=-6.1!) USER MOD Single : A 29 GLN : amide:sc= -2.1 K(o=-2.1,f=-6.5!) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 46 THR OG1 : rot 86:sc= 1.3 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -179:sc= -1.22 USER MOD Single : A 56 SER OG : rot -79:sc= 0.753 USER MOD Single : A 58 ASN : amide:sc= -1.14! C(o=-1.1!,f=-7.1!) USER MOD Single : A 60 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 63 LYS NZ :NH3+ -173:sc= 1.22 (180deg=1.14) USER MOD Single : A 64 SER OG : rot 74:sc= 1.27 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -1.14 K(o=-1.1,f=-2.4!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 8 LYS NZ :NH3+ 145:sc= 1.05 (180deg=-0.192) USER MOD Single : B 14 GLN : amide:sc= -0.208 K(o=-0.21,f=-1.2) USER MOD Single : B 20 LYS NZ :NH3+ -164:sc= -0.0487 (180deg=-0.336) USER MOD Single : B 24 ASN : amide:sc= -0.4 K(o=-0.4,f=-2.8!) USER MOD Single : B 29 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.3) USER MOD Single : B 36 GLN : amide:sc= 1.04 K(o=1,f=-0.57) USER MOD Single : B 46 THR OG1 : rot 78:sc= 1.21 USER MOD Single : B 58 ASN : amide:sc= 0.641 K(o=0.64,f=-7.3!) USER MOD Single : B 63 LYS NZ :NH3+ -166:sc= -0.0395 (180deg=-0.457) USER MOD Single : B 64 SER OG : rot 71:sc= 1.34 USER MOD Single : B 75 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 GLN :FLIP amide:sc=-1.42e-05 F(o=-0.9,f=-1.4e-05) USER MOD Single : B 78 TYR OH : rot 180:sc= -0.355 USER MOD Single : B 79 TYR OH : rot 180:sc= 0 USER MOD Single : B 94 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : B 100 HIS : no HD1:sc= 0.376 K(o=0.38,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 77 N ARG A 7 -3.876 5.599 -20.237 1.00 0.00 N ATOM 78 CA ARG A 7 -4.772 4.631 -19.619 1.00 0.00 C ATOM 79 C ARG A 7 -4.184 4.171 -18.287 1.00 0.00 C ATOM 80 O ARG A 7 -4.876 3.588 -17.456 1.00 0.00 O ATOM 81 CB ARG A 7 -4.974 3.426 -20.546 1.00 0.00 C ATOM 82 CG ARG A 7 -3.745 2.536 -20.667 1.00 0.00 C ATOM 83 CD ARG A 7 -3.943 1.438 -21.699 1.00 0.00 C ATOM 84 NE ARG A 7 -2.886 0.431 -21.633 1.00 0.00 N ATOM 85 CZ ARG A 7 -1.861 0.360 -22.486 1.00 0.00 C ATOM 86 NH1 ARG A 7 -1.718 1.272 -23.447 1.00 0.00 N ATOM 87 NH2 ARG A 7 -0.976 -0.624 -22.374 1.00 0.00 N ATOM 0 HA ARG A 7 -5.740 5.102 -19.445 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -5.809 2.830 -20.177 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -5.252 3.784 -21.537 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -2.882 3.143 -20.943 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -3.523 2.089 -19.698 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -4.910 0.960 -21.540 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -3.964 1.877 -22.696 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.934 -0.263 -20.887 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -2.394 2.031 -23.535 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -0.933 1.211 -24.095 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -1.080 -1.323 -21.638 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -0.192 -0.681 -23.024 1.00 0.00 H new ATOM 101 N LYS A 8 -2.892 4.452 -18.104 1.00 0.00 N ATOM 102 CA LYS A 8 -2.179 4.116 -16.878 1.00 0.00 C ATOM 103 C LYS A 8 -2.874 4.704 -15.655 1.00 0.00 C ATOM 104 O LYS A 8 -2.813 4.134 -14.567 1.00 0.00 O ATOM 105 CB LYS A 8 -0.729 4.613 -16.957 1.00 0.00 C ATOM 106 CG LYS A 8 -0.584 6.109 -17.225 1.00 0.00 C ATOM 107 CD LYS A 8 0.881 6.519 -17.254 1.00 0.00 C ATOM 108 CE LYS A 8 1.062 8.023 -17.449 1.00 0.00 C ATOM 109 NZ LYS A 8 0.752 8.469 -18.835 1.00 0.00 N ATOM 0 H LYS A 8 -2.314 4.919 -18.803 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.179 3.031 -16.774 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -0.225 4.375 -16.020 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.213 4.064 -17.745 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.054 6.359 -18.176 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -1.108 6.673 -16.453 1.00 0.00 H new ATOM 0 HD2 LYS A 8 1.358 6.216 -16.322 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.388 5.988 -18.059 1.00 0.00 H new ATOM 0 HE2 LYS A 8 0.418 8.555 -16.749 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.089 8.295 -17.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 0.892 9.497 -18.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 1.383 7.985 -19.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -0.236 8.237 -19.061 1.00 0.00 H new ATOM 123 N ALA A 9 -3.565 5.824 -15.849 1.00 0.00 N ATOM 124 CA ALA A 9 -4.263 6.494 -14.763 1.00 0.00 C ATOM 125 C ALA A 9 -5.318 5.584 -14.144 1.00 0.00 C ATOM 126 O ALA A 9 -5.612 5.687 -12.960 1.00 0.00 O ATOM 127 CB ALA A 9 -4.898 7.780 -15.259 1.00 0.00 C ATOM 0 H ALA A 9 -3.655 6.286 -16.754 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.533 6.737 -13.991 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.417 8.271 -14.436 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.124 8.442 -15.646 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -5.610 7.552 -16.052 1.00 0.00 H new ATOM 133 N ALA A 10 -5.876 4.688 -14.951 1.00 0.00 N ATOM 134 CA ALA A 10 -6.866 3.733 -14.468 1.00 0.00 C ATOM 135 C ALA A 10 -6.210 2.684 -13.577 1.00 0.00 C ATOM 136 O ALA A 10 -6.762 2.289 -12.542 1.00 0.00 O ATOM 137 CB ALA A 10 -7.571 3.068 -15.638 1.00 0.00 C ATOM 0 H ALA A 10 -5.659 4.603 -15.944 1.00 0.00 H new ATOM 0 HA ALA A 10 -7.605 4.272 -13.876 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -8.307 2.357 -15.263 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -8.072 3.826 -16.240 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.840 2.542 -16.252 1.00 0.00 H new ATOM 143 N LEU A 11 -5.017 2.253 -13.965 1.00 0.00 N ATOM 144 CA LEU A 11 -4.289 1.254 -13.200 1.00 0.00 C ATOM 145 C LEU A 11 -3.805 1.878 -11.899 1.00 0.00 C ATOM 146 O LEU A 11 -3.962 1.303 -10.820 1.00 0.00 O ATOM 147 CB LEU A 11 -3.118 0.700 -14.029 1.00 0.00 C ATOM 148 CG LEU A 11 -2.298 -0.426 -13.381 1.00 0.00 C ATOM 149 CD1 LEU A 11 -1.691 -1.318 -14.452 1.00 0.00 C ATOM 150 CD2 LEU A 11 -1.194 0.140 -12.498 1.00 0.00 C ATOM 0 H LEU A 11 -4.535 2.579 -14.803 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.946 0.417 -12.961 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.513 0.334 -14.977 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.444 1.524 -14.262 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.971 -1.016 -12.759 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -1.112 -2.112 -13.979 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.487 -1.758 -15.053 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.038 -0.725 -15.092 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.629 -0.679 -12.052 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.526 0.756 -13.100 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.635 0.749 -11.709 1.00 0.00 H new ATOM 162 N LEU A 12 -3.254 3.079 -12.012 1.00 0.00 N ATOM 163 CA LEU A 12 -2.777 3.815 -10.852 1.00 0.00 C ATOM 164 C LEU A 12 -3.943 4.212 -9.954 1.00 0.00 C ATOM 165 O LEU A 12 -3.768 4.391 -8.758 1.00 0.00 O ATOM 166 CB LEU A 12 -1.998 5.058 -11.289 1.00 0.00 C ATOM 167 CG LEU A 12 -0.733 4.774 -12.103 1.00 0.00 C ATOM 168 CD1 LEU A 12 -0.063 6.074 -12.515 1.00 0.00 C ATOM 169 CD2 LEU A 12 0.235 3.906 -11.313 1.00 0.00 C ATOM 0 H LEU A 12 -3.127 3.565 -12.900 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.108 3.166 -10.286 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.658 5.693 -11.880 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.721 5.626 -10.401 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.022 4.231 -13.003 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.835 5.854 -13.093 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.751 6.661 -13.123 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.209 6.641 -11.625 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.126 3.717 -11.912 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.517 4.419 -10.394 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.244 2.958 -11.067 1.00 0.00 H new ATOM 181 N ASP A 13 -5.130 4.343 -10.540 1.00 0.00 N ATOM 182 CA ASP A 13 -6.339 4.643 -9.773 1.00 0.00 C ATOM 183 C ASP A 13 -6.637 3.530 -8.778 1.00 0.00 C ATOM 184 O ASP A 13 -6.840 3.783 -7.592 1.00 0.00 O ATOM 185 CB ASP A 13 -7.544 4.846 -10.696 1.00 0.00 C ATOM 186 CG ASP A 13 -8.854 4.912 -9.933 1.00 0.00 C ATOM 187 OD1 ASP A 13 -9.114 5.938 -9.275 1.00 0.00 O ATOM 188 OD2 ASP A 13 -9.626 3.928 -9.980 1.00 0.00 O ATOM 0 H ASP A 13 -5.282 4.246 -11.544 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.159 5.569 -9.227 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -7.411 5.766 -11.265 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -7.587 4.029 -11.417 1.00 0.00 H new ATOM 193 N GLN A 14 -6.653 2.293 -9.262 1.00 0.00 N ATOM 194 CA GLN A 14 -6.907 1.156 -8.388 1.00 0.00 C ATOM 195 C GLN A 14 -5.754 0.975 -7.402 1.00 0.00 C ATOM 196 O GLN A 14 -5.981 0.698 -6.225 1.00 0.00 O ATOM 197 CB GLN A 14 -7.136 -0.122 -9.198 1.00 0.00 C ATOM 198 CG GLN A 14 -7.350 -1.367 -8.344 1.00 0.00 C ATOM 199 CD GLN A 14 -8.541 -1.264 -7.404 1.00 0.00 C ATOM 200 OE1 GLN A 14 -8.306 -0.792 -6.189 1.00 0.00 O flip ATOM 201 NE2 GLN A 14 -9.661 -1.613 -7.761 1.00 0.00 N flip ATOM 0 H GLN A 14 -6.495 2.055 -10.241 1.00 0.00 H new ATOM 0 HA GLN A 14 -7.817 1.358 -7.823 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -8.005 0.019 -9.841 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -6.279 -0.285 -9.851 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -7.488 -2.227 -8.999 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -6.450 -1.554 -7.758 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -9.807 -1.972 -8.704 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.447 -1.544 -7.114 1.00 0.00 H new ATOM 210 N VAL A 15 -4.524 1.148 -7.875 1.00 0.00 N ATOM 211 CA VAL A 15 -3.358 1.078 -6.996 1.00 0.00 C ATOM 212 C VAL A 15 -3.458 2.137 -5.899 1.00 0.00 C ATOM 213 O VAL A 15 -3.231 1.850 -4.725 1.00 0.00 O ATOM 214 CB VAL A 15 -2.034 1.256 -7.777 1.00 0.00 C ATOM 215 CG1 VAL A 15 -0.843 1.302 -6.831 1.00 0.00 C ATOM 216 CG2 VAL A 15 -1.856 0.133 -8.786 1.00 0.00 C ATOM 0 H VAL A 15 -4.308 1.336 -8.854 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.349 0.085 -6.546 1.00 0.00 H new ATOM 0 HB VAL A 15 -2.085 2.205 -8.310 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.074 1.428 -7.406 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -0.957 2.139 -6.143 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -0.792 0.372 -6.265 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.920 0.274 -9.326 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -1.834 -0.824 -8.265 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -2.687 0.143 -9.491 1.00 0.00 H new ATOM 226 N ALA A 16 -3.837 3.348 -6.291 1.00 0.00 N ATOM 227 CA ALA A 16 -3.998 4.454 -5.354 1.00 0.00 C ATOM 228 C ALA A 16 -5.085 4.152 -4.330 1.00 0.00 C ATOM 229 O ALA A 16 -4.989 4.537 -3.168 1.00 0.00 O ATOM 230 CB ALA A 16 -4.325 5.736 -6.103 1.00 0.00 C ATOM 0 H ALA A 16 -4.040 3.590 -7.261 1.00 0.00 H new ATOM 0 HA ALA A 16 -3.056 4.584 -4.821 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -4.443 6.553 -5.391 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.515 5.970 -6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -5.252 5.605 -6.661 1.00 0.00 H new ATOM 236 N ARG A 17 -6.121 3.467 -4.772 1.00 0.00 N ATOM 237 CA ARG A 17 -7.228 3.101 -3.904 1.00 0.00 C ATOM 238 C ARG A 17 -6.817 1.984 -2.945 1.00 0.00 C ATOM 239 O ARG A 17 -7.286 1.924 -1.809 1.00 0.00 O ATOM 240 CB ARG A 17 -8.421 2.682 -4.766 1.00 0.00 C ATOM 241 CG ARG A 17 -9.666 2.300 -3.990 1.00 0.00 C ATOM 242 CD ARG A 17 -10.854 2.132 -4.927 1.00 0.00 C ATOM 243 NE ARG A 17 -11.318 3.417 -5.452 1.00 0.00 N ATOM 244 CZ ARG A 17 -11.071 3.864 -6.684 1.00 0.00 C ATOM 245 NH1 ARG A 17 -10.336 3.146 -7.527 1.00 0.00 N ATOM 246 NH2 ARG A 17 -11.566 5.030 -7.073 1.00 0.00 N ATOM 0 H ARG A 17 -6.221 3.149 -5.736 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.514 3.959 -3.296 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.668 3.501 -5.441 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -8.123 1.837 -5.386 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.491 1.372 -3.446 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -9.888 3.067 -3.248 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -10.575 1.481 -5.755 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -11.669 1.641 -4.396 1.00 0.00 H new ATOM 0 HE ARG A 17 -11.868 4.012 -4.833 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -9.956 2.246 -7.233 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -10.152 3.495 -8.468 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -12.134 5.583 -6.431 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -11.379 5.375 -8.015 1.00 0.00 H new ATOM 260 N VAL A 18 -5.927 1.112 -3.404 1.00 0.00 N ATOM 261 CA VAL A 18 -5.389 0.054 -2.556 1.00 0.00 C ATOM 262 C VAL A 18 -4.408 0.638 -1.544 1.00 0.00 C ATOM 263 O VAL A 18 -4.488 0.349 -0.350 1.00 0.00 O ATOM 264 CB VAL A 18 -4.682 -1.045 -3.382 1.00 0.00 C ATOM 265 CG1 VAL A 18 -3.996 -2.052 -2.471 1.00 0.00 C ATOM 266 CG2 VAL A 18 -5.670 -1.755 -4.295 1.00 0.00 C ATOM 0 H VAL A 18 -5.563 1.116 -4.357 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.231 -0.403 -2.036 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.924 -0.562 -3.998 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.506 -2.815 -3.076 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -3.253 -1.541 -1.859 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -4.737 -2.522 -1.825 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.150 -2.524 -4.866 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.453 -2.217 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -6.116 -1.034 -4.980 1.00 0.00 H new ATOM 276 N GLY A 19 -3.496 1.471 -2.030 1.00 0.00 N ATOM 277 CA GLY A 19 -2.535 2.118 -1.156 1.00 0.00 C ATOM 278 C GLY A 19 -3.216 2.995 -0.128 1.00 0.00 C ATOM 279 O GLY A 19 -2.843 2.999 1.045 1.00 0.00 O ATOM 0 H GLY A 19 -3.404 1.711 -3.017 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.936 1.361 -0.649 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -1.849 2.721 -1.752 1.00 0.00 H new ATOM 283 N LYS A 20 -4.234 3.726 -0.569 1.00 0.00 N ATOM 284 CA LYS A 20 -5.028 4.557 0.324 1.00 0.00 C ATOM 285 C LYS A 20 -5.682 3.704 1.410 1.00 0.00 C ATOM 286 O LYS A 20 -5.760 4.106 2.575 1.00 0.00 O ATOM 287 CB LYS A 20 -6.111 5.299 -0.460 1.00 0.00 C ATOM 288 CG LYS A 20 -6.859 6.314 0.379 1.00 0.00 C ATOM 289 CD LYS A 20 -8.171 6.725 -0.264 1.00 0.00 C ATOM 290 CE LYS A 20 -8.953 7.662 0.642 1.00 0.00 C ATOM 291 NZ LYS A 20 -10.323 7.927 0.126 1.00 0.00 N ATOM 0 H LYS A 20 -4.529 3.759 -1.545 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.363 5.282 0.792 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.654 5.805 -1.310 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.820 4.576 -0.863 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.054 5.895 1.366 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.234 7.195 0.524 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.975 7.215 -1.217 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.768 5.839 -0.478 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.020 7.229 1.640 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.414 8.605 0.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.820 8.570 0.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.261 8.365 -0.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.847 7.031 0.057 1.00 0.00 H new ATOM 305 N ALA A 21 -6.142 2.518 1.019 1.00 0.00 N ATOM 306 CA ALA A 21 -6.796 1.603 1.945 1.00 0.00 C ATOM 307 C ALA A 21 -5.787 0.981 2.909 1.00 0.00 C ATOM 308 O ALA A 21 -6.151 0.536 3.995 1.00 0.00 O ATOM 309 CB ALA A 21 -7.548 0.517 1.185 1.00 0.00 C ATOM 0 H ALA A 21 -6.072 2.169 0.063 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.514 2.176 2.532 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.030 -0.156 1.894 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.305 0.976 0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.848 -0.046 0.568 1.00 0.00 H new ATOM 315 N LEU A 22 -4.522 0.956 2.512 1.00 0.00 N ATOM 316 CA LEU A 22 -3.464 0.423 3.364 1.00 0.00 C ATOM 317 C LEU A 22 -3.039 1.465 4.395 1.00 0.00 C ATOM 318 O LEU A 22 -2.670 1.135 5.524 1.00 0.00 O ATOM 319 CB LEU A 22 -2.260 -0.003 2.514 1.00 0.00 C ATOM 320 CG LEU A 22 -1.127 -0.687 3.282 1.00 0.00 C ATOM 321 CD1 LEU A 22 -1.589 -2.023 3.848 1.00 0.00 C ATOM 322 CD2 LEU A 22 0.084 -0.882 2.384 1.00 0.00 C ATOM 0 H LEU A 22 -4.202 1.298 1.606 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.848 -0.452 3.889 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.608 -0.680 1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.858 0.879 2.015 1.00 0.00 H new ATOM 0 HG LEU A 22 -0.842 -0.043 4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -0.768 -2.492 4.390 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.426 -1.861 4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.904 -2.674 3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.880 -1.370 2.947 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.191 -1.504 1.532 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.433 0.087 2.028 1.00 0.00 H new ATOM 334 N ALA A 23 -3.107 2.726 4.004 1.00 0.00 N ATOM 335 CA ALA A 23 -2.731 3.820 4.880 1.00 0.00 C ATOM 336 C ALA A 23 -3.800 4.077 5.938 1.00 0.00 C ATOM 337 O ALA A 23 -4.836 4.686 5.657 1.00 0.00 O ATOM 338 CB ALA A 23 -2.478 5.078 4.067 1.00 0.00 C ATOM 0 H ALA A 23 -3.422 3.018 3.079 1.00 0.00 H new ATOM 0 HA ALA A 23 -1.813 3.539 5.396 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.197 5.892 4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -1.672 4.896 3.357 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.384 5.350 3.525 1.00 0.00 H new ATOM 344 N ASN A 24 -3.548 3.589 7.143 1.00 0.00 N ATOM 345 CA ASN A 24 -4.437 3.824 8.275 1.00 0.00 C ATOM 346 C ASN A 24 -3.727 3.528 9.588 1.00 0.00 C ATOM 347 O ASN A 24 -3.470 4.430 10.384 1.00 0.00 O ATOM 348 CB ASN A 24 -5.693 2.957 8.175 1.00 0.00 C ATOM 349 CG ASN A 24 -6.635 3.170 9.351 1.00 0.00 C ATOM 350 OD1 ASN A 24 -6.480 2.550 10.400 1.00 0.00 O ATOM 351 ND2 ASN A 24 -7.628 4.026 9.176 1.00 0.00 N ATOM 0 H ASN A 24 -2.729 3.023 7.365 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.727 4.874 8.251 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -6.217 3.185 7.247 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.405 1.907 8.129 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -8.298 4.190 9.927 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.723 4.522 8.290 1.00 0.00 H new ATOM 358 N GLY A 25 -3.411 2.259 9.808 1.00 0.00 N ATOM 359 CA GLY A 25 -2.768 1.860 11.042 1.00 0.00 C ATOM 360 C GLY A 25 -3.569 0.818 11.799 1.00 0.00 C ATOM 361 O GLY A 25 -3.351 -0.379 11.636 1.00 0.00 O ATOM 0 H GLY A 25 -3.589 1.498 9.152 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.777 1.463 10.821 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -2.626 2.736 11.675 1.00 0.00 H new ATOM 365 N ARG A 26 -4.524 1.272 12.601 1.00 0.00 N ATOM 366 CA ARG A 26 -5.291 0.373 13.464 1.00 0.00 C ATOM 367 C ARG A 26 -6.285 -0.466 12.667 1.00 0.00 C ATOM 368 O ARG A 26 -6.613 -1.583 13.059 1.00 0.00 O ATOM 369 CB ARG A 26 -6.016 1.159 14.557 1.00 0.00 C ATOM 370 CG ARG A 26 -5.071 1.892 15.495 1.00 0.00 C ATOM 371 CD ARG A 26 -5.816 2.562 16.634 1.00 0.00 C ATOM 372 NE ARG A 26 -4.921 3.346 17.486 1.00 0.00 N ATOM 373 CZ ARG A 26 -4.950 3.330 18.819 1.00 0.00 C ATOM 374 NH1 ARG A 26 -5.808 2.546 19.463 1.00 0.00 N ATOM 375 NH2 ARG A 26 -4.111 4.093 19.504 1.00 0.00 N ATOM 0 H ARG A 26 -4.788 2.255 12.674 1.00 0.00 H new ATOM 0 HA ARG A 26 -4.582 -0.309 13.933 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -6.688 1.880 14.092 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -6.635 0.475 15.137 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -4.343 1.189 15.900 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -4.512 2.642 14.935 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -6.592 3.211 16.228 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -6.318 1.804 17.235 1.00 0.00 H new ATOM 0 HE ARG A 26 -4.231 3.943 17.031 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -6.449 1.952 18.938 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -5.825 2.538 20.483 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -3.446 4.690 19.012 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -4.130 4.084 20.524 1.00 0.00 H new ATOM 389 N ARG A 27 -6.754 0.056 11.541 1.00 0.00 N ATOM 390 CA ARG A 27 -7.657 -0.700 10.675 1.00 0.00 C ATOM 391 C ARG A 27 -6.905 -1.846 9.996 1.00 0.00 C ATOM 392 O ARG A 27 -7.509 -2.791 9.490 1.00 0.00 O ATOM 393 CB ARG A 27 -8.323 0.224 9.641 1.00 0.00 C ATOM 394 CG ARG A 27 -9.158 -0.501 8.592 1.00 0.00 C ATOM 395 CD ARG A 27 -10.031 0.456 7.784 1.00 0.00 C ATOM 396 NE ARG A 27 -9.298 1.609 7.257 1.00 0.00 N ATOM 397 CZ ARG A 27 -8.465 1.559 6.220 1.00 0.00 C ATOM 398 NH1 ARG A 27 -8.172 0.396 5.660 1.00 0.00 N ATOM 399 NH2 ARG A 27 -7.924 2.672 5.747 1.00 0.00 N ATOM 0 H ARG A 27 -6.528 0.992 11.206 1.00 0.00 H new ATOM 0 HA ARG A 27 -8.449 -1.131 11.288 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -8.960 0.936 10.166 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -7.549 0.801 9.136 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.497 -1.044 7.917 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -9.791 -1.241 9.082 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -10.482 -0.088 6.954 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -10.847 0.811 8.414 1.00 0.00 H new ATOM 0 HE ARG A 27 -9.435 2.510 7.715 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -8.585 -0.463 6.023 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.534 0.359 4.865 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -8.146 3.570 6.178 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -7.286 2.631 4.952 1.00 0.00 H new ATOM 413 N LEU A 28 -5.579 -1.776 10.023 1.00 0.00 N ATOM 414 CA LEU A 28 -4.750 -2.839 9.472 1.00 0.00 C ATOM 415 C LEU A 28 -4.747 -4.043 10.409 1.00 0.00 C ATOM 416 O LEU A 28 -4.402 -5.155 10.009 1.00 0.00 O ATOM 417 CB LEU A 28 -3.318 -2.350 9.241 1.00 0.00 C ATOM 418 CG LEU A 28 -3.174 -1.193 8.251 1.00 0.00 C ATOM 419 CD1 LEU A 28 -1.724 -0.743 8.165 1.00 0.00 C ATOM 420 CD2 LEU A 28 -3.685 -1.604 6.878 1.00 0.00 C ATOM 0 H LEU A 28 -5.057 -0.995 10.420 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.170 -3.136 8.511 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.898 -2.042 10.198 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.718 -3.188 8.885 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.774 -0.356 8.608 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.640 0.081 7.456 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.387 -0.412 9.147 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.104 -1.575 7.830 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.576 -0.770 6.185 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.109 -2.455 6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.737 -1.881 6.949 1.00 0.00 H new ATOM 432 N GLN A 29 -5.151 -3.813 11.656 1.00 0.00 N ATOM 433 CA GLN A 29 -5.244 -4.881 12.644 1.00 0.00 C ATOM 434 C GLN A 29 -6.318 -5.879 12.232 1.00 0.00 C ATOM 435 O GLN A 29 -6.291 -7.048 12.620 1.00 0.00 O ATOM 436 CB GLN A 29 -5.577 -4.306 14.019 1.00 0.00 C ATOM 437 CG GLN A 29 -5.345 -5.279 15.156 1.00 0.00 C ATOM 438 CD GLN A 29 -6.033 -4.854 16.433 1.00 0.00 C ATOM 439 OE1 GLN A 29 -7.173 -5.235 16.687 1.00 0.00 O ATOM 440 NE2 GLN A 29 -5.354 -4.059 17.242 1.00 0.00 N ATOM 0 H GLN A 29 -5.420 -2.893 12.005 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.281 -5.389 12.698 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -4.973 -3.414 14.186 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.620 -3.991 14.029 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.705 -6.266 14.864 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.274 -5.371 15.338 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.409 -3.765 16.994 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.775 -3.739 18.114 1.00 0.00 H new ATOM 449 N ILE A 30 -7.271 -5.401 11.441 1.00 0.00 N ATOM 450 CA ILE A 30 -8.319 -6.249 10.909 1.00 0.00 C ATOM 451 C ILE A 30 -7.739 -7.205 9.872 1.00 0.00 C ATOM 452 O ILE A 30 -8.130 -8.364 9.796 1.00 0.00 O ATOM 453 CB ILE A 30 -9.453 -5.415 10.276 1.00 0.00 C ATOM 454 CG1 ILE A 30 -10.014 -4.422 11.301 1.00 0.00 C ATOM 455 CG2 ILE A 30 -10.557 -6.323 9.755 1.00 0.00 C ATOM 456 CD1 ILE A 30 -11.093 -3.513 10.752 1.00 0.00 C ATOM 0 H ILE A 30 -7.335 -4.424 11.155 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.741 -6.820 11.736 1.00 0.00 H new ATOM 0 HB ILE A 30 -9.045 -4.855 9.434 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -10.418 -4.978 12.147 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -9.197 -3.810 11.683 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.348 -5.717 9.312 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.149 -6.995 9.000 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.966 -6.908 10.579 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -11.437 -2.841 11.538 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -10.690 -2.928 9.925 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -11.930 -4.115 10.397 1.00 0.00 H new ATOM 468 N LEU A 31 -6.778 -6.715 9.096 1.00 0.00 N ATOM 469 CA LEU A 31 -6.110 -7.536 8.093 1.00 0.00 C ATOM 470 C LEU A 31 -5.225 -8.574 8.773 1.00 0.00 C ATOM 471 O LEU A 31 -5.090 -9.697 8.296 1.00 0.00 O ATOM 472 CB LEU A 31 -5.277 -6.664 7.148 1.00 0.00 C ATOM 473 CG LEU A 31 -6.071 -5.631 6.347 1.00 0.00 C ATOM 474 CD1 LEU A 31 -5.140 -4.801 5.478 1.00 0.00 C ATOM 475 CD2 LEU A 31 -7.132 -6.314 5.497 1.00 0.00 C ATOM 0 H LEU A 31 -6.444 -5.752 9.143 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.869 -8.050 7.504 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.520 -6.143 7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.749 -7.314 6.450 1.00 0.00 H new ATOM 0 HG LEU A 31 -6.572 -4.963 7.047 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.722 -4.071 4.915 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.420 -4.281 6.110 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.610 -5.455 4.785 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.687 -5.563 4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.653 -7.006 4.804 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.817 -6.863 6.143 1.00 0.00 H new ATOM 487 N ASP A 32 -4.635 -8.181 9.898 1.00 0.00 N ATOM 488 CA ASP A 32 -3.839 -9.093 10.719 1.00 0.00 C ATOM 489 C ASP A 32 -4.719 -10.212 11.274 1.00 0.00 C ATOM 490 O ASP A 32 -4.270 -11.340 11.474 1.00 0.00 O ATOM 491 CB ASP A 32 -3.169 -8.313 11.859 1.00 0.00 C ATOM 492 CG ASP A 32 -2.472 -9.203 12.873 1.00 0.00 C ATOM 493 OD1 ASP A 32 -1.367 -9.702 12.584 1.00 0.00 O ATOM 494 OD2 ASP A 32 -3.015 -9.378 13.984 1.00 0.00 O ATOM 0 H ASP A 32 -4.693 -7.231 10.265 1.00 0.00 H new ATOM 0 HA ASP A 32 -3.063 -9.546 10.101 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -2.442 -7.619 11.436 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -3.922 -7.714 12.370 1.00 0.00 H new ATOM 499 N LEU A 33 -5.985 -9.887 11.500 1.00 0.00 N ATOM 500 CA LEU A 33 -6.958 -10.860 11.978 1.00 0.00 C ATOM 501 C LEU A 33 -7.444 -11.727 10.815 1.00 0.00 C ATOM 502 O LEU A 33 -7.516 -12.950 10.927 1.00 0.00 O ATOM 503 CB LEU A 33 -8.132 -10.126 12.649 1.00 0.00 C ATOM 504 CG LEU A 33 -9.093 -10.986 13.486 1.00 0.00 C ATOM 505 CD1 LEU A 33 -9.903 -10.100 14.419 1.00 0.00 C ATOM 506 CD2 LEU A 33 -10.035 -11.786 12.599 1.00 0.00 C ATOM 0 H LEU A 33 -6.364 -8.951 11.359 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.492 -11.514 12.715 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.724 -9.347 13.293 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.711 -9.627 11.872 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.495 -11.686 14.069 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -10.581 -10.717 15.009 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.229 -9.562 15.086 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.480 -9.385 13.832 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.701 -12.383 13.221 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.625 -11.104 11.986 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -9.455 -12.445 11.953 1.00 0.00 H new ATOM 518 N LEU A 34 -7.755 -11.086 9.690 1.00 0.00 N ATOM 519 CA LEU A 34 -8.260 -11.793 8.515 1.00 0.00 C ATOM 520 C LEU A 34 -7.166 -12.623 7.850 1.00 0.00 C ATOM 521 O LEU A 34 -7.445 -13.447 6.981 1.00 0.00 O ATOM 522 CB LEU A 34 -8.861 -10.807 7.506 1.00 0.00 C ATOM 523 CG LEU A 34 -10.116 -10.071 7.981 1.00 0.00 C ATOM 524 CD1 LEU A 34 -10.624 -9.134 6.899 1.00 0.00 C ATOM 525 CD2 LEU A 34 -11.198 -11.064 8.380 1.00 0.00 C ATOM 0 H LEU A 34 -7.666 -10.077 9.567 1.00 0.00 H new ATOM 0 HA LEU A 34 -9.042 -12.473 8.853 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -8.102 -10.068 7.248 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.102 -11.349 6.592 1.00 0.00 H new ATOM 0 HG LEU A 34 -9.856 -9.476 8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.517 -8.619 7.254 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -9.853 -8.401 6.661 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -10.867 -9.708 6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -12.083 -10.523 8.715 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -11.456 -11.685 7.522 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -10.831 -11.696 9.189 1.00 0.00 H new ATOM 537 N ALA A 35 -5.922 -12.408 8.266 1.00 0.00 N ATOM 538 CA ALA A 35 -4.805 -13.218 7.796 1.00 0.00 C ATOM 539 C ALA A 35 -4.902 -14.628 8.368 1.00 0.00 C ATOM 540 O ALA A 35 -4.229 -15.551 7.910 1.00 0.00 O ATOM 541 CB ALA A 35 -3.481 -12.578 8.186 1.00 0.00 C ATOM 0 H ALA A 35 -5.662 -11.678 8.929 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.851 -13.277 6.709 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -2.658 -13.196 7.827 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.411 -11.586 7.740 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.424 -12.492 9.271 1.00 0.00 H new ATOM 547 N GLN A 36 -5.749 -14.781 9.381 1.00 0.00 N ATOM 548 CA GLN A 36 -6.001 -16.081 9.985 1.00 0.00 C ATOM 549 C GLN A 36 -7.024 -16.854 9.160 1.00 0.00 C ATOM 550 O GLN A 36 -7.112 -18.080 9.248 1.00 0.00 O ATOM 551 CB GLN A 36 -6.501 -15.912 11.420 1.00 0.00 C ATOM 552 CG GLN A 36 -5.527 -15.165 12.318 1.00 0.00 C ATOM 553 CD GLN A 36 -6.097 -14.867 13.691 1.00 0.00 C ATOM 554 OE1 GLN A 36 -6.937 -15.605 14.205 1.00 0.00 O ATOM 555 NE2 GLN A 36 -5.646 -13.779 14.296 1.00 0.00 N ATOM 0 H GLN A 36 -6.274 -14.015 9.802 1.00 0.00 H new ATOM 0 HA GLN A 36 -5.067 -16.643 10.005 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.451 -15.378 11.405 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.695 -16.896 11.847 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -4.617 -15.755 12.429 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.243 -14.229 11.837 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.949 -13.192 13.837 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -5.995 -13.528 15.221 1.00 0.00 H new ATOM 564 N GLY A 37 -7.792 -16.129 8.355 1.00 0.00 N ATOM 565 CA GLY A 37 -8.775 -16.758 7.504 1.00 0.00 C ATOM 566 C GLY A 37 -10.079 -15.990 7.454 1.00 0.00 C ATOM 567 O GLY A 37 -10.112 -14.782 7.696 1.00 0.00 O ATOM 0 H GLY A 37 -7.748 -15.113 8.279 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -8.372 -16.849 6.495 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.967 -17.769 7.863 1.00 0.00 H new ATOM 571 N GLU A 38 -11.153 -16.699 7.150 1.00 0.00 N ATOM 572 CA GLU A 38 -12.472 -16.100 7.024 1.00 0.00 C ATOM 573 C GLU A 38 -13.144 -16.056 8.395 1.00 0.00 C ATOM 574 O GLU A 38 -13.418 -17.098 8.997 1.00 0.00 O ATOM 575 CB GLU A 38 -13.294 -16.927 6.032 1.00 0.00 C ATOM 576 CG GLU A 38 -14.533 -16.231 5.497 1.00 0.00 C ATOM 577 CD GLU A 38 -15.190 -17.027 4.388 1.00 0.00 C ATOM 578 OE1 GLU A 38 -14.588 -17.140 3.295 1.00 0.00 O ATOM 579 OE2 GLU A 38 -16.294 -17.561 4.605 1.00 0.00 O ATOM 0 H GLU A 38 -11.136 -17.705 6.984 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.395 -15.078 6.652 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.656 -17.200 5.191 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.596 -17.855 6.517 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -15.245 -16.082 6.309 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -14.263 -15.243 5.124 1.00 0.00 H new ATOM 586 N ARG A 39 -13.399 -14.853 8.891 1.00 0.00 N ATOM 587 CA ARG A 39 -13.870 -14.678 10.259 1.00 0.00 C ATOM 588 C ARG A 39 -15.162 -13.863 10.288 1.00 0.00 C ATOM 589 O ARG A 39 -15.374 -12.992 9.446 1.00 0.00 O ATOM 590 CB ARG A 39 -12.785 -13.979 11.085 1.00 0.00 C ATOM 591 CG ARG A 39 -12.918 -14.177 12.587 1.00 0.00 C ATOM 592 CD ARG A 39 -12.544 -15.593 12.999 1.00 0.00 C ATOM 593 NE ARG A 39 -12.604 -15.773 14.450 1.00 0.00 N ATOM 594 CZ ARG A 39 -11.752 -16.528 15.147 1.00 0.00 C ATOM 595 NH1 ARG A 39 -10.803 -17.216 14.528 1.00 0.00 N ATOM 596 NH2 ARG A 39 -11.873 -16.615 16.464 1.00 0.00 N ATOM 0 H ARG A 39 -13.288 -13.985 8.368 1.00 0.00 H new ATOM 0 HA ARG A 39 -14.079 -15.658 10.688 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -11.809 -14.346 10.767 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -12.810 -12.911 10.867 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -12.277 -13.465 13.107 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -13.943 -13.967 12.893 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -13.218 -16.301 12.517 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -11.538 -15.820 12.646 1.00 0.00 H new ATOM 0 HE ARG A 39 -13.344 -15.291 14.961 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -10.720 -17.171 13.512 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -10.156 -17.791 15.067 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -12.616 -16.106 16.943 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -11.223 -17.191 16.999 1.00 0.00 H new ATOM 610 N ALA A 40 -16.023 -14.155 11.258 1.00 0.00 N ATOM 611 CA ALA A 40 -17.282 -13.434 11.413 1.00 0.00 C ATOM 612 C ALA A 40 -17.049 -12.044 12.000 1.00 0.00 C ATOM 613 O ALA A 40 -16.049 -11.809 12.683 1.00 0.00 O ATOM 614 CB ALA A 40 -18.237 -14.229 12.289 1.00 0.00 C ATOM 0 H ALA A 40 -15.871 -14.888 11.951 1.00 0.00 H new ATOM 0 HA ALA A 40 -17.729 -13.311 10.427 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -19.173 -13.681 12.397 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -18.434 -15.196 11.827 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -17.789 -14.380 13.271 1.00 0.00 H new ATOM 620 N VAL A 41 -17.986 -11.138 11.740 1.00 0.00 N ATOM 621 CA VAL A 41 -17.854 -9.738 12.142 1.00 0.00 C ATOM 622 C VAL A 41 -17.750 -9.590 13.659 1.00 0.00 C ATOM 623 O VAL A 41 -16.945 -8.799 14.153 1.00 0.00 O ATOM 624 CB VAL A 41 -19.043 -8.888 11.636 1.00 0.00 C ATOM 625 CG1 VAL A 41 -18.884 -7.429 12.047 1.00 0.00 C ATOM 626 CG2 VAL A 41 -19.180 -9.001 10.127 1.00 0.00 C ATOM 0 H VAL A 41 -18.854 -11.349 11.248 1.00 0.00 H new ATOM 0 HA VAL A 41 -16.932 -9.376 11.686 1.00 0.00 H new ATOM 0 HB VAL A 41 -19.952 -9.275 12.096 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -19.733 -6.853 11.679 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -18.842 -7.360 13.134 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -17.963 -7.030 11.622 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -20.022 -8.396 9.792 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -18.266 -8.646 9.651 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -19.350 -10.042 9.854 1.00 0.00 H new ATOM 636 N GLU A 42 -18.550 -10.360 14.392 1.00 0.00 N ATOM 637 CA GLU A 42 -18.583 -10.263 15.851 1.00 0.00 C ATOM 638 C GLU A 42 -17.202 -10.536 16.431 1.00 0.00 C ATOM 639 O GLU A 42 -16.726 -9.807 17.306 1.00 0.00 O ATOM 640 CB GLU A 42 -19.581 -11.250 16.465 1.00 0.00 C ATOM 641 CG GLU A 42 -20.856 -11.443 15.663 1.00 0.00 C ATOM 642 CD GLU A 42 -20.670 -12.421 14.523 1.00 0.00 C ATOM 643 OE1 GLU A 42 -20.593 -13.638 14.790 1.00 0.00 O ATOM 644 OE2 GLU A 42 -20.576 -11.972 13.361 1.00 0.00 O ATOM 0 H GLU A 42 -19.184 -11.057 14.002 1.00 0.00 H new ATOM 0 HA GLU A 42 -18.900 -9.249 16.097 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -19.091 -12.217 16.581 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -19.845 -10.904 17.464 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -21.647 -11.801 16.322 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -21.183 -10.482 15.266 1.00 0.00 H new ATOM 651 N ALA A 43 -16.565 -11.588 15.931 1.00 0.00 N ATOM 652 CA ALA A 43 -15.229 -11.963 16.375 1.00 0.00 C ATOM 653 C ALA A 43 -14.223 -10.868 16.052 1.00 0.00 C ATOM 654 O ALA A 43 -13.389 -10.517 16.886 1.00 0.00 O ATOM 655 CB ALA A 43 -14.801 -13.274 15.734 1.00 0.00 C ATOM 0 H ALA A 43 -16.955 -12.199 15.214 1.00 0.00 H new ATOM 0 HA ALA A 43 -15.258 -12.095 17.457 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -13.801 -13.538 16.078 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -15.500 -14.062 16.015 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -14.795 -13.164 14.650 1.00 0.00 H new ATOM 661 N ILE A 44 -14.317 -10.328 14.841 1.00 0.00 N ATOM 662 CA ILE A 44 -13.437 -9.250 14.410 1.00 0.00 C ATOM 663 C ILE A 44 -13.600 -8.033 15.313 1.00 0.00 C ATOM 664 O ILE A 44 -12.618 -7.480 15.806 1.00 0.00 O ATOM 665 CB ILE A 44 -13.718 -8.839 12.948 1.00 0.00 C ATOM 666 CG1 ILE A 44 -13.522 -10.036 12.012 1.00 0.00 C ATOM 667 CG2 ILE A 44 -12.815 -7.679 12.535 1.00 0.00 C ATOM 668 CD1 ILE A 44 -13.914 -9.756 10.577 1.00 0.00 C ATOM 0 H ILE A 44 -14.997 -10.621 14.139 1.00 0.00 H new ATOM 0 HA ILE A 44 -12.415 -9.622 14.477 1.00 0.00 H new ATOM 0 HB ILE A 44 -14.754 -8.508 12.873 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -12.476 -10.341 12.041 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.109 -10.876 12.383 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -13.027 -7.403 11.502 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -13.001 -6.824 13.185 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -11.771 -7.981 12.623 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -13.748 -10.649 9.974 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.968 -9.480 10.535 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -13.309 -8.937 10.188 1.00 0.00 H new ATOM 680 N ALA A 45 -14.847 -7.641 15.538 1.00 0.00 N ATOM 681 CA ALA A 45 -15.156 -6.491 16.373 1.00 0.00 C ATOM 682 C ALA A 45 -14.623 -6.682 17.789 1.00 0.00 C ATOM 683 O ALA A 45 -13.911 -5.827 18.316 1.00 0.00 O ATOM 684 CB ALA A 45 -16.657 -6.255 16.396 1.00 0.00 C ATOM 0 H ALA A 45 -15.666 -8.108 15.150 1.00 0.00 H new ATOM 0 HA ALA A 45 -14.666 -5.615 15.948 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -16.880 -5.392 17.023 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -17.011 -6.068 15.382 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -17.158 -7.136 16.799 1.00 0.00 H new ATOM 690 N THR A 46 -14.946 -7.823 18.384 1.00 0.00 N ATOM 691 CA THR A 46 -14.531 -8.122 19.747 1.00 0.00 C ATOM 692 C THR A 46 -13.004 -8.113 19.873 1.00 0.00 C ATOM 693 O THR A 46 -12.448 -7.454 20.751 1.00 0.00 O ATOM 694 CB THR A 46 -15.081 -9.489 20.204 1.00 0.00 C ATOM 695 OG1 THR A 46 -16.496 -9.551 19.970 1.00 0.00 O ATOM 696 CG2 THR A 46 -14.801 -9.721 21.684 1.00 0.00 C ATOM 0 H THR A 46 -15.496 -8.559 17.941 1.00 0.00 H new ATOM 0 HA THR A 46 -14.941 -7.343 20.391 1.00 0.00 H new ATOM 0 HB THR A 46 -14.580 -10.267 19.628 1.00 0.00 H new ATOM 0 HG1 THR A 46 -16.663 -9.849 19.051 1.00 0.00 H new ATOM 0 HG21 THR A 46 -15.198 -10.691 21.982 1.00 0.00 H new ATOM 0 HG22 THR A 46 -13.725 -9.701 21.858 1.00 0.00 H new ATOM 0 HG23 THR A 46 -15.279 -8.937 22.272 1.00 0.00 H new ATOM 704 N ALA A 47 -12.332 -8.812 18.965 1.00 0.00 N ATOM 705 CA ALA A 47 -10.881 -8.951 19.021 1.00 0.00 C ATOM 706 C ALA A 47 -10.170 -7.613 18.825 1.00 0.00 C ATOM 707 O ALA A 47 -9.116 -7.372 19.416 1.00 0.00 O ATOM 708 CB ALA A 47 -10.405 -9.960 17.988 1.00 0.00 C ATOM 0 H ALA A 47 -12.770 -9.293 18.179 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.626 -9.313 20.017 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.320 -10.052 18.042 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -10.862 -10.929 18.188 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -10.691 -9.623 16.992 1.00 0.00 H new ATOM 714 N THR A 48 -10.743 -6.745 18.002 1.00 0.00 N ATOM 715 CA THR A 48 -10.138 -5.446 17.732 1.00 0.00 C ATOM 716 C THR A 48 -10.457 -4.445 18.843 1.00 0.00 C ATOM 717 O THR A 48 -9.764 -3.436 19.001 1.00 0.00 O ATOM 718 CB THR A 48 -10.603 -4.877 16.377 1.00 0.00 C ATOM 719 OG1 THR A 48 -12.032 -4.907 16.294 1.00 0.00 O ATOM 720 CG2 THR A 48 -10.008 -5.663 15.217 1.00 0.00 C ATOM 0 H THR A 48 -11.621 -6.915 17.512 1.00 0.00 H new ATOM 0 HA THR A 48 -9.060 -5.601 17.694 1.00 0.00 H new ATOM 0 HB THR A 48 -10.255 -3.846 16.310 1.00 0.00 H new ATOM 0 HG1 THR A 48 -12.321 -5.775 15.944 1.00 0.00 H new ATOM 0 HG21 THR A 48 -10.354 -5.239 14.274 1.00 0.00 H new ATOM 0 HG22 THR A 48 -8.920 -5.610 15.261 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.323 -6.704 15.283 1.00 0.00 H new ATOM 728 N GLY A 49 -11.502 -4.738 19.616 1.00 0.00 N ATOM 729 CA GLY A 49 -11.905 -3.856 20.694 1.00 0.00 C ATOM 730 C GLY A 49 -12.907 -2.814 20.241 1.00 0.00 C ATOM 731 O GLY A 49 -13.143 -1.823 20.936 1.00 0.00 O ATOM 0 H GLY A 49 -12.077 -5.574 19.512 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -12.338 -4.447 21.501 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.025 -3.358 21.101 1.00 0.00 H new ATOM 735 N MET A 50 -13.509 -3.039 19.082 1.00 0.00 N ATOM 736 CA MET A 50 -14.467 -2.095 18.519 1.00 0.00 C ATOM 737 C MET A 50 -15.861 -2.713 18.469 1.00 0.00 C ATOM 738 O MET A 50 -16.045 -3.875 18.825 1.00 0.00 O ATOM 739 CB MET A 50 -14.026 -1.660 17.114 1.00 0.00 C ATOM 740 CG MET A 50 -12.732 -0.858 17.103 1.00 0.00 C ATOM 741 SD MET A 50 -12.222 -0.369 15.440 1.00 0.00 S ATOM 742 CE MET A 50 -11.849 -1.964 14.710 1.00 0.00 C ATOM 0 H MET A 50 -13.351 -3.869 18.511 1.00 0.00 H new ATOM 0 HA MET A 50 -14.502 -1.215 19.161 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.900 -2.546 16.491 1.00 0.00 H new ATOM 0 HB3 MET A 50 -14.818 -1.063 16.662 1.00 0.00 H new ATOM 0 HG2 MET A 50 -12.858 0.034 17.716 1.00 0.00 H new ATOM 0 HG3 MET A 50 -11.940 -1.450 17.561 1.00 0.00 H new ATOM 0 HE1 MET A 50 -12.006 -1.917 13.632 1.00 0.00 H new ATOM 0 HE2 MET A 50 -10.810 -2.224 14.914 1.00 0.00 H new ATOM 0 HE3 MET A 50 -12.504 -2.723 15.139 1.00 0.00 H new ATOM 752 N ASN A 51 -16.847 -1.934 18.045 1.00 0.00 N ATOM 753 CA ASN A 51 -18.211 -2.437 17.923 1.00 0.00 C ATOM 754 C ASN A 51 -18.422 -3.054 16.551 1.00 0.00 C ATOM 755 O ASN A 51 -17.591 -2.886 15.656 1.00 0.00 O ATOM 756 CB ASN A 51 -19.235 -1.319 18.143 1.00 0.00 C ATOM 757 CG ASN A 51 -19.173 -0.727 19.535 1.00 0.00 C ATOM 758 OD1 ASN A 51 -18.471 0.254 19.771 1.00 0.00 O ATOM 759 ND2 ASN A 51 -19.906 -1.318 20.468 1.00 0.00 N ATOM 0 H ASN A 51 -16.730 -0.956 17.781 1.00 0.00 H new ATOM 0 HA ASN A 51 -18.356 -3.197 18.691 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -19.066 -0.530 17.410 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -20.236 -1.711 17.965 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -19.901 -0.960 21.423 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -20.475 -2.130 20.231 1.00 0.00 H new ATOM 766 N LEU A 52 -19.538 -3.752 16.382 1.00 0.00 N ATOM 767 CA LEU A 52 -19.847 -4.398 15.112 1.00 0.00 C ATOM 768 C LEU A 52 -19.991 -3.366 14.001 1.00 0.00 C ATOM 769 O LEU A 52 -19.412 -3.517 12.927 1.00 0.00 O ATOM 770 CB LEU A 52 -21.123 -5.244 15.216 1.00 0.00 C ATOM 771 CG LEU A 52 -20.945 -6.646 15.813 1.00 0.00 C ATOM 772 CD1 LEU A 52 -20.572 -6.578 17.286 1.00 0.00 C ATOM 773 CD2 LEU A 52 -22.213 -7.464 15.625 1.00 0.00 C ATOM 0 H LEU A 52 -20.243 -3.885 17.107 1.00 0.00 H new ATOM 0 HA LEU A 52 -19.016 -5.060 14.868 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -21.849 -4.701 15.821 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -21.552 -5.345 14.219 1.00 0.00 H new ATOM 0 HG LEU A 52 -20.127 -7.134 15.284 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -20.453 -7.588 17.678 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -19.635 -6.032 17.399 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -21.360 -6.065 17.837 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.073 -8.456 16.053 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.044 -6.967 16.125 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -22.433 -7.556 14.561 1.00 0.00 H new ATOM 785 N THR A 53 -20.737 -2.300 14.276 1.00 0.00 N ATOM 786 CA THR A 53 -20.960 -1.250 13.290 1.00 0.00 C ATOM 787 C THR A 53 -19.654 -0.501 13.001 1.00 0.00 C ATOM 788 O THR A 53 -19.449 0.013 11.901 1.00 0.00 O ATOM 789 CB THR A 53 -22.057 -0.261 13.757 1.00 0.00 C ATOM 790 OG1 THR A 53 -22.423 0.629 12.691 1.00 0.00 O ATOM 791 CG2 THR A 53 -21.601 0.550 14.962 1.00 0.00 C ATOM 0 H THR A 53 -21.196 -2.141 15.173 1.00 0.00 H new ATOM 0 HA THR A 53 -21.305 -1.723 12.371 1.00 0.00 H new ATOM 0 HB THR A 53 -22.925 -0.853 14.048 1.00 0.00 H new ATOM 0 HG1 THR A 53 -23.118 1.245 13.003 1.00 0.00 H new ATOM 0 HG21 THR A 53 -22.395 1.233 15.262 1.00 0.00 H new ATOM 0 HG22 THR A 53 -21.370 -0.123 15.787 1.00 0.00 H new ATOM 0 HG23 THR A 53 -20.711 1.122 14.700 1.00 0.00 H new ATOM 799 N THR A 54 -18.767 -0.466 13.989 1.00 0.00 N ATOM 800 CA THR A 54 -17.465 0.159 13.829 1.00 0.00 C ATOM 801 C THR A 54 -16.586 -0.695 12.918 1.00 0.00 C ATOM 802 O THR A 54 -15.941 -0.193 11.991 1.00 0.00 O ATOM 803 CB THR A 54 -16.766 0.325 15.193 1.00 0.00 C ATOM 804 OG1 THR A 54 -17.724 0.705 16.188 1.00 0.00 O ATOM 805 CG2 THR A 54 -15.664 1.373 15.117 1.00 0.00 C ATOM 0 H THR A 54 -18.930 -0.866 14.913 1.00 0.00 H new ATOM 0 HA THR A 54 -17.613 1.143 13.384 1.00 0.00 H new ATOM 0 HB THR A 54 -16.316 -0.630 15.464 1.00 0.00 H new ATOM 0 HG1 THR A 54 -17.272 0.823 17.049 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.187 1.471 16.092 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.922 1.068 14.379 1.00 0.00 H new ATOM 0 HG23 THR A 54 -16.093 2.332 14.825 1.00 0.00 H new ATOM 813 N ALA A 55 -16.582 -1.997 13.184 1.00 0.00 N ATOM 814 CA ALA A 55 -15.797 -2.939 12.405 1.00 0.00 C ATOM 815 C ALA A 55 -16.287 -3.001 10.965 1.00 0.00 C ATOM 816 O ALA A 55 -15.492 -2.907 10.035 1.00 0.00 O ATOM 817 CB ALA A 55 -15.839 -4.321 13.039 1.00 0.00 C ATOM 0 H ALA A 55 -17.119 -2.423 13.939 1.00 0.00 H new ATOM 0 HA ALA A 55 -14.764 -2.590 12.397 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -15.246 -5.013 12.442 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.431 -4.271 14.049 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -16.871 -4.671 13.082 1.00 0.00 H new ATOM 823 N SER A 56 -17.597 -3.128 10.785 1.00 0.00 N ATOM 824 CA SER A 56 -18.168 -3.269 9.451 1.00 0.00 C ATOM 825 C SER A 56 -17.978 -2.002 8.620 1.00 0.00 C ATOM 826 O SER A 56 -17.838 -2.074 7.402 1.00 0.00 O ATOM 827 CB SER A 56 -19.649 -3.645 9.539 1.00 0.00 C ATOM 828 OG SER A 56 -20.343 -2.801 10.443 1.00 0.00 O ATOM 0 H SER A 56 -18.281 -3.136 11.542 1.00 0.00 H new ATOM 0 HA SER A 56 -17.634 -4.073 8.945 1.00 0.00 H new ATOM 0 HB2 SER A 56 -20.103 -3.574 8.551 1.00 0.00 H new ATOM 0 HB3 SER A 56 -19.744 -4.682 9.860 1.00 0.00 H new ATOM 0 HG SER A 56 -20.172 -3.095 11.362 1.00 0.00 H new ATOM 834 N ALA A 57 -17.960 -0.846 9.277 1.00 0.00 N ATOM 835 CA ALA A 57 -17.695 0.413 8.590 1.00 0.00 C ATOM 836 C ALA A 57 -16.284 0.410 8.010 1.00 0.00 C ATOM 837 O ALA A 57 -16.064 0.808 6.865 1.00 0.00 O ATOM 838 CB ALA A 57 -17.881 1.592 9.535 1.00 0.00 C ATOM 0 H ALA A 57 -18.125 -0.755 10.279 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.408 0.517 7.773 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.678 2.521 9.002 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.906 1.603 9.906 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.192 1.498 10.374 1.00 0.00 H new ATOM 844 N ASN A 58 -15.334 -0.067 8.801 1.00 0.00 N ATOM 845 CA ASN A 58 -13.950 -0.166 8.356 1.00 0.00 C ATOM 846 C ASN A 58 -13.789 -1.293 7.339 1.00 0.00 C ATOM 847 O ASN A 58 -13.002 -1.187 6.397 1.00 0.00 O ATOM 848 CB ASN A 58 -13.013 -0.384 9.545 1.00 0.00 C ATOM 849 CG ASN A 58 -12.750 0.896 10.322 1.00 0.00 C ATOM 850 OD1 ASN A 58 -11.812 1.632 10.021 1.00 0.00 O ATOM 851 ND2 ASN A 58 -13.572 1.175 11.322 1.00 0.00 N ATOM 0 H ASN A 58 -15.495 -0.392 9.754 1.00 0.00 H new ATOM 0 HA ASN A 58 -13.682 0.774 7.874 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -13.446 -1.128 10.213 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -12.066 -0.789 9.188 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -13.437 2.024 11.871 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -14.340 0.541 11.543 1.00 0.00 H new ATOM 858 N LEU A 59 -14.543 -2.369 7.534 1.00 0.00 N ATOM 859 CA LEU A 59 -14.555 -3.490 6.600 1.00 0.00 C ATOM 860 C LEU A 59 -15.125 -3.063 5.251 1.00 0.00 C ATOM 861 O LEU A 59 -14.661 -3.507 4.199 1.00 0.00 O ATOM 862 CB LEU A 59 -15.376 -4.650 7.175 1.00 0.00 C ATOM 863 CG LEU A 59 -14.737 -5.376 8.361 1.00 0.00 C ATOM 864 CD1 LEU A 59 -15.743 -6.297 9.033 1.00 0.00 C ATOM 865 CD2 LEU A 59 -13.526 -6.169 7.895 1.00 0.00 C ATOM 0 H LEU A 59 -15.159 -2.489 8.338 1.00 0.00 H new ATOM 0 HA LEU A 59 -13.528 -3.822 6.451 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.348 -4.267 7.485 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -15.557 -5.374 6.381 1.00 0.00 H new ATOM 0 HG LEU A 59 -14.415 -4.632 9.090 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -15.268 -6.803 9.873 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -16.589 -5.711 9.393 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -16.094 -7.038 8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.078 -6.682 8.746 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -13.836 -6.903 7.151 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -12.795 -5.491 7.454 1.00 0.00 H new ATOM 877 N GLN A 60 -16.128 -2.194 5.290 1.00 0.00 N ATOM 878 CA GLN A 60 -16.725 -1.650 4.078 1.00 0.00 C ATOM 879 C GLN A 60 -15.677 -0.873 3.287 1.00 0.00 C ATOM 880 O GLN A 60 -15.586 -0.996 2.067 1.00 0.00 O ATOM 881 CB GLN A 60 -17.903 -0.737 4.427 1.00 0.00 C ATOM 882 CG GLN A 60 -18.656 -0.213 3.212 1.00 0.00 C ATOM 883 CD GLN A 60 -19.770 0.750 3.576 1.00 0.00 C ATOM 884 OE1 GLN A 60 -19.684 1.479 4.562 1.00 0.00 O ATOM 885 NE2 GLN A 60 -20.819 0.766 2.773 1.00 0.00 N ATOM 0 H GLN A 60 -16.547 -1.850 6.154 1.00 0.00 H new ATOM 0 HA GLN A 60 -17.094 -2.475 3.468 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -18.597 -1.284 5.065 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -17.535 0.109 5.007 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -17.954 0.287 2.544 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -19.076 -1.054 2.661 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -20.852 0.145 1.965 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -21.596 1.399 2.961 1.00 0.00 H new ATOM 894 N ALA A 61 -14.877 -0.085 4.001 1.00 0.00 N ATOM 895 CA ALA A 61 -13.800 0.681 3.384 1.00 0.00 C ATOM 896 C ALA A 61 -12.756 -0.249 2.773 1.00 0.00 C ATOM 897 O ALA A 61 -12.223 0.021 1.695 1.00 0.00 O ATOM 898 CB ALA A 61 -13.155 1.609 4.405 1.00 0.00 C ATOM 0 H ALA A 61 -14.956 0.039 5.010 1.00 0.00 H new ATOM 0 HA ALA A 61 -14.226 1.287 2.585 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.353 2.173 3.928 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -13.904 2.300 4.793 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -12.746 1.019 5.225 1.00 0.00 H new ATOM 904 N LEU A 62 -12.479 -1.350 3.464 1.00 0.00 N ATOM 905 CA LEU A 62 -11.537 -2.351 2.976 1.00 0.00 C ATOM 906 C LEU A 62 -12.042 -2.982 1.681 1.00 0.00 C ATOM 907 O LEU A 62 -11.272 -3.202 0.743 1.00 0.00 O ATOM 908 CB LEU A 62 -11.308 -3.432 4.034 1.00 0.00 C ATOM 909 CG LEU A 62 -10.520 -2.987 5.268 1.00 0.00 C ATOM 910 CD1 LEU A 62 -10.533 -4.076 6.330 1.00 0.00 C ATOM 911 CD2 LEU A 62 -9.090 -2.643 4.883 1.00 0.00 C ATOM 0 H LEU A 62 -12.896 -1.572 4.368 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.589 -1.854 2.772 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -12.278 -3.809 4.360 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.782 -4.266 3.569 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.996 -2.097 5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.968 -3.742 7.200 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.562 -4.286 6.624 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.079 -4.982 5.928 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.540 -2.328 5.770 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.609 -3.520 4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.094 -1.834 4.152 1.00 0.00 H new ATOM 923 N LYS A 63 -13.339 -3.270 1.628 1.00 0.00 N ATOM 924 CA LYS A 63 -13.947 -3.805 0.416 1.00 0.00 C ATOM 925 C LYS A 63 -13.971 -2.747 -0.683 1.00 0.00 C ATOM 926 O LYS A 63 -13.771 -3.057 -1.855 1.00 0.00 O ATOM 927 CB LYS A 63 -15.364 -4.332 0.688 1.00 0.00 C ATOM 928 CG LYS A 63 -16.185 -4.522 -0.579 1.00 0.00 C ATOM 929 CD LYS A 63 -17.382 -5.439 -0.373 1.00 0.00 C ATOM 930 CE LYS A 63 -16.961 -6.897 -0.309 1.00 0.00 C ATOM 931 NZ LYS A 63 -18.116 -7.816 -0.481 1.00 0.00 N ATOM 0 H LYS A 63 -13.986 -3.142 2.406 1.00 0.00 H new ATOM 0 HA LYS A 63 -13.338 -4.644 0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -15.296 -5.283 1.216 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -15.883 -3.637 1.349 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -16.533 -3.551 -0.930 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -15.548 -4.934 -1.361 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -17.896 -5.167 0.549 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -18.093 -5.300 -1.187 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.221 -7.095 -1.084 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.480 -7.094 0.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.808 -8.795 -0.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -18.862 -7.566 0.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.487 -7.730 -1.449 1.00 0.00 H new ATOM 945 N SER A 64 -14.191 -1.495 -0.295 1.00 0.00 N ATOM 946 CA SER A 64 -14.206 -0.391 -1.246 1.00 0.00 C ATOM 947 C SER A 64 -12.833 -0.214 -1.899 1.00 0.00 C ATOM 948 O SER A 64 -12.734 0.215 -3.051 1.00 0.00 O ATOM 949 CB SER A 64 -14.637 0.903 -0.551 1.00 0.00 C ATOM 950 OG SER A 64 -15.915 0.759 0.052 1.00 0.00 O ATOM 0 H SER A 64 -14.361 -1.220 0.672 1.00 0.00 H new ATOM 0 HA SER A 64 -14.927 -0.625 -2.029 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.902 1.174 0.207 1.00 0.00 H new ATOM 0 HB3 SER A 64 -14.663 1.717 -1.275 1.00 0.00 H new ATOM 0 HG SER A 64 -15.835 0.214 0.863 1.00 0.00 H new ATOM 956 N GLY A 65 -11.779 -0.538 -1.155 1.00 0.00 N ATOM 957 CA GLY A 65 -10.441 -0.497 -1.707 1.00 0.00 C ATOM 958 C GLY A 65 -10.149 -1.702 -2.583 1.00 0.00 C ATOM 959 O GLY A 65 -9.335 -1.626 -3.503 1.00 0.00 O ATOM 0 H GLY A 65 -11.831 -0.828 -0.179 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.318 0.415 -2.292 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.715 -0.455 -0.895 1.00 0.00 H new ATOM 963 N GLY A 66 -10.832 -2.808 -2.300 1.00 0.00 N ATOM 964 CA GLY A 66 -10.633 -4.027 -3.063 1.00 0.00 C ATOM 965 C GLY A 66 -9.767 -5.031 -2.329 1.00 0.00 C ATOM 966 O GLY A 66 -9.192 -5.931 -2.941 1.00 0.00 O ATOM 0 H GLY A 66 -11.522 -2.881 -1.553 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.601 -4.478 -3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -10.171 -3.783 -4.019 1.00 0.00 H new ATOM 970 N LEU A 67 -9.685 -4.882 -1.012 1.00 0.00 N ATOM 971 CA LEU A 67 -8.807 -5.716 -0.201 1.00 0.00 C ATOM 972 C LEU A 67 -9.531 -6.925 0.383 1.00 0.00 C ATOM 973 O LEU A 67 -8.977 -8.026 0.419 1.00 0.00 O ATOM 974 CB LEU A 67 -8.187 -4.880 0.921 1.00 0.00 C ATOM 975 CG LEU A 67 -6.693 -4.587 0.763 1.00 0.00 C ATOM 976 CD1 LEU A 67 -6.393 -4.033 -0.620 1.00 0.00 C ATOM 977 CD2 LEU A 67 -6.228 -3.615 1.837 1.00 0.00 C ATOM 0 H LEU A 67 -10.217 -4.191 -0.483 1.00 0.00 H new ATOM 0 HA LEU A 67 -8.022 -6.097 -0.855 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.722 -3.933 0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -8.342 -5.398 1.867 1.00 0.00 H new ATOM 0 HG LEU A 67 -6.147 -5.523 0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.325 -3.833 -0.708 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -6.689 -4.761 -1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.949 -3.108 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.164 -3.416 1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.784 -2.682 1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.403 -4.050 2.821 1.00 0.00 H new ATOM 989 N VAL A 68 -10.764 -6.738 0.838 1.00 0.00 N ATOM 990 CA VAL A 68 -11.478 -7.818 1.508 1.00 0.00 C ATOM 991 C VAL A 68 -12.814 -8.126 0.840 1.00 0.00 C ATOM 992 O VAL A 68 -13.340 -7.327 0.062 1.00 0.00 O ATOM 993 CB VAL A 68 -11.732 -7.513 3.003 1.00 0.00 C ATOM 994 CG1 VAL A 68 -10.429 -7.201 3.725 1.00 0.00 C ATOM 995 CG2 VAL A 68 -12.729 -6.376 3.167 1.00 0.00 C ATOM 0 H VAL A 68 -11.283 -5.864 0.758 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.827 -8.688 1.427 1.00 0.00 H new ATOM 0 HB VAL A 68 -12.163 -8.405 3.457 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.636 -6.990 4.774 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.759 -8.057 3.652 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.958 -6.332 3.266 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.889 -6.183 4.228 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.338 -5.478 2.689 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -13.675 -6.652 2.702 1.00 0.00 H new ATOM 1005 N GLU A 69 -13.349 -9.292 1.166 1.00 0.00 N ATOM 1006 CA GLU A 69 -14.650 -9.723 0.687 1.00 0.00 C ATOM 1007 C GLU A 69 -15.528 -10.126 1.865 1.00 0.00 C ATOM 1008 O GLU A 69 -15.055 -10.201 3.001 1.00 0.00 O ATOM 1009 CB GLU A 69 -14.508 -10.896 -0.287 1.00 0.00 C ATOM 1010 CG GLU A 69 -14.756 -10.520 -1.738 1.00 0.00 C ATOM 1011 CD GLU A 69 -16.164 -10.006 -1.975 1.00 0.00 C ATOM 1012 OE1 GLU A 69 -17.031 -10.190 -1.090 1.00 0.00 O ATOM 1013 OE2 GLU A 69 -16.413 -9.414 -3.043 1.00 0.00 O ATOM 0 H GLU A 69 -12.889 -9.969 1.774 1.00 0.00 H new ATOM 0 HA GLU A 69 -15.117 -8.892 0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -13.505 -11.313 -0.196 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.207 -11.681 -0.000 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.039 -9.756 -2.039 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -14.580 -11.390 -2.370 1.00 0.00 H new ATOM 1020 N ALA A 70 -16.794 -10.402 1.594 1.00 0.00 N ATOM 1021 CA ALA A 70 -17.743 -10.736 2.646 1.00 0.00 C ATOM 1022 C ALA A 70 -18.747 -11.771 2.166 1.00 0.00 C ATOM 1023 O ALA A 70 -19.311 -11.647 1.078 1.00 0.00 O ATOM 1024 CB ALA A 70 -18.470 -9.485 3.116 1.00 0.00 C ATOM 0 H ALA A 70 -17.189 -10.401 0.654 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.186 -11.160 3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -19.177 -9.749 3.903 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -17.747 -8.768 3.504 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -19.008 -9.041 2.279 1.00 0.00 H new ATOM 1030 N ARG A 71 -18.958 -12.792 2.979 1.00 0.00 N ATOM 1031 CA ARG A 71 -19.950 -13.814 2.691 1.00 0.00 C ATOM 1032 C ARG A 71 -20.923 -13.937 3.852 1.00 0.00 C ATOM 1033 O ARG A 71 -20.515 -14.186 4.986 1.00 0.00 O ATOM 1034 CB ARG A 71 -19.289 -15.174 2.443 1.00 0.00 C ATOM 1035 CG ARG A 71 -18.461 -15.241 1.173 1.00 0.00 C ATOM 1036 CD ARG A 71 -17.933 -16.646 0.941 1.00 0.00 C ATOM 1037 NE ARG A 71 -17.227 -16.773 -0.332 1.00 0.00 N ATOM 1038 CZ ARG A 71 -17.617 -17.581 -1.317 1.00 0.00 C ATOM 1039 NH1 ARG A 71 -18.732 -18.296 -1.194 1.00 0.00 N ATOM 1040 NH2 ARG A 71 -16.895 -17.671 -2.427 1.00 0.00 N ATOM 0 H ARG A 71 -18.450 -12.936 3.852 1.00 0.00 H new ATOM 0 HA ARG A 71 -20.484 -13.515 1.789 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -18.650 -15.415 3.293 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -20.064 -15.939 2.399 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -19.068 -14.932 0.322 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -17.627 -14.542 1.241 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -17.261 -16.917 1.755 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -18.763 -17.352 0.965 1.00 0.00 H new ATOM 0 HE ARG A 71 -16.388 -16.211 -0.475 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -19.291 -18.227 -0.344 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -19.028 -18.914 -1.950 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -16.041 -17.122 -2.526 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -17.194 -18.290 -3.181 1.00 0.00 H new ATOM 1054 N ARG A 72 -22.205 -13.740 3.584 1.00 0.00 N ATOM 1055 CA ARG A 72 -23.217 -13.962 4.602 1.00 0.00 C ATOM 1056 C ARG A 72 -23.520 -15.451 4.677 1.00 0.00 C ATOM 1057 O ARG A 72 -24.292 -15.981 3.876 1.00 0.00 O ATOM 1058 CB ARG A 72 -24.491 -13.170 4.298 1.00 0.00 C ATOM 1059 CG ARG A 72 -25.496 -13.185 5.440 1.00 0.00 C ATOM 1060 CD ARG A 72 -26.780 -12.450 5.080 1.00 0.00 C ATOM 1061 NE ARG A 72 -26.533 -11.093 4.593 1.00 0.00 N ATOM 1062 CZ ARG A 72 -26.449 -10.014 5.370 1.00 0.00 C ATOM 1063 NH1 ARG A 72 -26.583 -10.114 6.689 1.00 0.00 N ATOM 1064 NH2 ARG A 72 -26.232 -8.827 4.823 1.00 0.00 N ATOM 0 H ARG A 72 -22.565 -13.431 2.681 1.00 0.00 H new ATOM 0 HA ARG A 72 -22.839 -13.613 5.563 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -24.224 -12.138 4.072 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -24.961 -13.580 3.404 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -25.730 -14.216 5.703 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -25.050 -12.725 6.322 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -27.316 -13.014 4.317 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -27.427 -12.406 5.956 1.00 0.00 H new ATOM 0 HE ARG A 72 -26.417 -10.964 3.588 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -26.752 -11.024 7.117 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -26.517 -9.280 7.273 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -26.130 -8.742 3.812 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -26.167 -7.998 5.413 1.00 0.00 H new ATOM 1078 N GLU A 73 -22.883 -16.121 5.618 1.00 0.00 N ATOM 1079 CA GLU A 73 -22.992 -17.564 5.740 1.00 0.00 C ATOM 1080 C GLU A 73 -23.789 -17.923 6.988 1.00 0.00 C ATOM 1081 O GLU A 73 -23.509 -17.421 8.080 1.00 0.00 O ATOM 1082 CB GLU A 73 -21.594 -18.190 5.795 1.00 0.00 C ATOM 1083 CG GLU A 73 -21.585 -19.698 5.608 1.00 0.00 C ATOM 1084 CD GLU A 73 -22.142 -20.113 4.262 1.00 0.00 C ATOM 1085 OE1 GLU A 73 -21.413 -20.020 3.254 1.00 0.00 O ATOM 1086 OE2 GLU A 73 -23.316 -20.526 4.206 1.00 0.00 O ATOM 0 H GLU A 73 -22.279 -15.685 6.315 1.00 0.00 H new ATOM 0 HA GLU A 73 -23.516 -17.959 4.870 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -20.973 -17.735 5.024 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.137 -17.950 6.755 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -20.564 -20.068 5.706 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.171 -20.164 6.401 1.00 0.00 H new ATOM 1093 N GLY A 74 -24.786 -18.780 6.823 1.00 0.00 N ATOM 1094 CA GLY A 74 -25.643 -19.135 7.933 1.00 0.00 C ATOM 1095 C GLY A 74 -26.557 -17.991 8.314 1.00 0.00 C ATOM 1096 O GLY A 74 -27.566 -17.746 7.652 1.00 0.00 O ATOM 0 H GLY A 74 -25.016 -19.235 5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -26.241 -20.007 7.668 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -25.032 -19.416 8.791 1.00 0.00 H new ATOM 1100 N THR A 75 -26.197 -17.286 9.373 1.00 0.00 N ATOM 1101 CA THR A 75 -26.961 -16.131 9.816 1.00 0.00 C ATOM 1102 C THR A 75 -26.032 -14.942 10.077 1.00 0.00 C ATOM 1103 O THR A 75 -26.472 -13.856 10.460 1.00 0.00 O ATOM 1104 CB THR A 75 -27.769 -16.473 11.090 1.00 0.00 C ATOM 1105 OG1 THR A 75 -28.435 -17.730 10.913 1.00 0.00 O ATOM 1106 CG2 THR A 75 -28.809 -15.403 11.393 1.00 0.00 C ATOM 0 H THR A 75 -25.378 -17.494 9.944 1.00 0.00 H new ATOM 0 HA THR A 75 -27.660 -15.857 9.026 1.00 0.00 H new ATOM 0 HB THR A 75 -27.071 -16.525 11.925 1.00 0.00 H new ATOM 0 HG1 THR A 75 -28.945 -17.946 11.721 1.00 0.00 H new ATOM 0 HG21 THR A 75 -29.359 -15.675 12.294 1.00 0.00 H new ATOM 0 HG22 THR A 75 -28.312 -14.445 11.546 1.00 0.00 H new ATOM 0 HG23 THR A 75 -29.502 -15.322 10.556 1.00 0.00 H new ATOM 1114 N ARG A 76 -24.743 -15.136 9.831 1.00 0.00 N ATOM 1115 CA ARG A 76 -23.753 -14.112 10.141 1.00 0.00 C ATOM 1116 C ARG A 76 -23.023 -13.661 8.886 1.00 0.00 C ATOM 1117 O ARG A 76 -23.140 -14.284 7.830 1.00 0.00 O ATOM 1118 CB ARG A 76 -22.730 -14.647 11.142 1.00 0.00 C ATOM 1119 CG ARG A 76 -23.342 -15.318 12.357 1.00 0.00 C ATOM 1120 CD ARG A 76 -22.268 -15.779 13.324 1.00 0.00 C ATOM 1121 NE ARG A 76 -22.798 -16.661 14.359 1.00 0.00 N ATOM 1122 CZ ARG A 76 -22.284 -16.763 15.580 1.00 0.00 C ATOM 1123 NH1 ARG A 76 -21.317 -15.937 15.972 1.00 0.00 N ATOM 1124 NH2 ARG A 76 -22.763 -17.667 16.419 1.00 0.00 N ATOM 0 H ARG A 76 -24.360 -15.987 9.420 1.00 0.00 H new ATOM 0 HA ARG A 76 -24.282 -13.262 10.572 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -22.081 -15.361 10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.099 -13.823 11.475 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -24.015 -14.623 12.860 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -23.942 -16.171 12.041 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -21.484 -16.299 12.773 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -21.806 -14.910 13.792 1.00 0.00 H new ATOM 0 HE ARG A 76 -23.611 -17.233 14.132 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -20.967 -15.222 15.334 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -20.925 -16.019 16.910 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -23.523 -18.281 16.127 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -22.372 -17.750 17.357 1.00 0.00 H new ATOM 1138 N GLN A 77 -22.270 -12.580 9.008 1.00 0.00 N ATOM 1139 CA GLN A 77 -21.422 -12.120 7.926 1.00 0.00 C ATOM 1140 C GLN A 77 -19.979 -12.502 8.208 1.00 0.00 C ATOM 1141 O GLN A 77 -19.424 -12.141 9.245 1.00 0.00 O ATOM 1142 CB GLN A 77 -21.516 -10.604 7.749 1.00 0.00 C ATOM 1143 CG GLN A 77 -22.911 -10.099 7.431 1.00 0.00 C ATOM 1144 CD GLN A 77 -22.919 -8.626 7.075 1.00 0.00 C ATOM 1145 OE1 GLN A 77 -23.765 -8.163 6.313 1.00 0.00 O ATOM 1146 NE2 GLN A 77 -21.970 -7.880 7.620 1.00 0.00 N ATOM 0 H GLN A 77 -22.230 -12.005 9.849 1.00 0.00 H new ATOM 0 HA GLN A 77 -21.764 -12.596 7.007 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -21.166 -10.121 8.661 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -20.841 -10.301 6.949 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -23.323 -10.674 6.602 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -23.561 -10.267 8.290 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -21.286 -8.303 8.248 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -21.923 -6.883 7.412 1.00 0.00 H new ATOM 1155 N TYR A 78 -19.383 -13.241 7.297 1.00 0.00 N ATOM 1156 CA TYR A 78 -17.993 -13.631 7.432 1.00 0.00 C ATOM 1157 C TYR A 78 -17.150 -12.866 6.426 1.00 0.00 C ATOM 1158 O TYR A 78 -17.430 -12.888 5.227 1.00 0.00 O ATOM 1159 CB TYR A 78 -17.832 -15.141 7.223 1.00 0.00 C ATOM 1160 CG TYR A 78 -18.543 -15.982 8.264 1.00 0.00 C ATOM 1161 CD1 TYR A 78 -19.917 -16.163 8.218 1.00 0.00 C ATOM 1162 CD2 TYR A 78 -17.837 -16.588 9.296 1.00 0.00 C ATOM 1163 CE1 TYR A 78 -20.570 -16.923 9.166 1.00 0.00 C ATOM 1164 CE2 TYR A 78 -18.485 -17.351 10.251 1.00 0.00 C ATOM 1165 CZ TYR A 78 -19.851 -17.513 10.181 1.00 0.00 C ATOM 1166 OH TYR A 78 -20.506 -18.273 11.125 1.00 0.00 O ATOM 0 H TYR A 78 -19.839 -13.585 6.452 1.00 0.00 H new ATOM 0 HA TYR A 78 -17.655 -13.391 8.440 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -18.212 -15.404 6.236 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -16.771 -15.389 7.233 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -20.486 -15.700 7.425 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -16.766 -16.461 9.354 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -21.641 -17.055 9.112 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -17.923 -17.817 11.047 1.00 0.00 H new ATOM 0 HH TYR A 78 -19.858 -18.621 11.772 1.00 0.00 H new ATOM 1176 N TYR A 79 -16.134 -12.180 6.913 1.00 0.00 N ATOM 1177 CA TYR A 79 -15.265 -11.408 6.047 1.00 0.00 C ATOM 1178 C TYR A 79 -13.980 -12.165 5.776 1.00 0.00 C ATOM 1179 O TYR A 79 -13.502 -12.933 6.612 1.00 0.00 O ATOM 1180 CB TYR A 79 -14.969 -10.028 6.643 1.00 0.00 C ATOM 1181 CG TYR A 79 -16.047 -9.004 6.357 1.00 0.00 C ATOM 1182 CD1 TYR A 79 -17.234 -8.988 7.077 1.00 0.00 C ATOM 1183 CD2 TYR A 79 -15.871 -8.051 5.359 1.00 0.00 C ATOM 1184 CE1 TYR A 79 -18.218 -8.054 6.811 1.00 0.00 C ATOM 1185 CE2 TYR A 79 -16.849 -7.113 5.087 1.00 0.00 C ATOM 1186 CZ TYR A 79 -18.022 -7.118 5.817 1.00 0.00 C ATOM 1187 OH TYR A 79 -19.002 -6.190 5.552 1.00 0.00 O ATOM 0 H TYR A 79 -15.890 -12.142 7.903 1.00 0.00 H new ATOM 0 HA TYR A 79 -15.783 -11.254 5.100 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -14.848 -10.125 7.722 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -14.020 -9.666 6.247 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -17.391 -9.717 7.858 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -14.955 -8.044 4.787 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -19.136 -8.057 7.379 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -16.697 -6.380 4.308 1.00 0.00 H new ATOM 0 HH TYR A 79 -18.708 -5.602 4.825 1.00 0.00 H new ATOM 1197 N ARG A 80 -13.443 -11.950 4.593 1.00 0.00 N ATOM 1198 CA ARG A 80 -12.267 -12.660 4.135 1.00 0.00 C ATOM 1199 C ARG A 80 -11.422 -11.722 3.294 1.00 0.00 C ATOM 1200 O ARG A 80 -11.869 -10.634 2.943 1.00 0.00 O ATOM 1201 CB ARG A 80 -12.691 -13.871 3.298 1.00 0.00 C ATOM 1202 CG ARG A 80 -13.297 -13.488 1.954 1.00 0.00 C ATOM 1203 CD ARG A 80 -14.039 -14.643 1.298 1.00 0.00 C ATOM 1204 NE ARG A 80 -13.246 -15.871 1.253 1.00 0.00 N ATOM 1205 CZ ARG A 80 -12.456 -16.222 0.235 1.00 0.00 C ATOM 1206 NH1 ARG A 80 -12.302 -15.411 -0.803 1.00 0.00 N ATOM 1207 NH2 ARG A 80 -11.811 -17.380 0.264 1.00 0.00 N ATOM 0 H ARG A 80 -13.810 -11.277 3.921 1.00 0.00 H new ATOM 0 HA ARG A 80 -11.687 -13.007 4.990 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -11.824 -14.510 3.130 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -13.415 -14.459 3.862 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -13.983 -12.652 2.093 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -12.506 -13.143 1.288 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -14.963 -14.832 1.844 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -14.320 -14.360 0.284 1.00 0.00 H new ATOM 0 HE ARG A 80 -13.300 -16.502 2.053 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -12.788 -14.515 -0.826 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -11.697 -15.684 -1.578 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -11.918 -18.003 1.064 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -11.208 -17.647 -0.514 1.00 0.00 H new ATOM 1221 N ILE A 81 -10.215 -12.134 2.964 1.00 0.00 N ATOM 1222 CA ILE A 81 -9.379 -11.354 2.069 1.00 0.00 C ATOM 1223 C ILE A 81 -9.760 -11.666 0.620 1.00 0.00 C ATOM 1224 O ILE A 81 -10.038 -12.820 0.284 1.00 0.00 O ATOM 1225 CB ILE A 81 -7.878 -11.632 2.315 1.00 0.00 C ATOM 1226 CG1 ILE A 81 -7.540 -11.382 3.790 1.00 0.00 C ATOM 1227 CG2 ILE A 81 -7.013 -10.758 1.415 1.00 0.00 C ATOM 1228 CD1 ILE A 81 -6.097 -11.660 4.147 1.00 0.00 C ATOM 0 H ILE A 81 -9.791 -12.999 3.299 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.547 -10.295 2.266 1.00 0.00 H new ATOM 0 HB ILE A 81 -7.670 -12.674 2.074 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.770 -10.345 4.034 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -8.184 -12.006 4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.961 -10.970 1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.244 -10.970 0.371 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -7.215 -9.708 1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.939 -11.459 5.207 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.865 -12.704 3.937 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.445 -11.017 3.555 1.00 0.00 H new ATOM 1240 N ALA A 82 -9.784 -10.643 -0.228 1.00 0.00 N ATOM 1241 CA ALA A 82 -10.271 -10.781 -1.601 1.00 0.00 C ATOM 1242 C ALA A 82 -9.215 -11.383 -2.528 1.00 0.00 C ATOM 1243 O ALA A 82 -9.096 -10.990 -3.694 1.00 0.00 O ATOM 1244 CB ALA A 82 -10.719 -9.428 -2.126 1.00 0.00 C ATOM 0 H ALA A 82 -9.470 -9.702 0.011 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.117 -11.468 -1.585 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -11.081 -9.536 -3.149 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -11.520 -9.041 -1.497 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.878 -8.735 -2.110 1.00 0.00 H new ATOM 1250 N GLY A 83 -8.480 -12.354 -2.015 1.00 0.00 N ATOM 1251 CA GLY A 83 -7.454 -13.011 -2.793 1.00 0.00 C ATOM 1252 C GLY A 83 -6.244 -13.356 -1.955 1.00 0.00 C ATOM 1253 O GLY A 83 -5.814 -12.554 -1.125 1.00 0.00 O ATOM 0 H GLY A 83 -8.578 -12.703 -1.061 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -7.860 -13.921 -3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.153 -12.364 -3.616 1.00 0.00 H new ATOM 1257 N GLU A 84 -5.694 -14.543 -2.162 1.00 0.00 N ATOM 1258 CA GLU A 84 -4.515 -14.974 -1.422 1.00 0.00 C ATOM 1259 C GLU A 84 -3.318 -14.100 -1.785 1.00 0.00 C ATOM 1260 O GLU A 84 -2.433 -13.867 -0.963 1.00 0.00 O ATOM 1261 CB GLU A 84 -4.203 -16.444 -1.705 1.00 0.00 C ATOM 1262 CG GLU A 84 -3.057 -16.984 -0.868 1.00 0.00 C ATOM 1263 CD GLU A 84 -2.687 -18.404 -1.227 1.00 0.00 C ATOM 1264 OE1 GLU A 84 -2.365 -18.656 -2.402 1.00 0.00 O ATOM 1265 OE2 GLU A 84 -2.680 -19.268 -0.326 1.00 0.00 O ATOM 0 H GLU A 84 -6.044 -15.225 -2.835 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.720 -14.868 -0.357 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.095 -17.041 -1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.959 -16.560 -2.761 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.185 -16.343 -0.997 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.331 -16.940 0.186 1.00 0.00 H new ATOM 1272 N ASP A 85 -3.309 -13.598 -3.013 1.00 0.00 N ATOM 1273 CA ASP A 85 -2.254 -12.696 -3.458 1.00 0.00 C ATOM 1274 C ASP A 85 -2.312 -11.396 -2.664 1.00 0.00 C ATOM 1275 O ASP A 85 -1.286 -10.797 -2.350 1.00 0.00 O ATOM 1276 CB ASP A 85 -2.378 -12.407 -4.957 1.00 0.00 C ATOM 1277 CG ASP A 85 -2.147 -13.638 -5.810 1.00 0.00 C ATOM 1278 OD1 ASP A 85 -3.098 -14.426 -5.998 1.00 0.00 O ATOM 1279 OD2 ASP A 85 -1.011 -13.832 -6.291 1.00 0.00 O ATOM 0 H ASP A 85 -4.019 -13.799 -3.718 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.292 -13.178 -3.284 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -3.370 -12.007 -5.165 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.659 -11.637 -5.235 1.00 0.00 H new ATOM 1284 N VAL A 86 -3.529 -10.982 -2.322 1.00 0.00 N ATOM 1285 CA VAL A 86 -3.738 -9.797 -1.499 1.00 0.00 C ATOM 1286 C VAL A 86 -3.320 -10.085 -0.059 1.00 0.00 C ATOM 1287 O VAL A 86 -2.778 -9.220 0.633 1.00 0.00 O ATOM 1288 CB VAL A 86 -5.216 -9.346 -1.526 1.00 0.00 C ATOM 1289 CG1 VAL A 86 -5.400 -8.043 -0.761 1.00 0.00 C ATOM 1290 CG2 VAL A 86 -5.705 -9.204 -2.961 1.00 0.00 C ATOM 0 H VAL A 86 -4.389 -11.453 -2.604 1.00 0.00 H new ATOM 0 HA VAL A 86 -3.127 -8.993 -1.908 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.815 -10.112 -1.034 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.448 -7.746 -0.794 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.096 -8.184 0.276 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.788 -7.264 -1.216 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.748 -8.886 -2.960 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.099 -8.461 -3.480 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.619 -10.163 -3.471 1.00 0.00 H new ATOM 1300 N ALA A 87 -3.561 -11.316 0.380 1.00 0.00 N ATOM 1301 CA ALA A 87 -3.167 -11.749 1.715 1.00 0.00 C ATOM 1302 C ALA A 87 -1.651 -11.707 1.874 1.00 0.00 C ATOM 1303 O ALA A 87 -1.132 -11.211 2.874 1.00 0.00 O ATOM 1304 CB ALA A 87 -3.686 -13.153 1.990 1.00 0.00 C ATOM 0 H ALA A 87 -4.030 -12.034 -0.173 1.00 0.00 H new ATOM 0 HA ALA A 87 -3.606 -11.063 2.439 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.384 -13.463 2.990 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.774 -13.159 1.921 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -3.272 -13.844 1.256 1.00 0.00 H new ATOM 1310 N ARG A 88 -0.940 -12.218 0.875 1.00 0.00 N ATOM 1311 CA ARG A 88 0.517 -12.228 0.911 1.00 0.00 C ATOM 1312 C ARG A 88 1.075 -10.828 0.697 1.00 0.00 C ATOM 1313 O ARG A 88 2.214 -10.551 1.058 1.00 0.00 O ATOM 1314 CB ARG A 88 1.092 -13.196 -0.125 1.00 0.00 C ATOM 1315 CG ARG A 88 0.728 -14.646 0.147 1.00 0.00 C ATOM 1316 CD ARG A 88 1.567 -15.609 -0.680 1.00 0.00 C ATOM 1317 NE ARG A 88 1.461 -15.346 -2.113 1.00 0.00 N ATOM 1318 CZ ARG A 88 0.681 -16.037 -2.938 1.00 0.00 C ATOM 1319 NH1 ARG A 88 -0.050 -17.043 -2.478 1.00 0.00 N ATOM 1320 NH2 ARG A 88 0.637 -15.722 -4.225 1.00 0.00 N ATOM 0 H ARG A 88 -1.347 -12.629 0.035 1.00 0.00 H new ATOM 0 HA ARG A 88 0.819 -12.573 1.900 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.730 -12.916 -1.115 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.177 -13.097 -0.143 1.00 0.00 H new ATOM 0 HG2 ARG A 88 0.867 -14.862 1.206 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -0.328 -14.803 -0.075 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.611 -15.532 -0.375 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.249 -16.632 -0.476 1.00 0.00 H new ATOM 0 HE ARG A 88 2.019 -14.587 -2.504 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.015 -17.288 -1.489 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.648 -17.571 -3.114 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.201 -14.950 -4.581 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.039 -16.251 -4.859 1.00 0.00 H new ATOM 1334 N LEU A 89 0.267 -9.948 0.117 1.00 0.00 N ATOM 1335 CA LEU A 89 0.642 -8.546 -0.038 1.00 0.00 C ATOM 1336 C LEU A 89 0.825 -7.916 1.340 1.00 0.00 C ATOM 1337 O LEU A 89 1.846 -7.281 1.616 1.00 0.00 O ATOM 1338 CB LEU A 89 -0.434 -7.801 -0.853 1.00 0.00 C ATOM 1339 CG LEU A 89 -0.089 -6.368 -1.295 1.00 0.00 C ATOM 1340 CD1 LEU A 89 -0.948 -5.965 -2.485 1.00 0.00 C ATOM 1341 CD2 LEU A 89 -0.293 -5.378 -0.158 1.00 0.00 C ATOM 0 H LEU A 89 -0.654 -10.180 -0.255 1.00 0.00 H new ATOM 0 HA LEU A 89 1.585 -8.473 -0.580 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.656 -8.389 -1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -1.348 -7.765 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 89 0.962 -6.350 -1.583 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.695 -4.949 -2.789 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.764 -6.648 -3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.001 -6.009 -2.205 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.041 -4.374 -0.500 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -1.335 -5.402 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.351 -5.648 0.679 1.00 0.00 H new ATOM 1353 N PHE A 90 -0.162 -8.117 2.208 1.00 0.00 N ATOM 1354 CA PHE A 90 -0.101 -7.595 3.567 1.00 0.00 C ATOM 1355 C PHE A 90 1.009 -8.286 4.354 1.00 0.00 C ATOM 1356 O PHE A 90 1.700 -7.660 5.158 1.00 0.00 O ATOM 1357 CB PHE A 90 -1.448 -7.780 4.276 1.00 0.00 C ATOM 1358 CG PHE A 90 -1.477 -7.228 5.676 1.00 0.00 C ATOM 1359 CD1 PHE A 90 -1.507 -5.858 5.895 1.00 0.00 C ATOM 1360 CD2 PHE A 90 -1.467 -8.078 6.772 1.00 0.00 C ATOM 1361 CE1 PHE A 90 -1.531 -5.348 7.179 1.00 0.00 C ATOM 1362 CE2 PHE A 90 -1.490 -7.572 8.059 1.00 0.00 C ATOM 1363 CZ PHE A 90 -1.522 -6.207 8.263 1.00 0.00 C ATOM 0 H PHE A 90 -1.013 -8.637 1.994 1.00 0.00 H new ATOM 0 HA PHE A 90 0.120 -6.529 3.515 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.227 -7.295 3.688 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.688 -8.843 4.309 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.512 -5.183 5.052 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.441 -9.147 6.619 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.557 -4.280 7.336 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.483 -8.244 8.904 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.540 -5.811 9.267 1.00 0.00 H new ATOM 1373 N ALA A 91 1.177 -9.579 4.111 1.00 0.00 N ATOM 1374 CA ALA A 91 2.228 -10.345 4.763 1.00 0.00 C ATOM 1375 C ALA A 91 3.608 -9.833 4.355 1.00 0.00 C ATOM 1376 O ALA A 91 4.483 -9.644 5.197 1.00 0.00 O ATOM 1377 CB ALA A 91 2.086 -11.823 4.429 1.00 0.00 C ATOM 0 H ALA A 91 0.598 -10.118 3.467 1.00 0.00 H new ATOM 0 HA ALA A 91 2.127 -10.219 5.841 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.878 -12.385 4.923 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.117 -12.183 4.774 1.00 0.00 H new ATOM 0 HB3 ALA A 91 2.161 -11.961 3.350 1.00 0.00 H new ATOM 1383 N LEU A 92 3.780 -9.591 3.059 1.00 0.00 N ATOM 1384 CA LEU A 92 5.050 -9.125 2.512 1.00 0.00 C ATOM 1385 C LEU A 92 5.460 -7.796 3.143 1.00 0.00 C ATOM 1386 O LEU A 92 6.579 -7.660 3.641 1.00 0.00 O ATOM 1387 CB LEU A 92 4.941 -8.995 0.983 1.00 0.00 C ATOM 1388 CG LEU A 92 6.238 -8.660 0.231 1.00 0.00 C ATOM 1389 CD1 LEU A 92 6.165 -9.183 -1.196 1.00 0.00 C ATOM 1390 CD2 LEU A 92 6.487 -7.157 0.209 1.00 0.00 C ATOM 0 H LEU A 92 3.046 -9.712 2.361 1.00 0.00 H new ATOM 0 HA LEU A 92 5.824 -9.856 2.749 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.549 -9.932 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.206 -8.222 0.758 1.00 0.00 H new ATOM 0 HG LEU A 92 7.064 -9.141 0.755 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.089 -8.940 -1.720 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.030 -10.264 -1.181 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.323 -8.719 -1.711 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.412 -6.949 -0.330 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.656 -6.658 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.572 -6.787 1.231 1.00 0.00 H new ATOM 1402 N VAL A 93 4.548 -6.829 3.138 1.00 0.00 N ATOM 1403 CA VAL A 93 4.844 -5.507 3.679 1.00 0.00 C ATOM 1404 C VAL A 93 5.074 -5.574 5.193 1.00 0.00 C ATOM 1405 O VAL A 93 5.857 -4.804 5.743 1.00 0.00 O ATOM 1406 CB VAL A 93 3.729 -4.483 3.340 1.00 0.00 C ATOM 1407 CG1 VAL A 93 2.410 -4.847 4.004 1.00 0.00 C ATOM 1408 CG2 VAL A 93 4.155 -3.073 3.726 1.00 0.00 C ATOM 0 H VAL A 93 3.603 -6.935 2.768 1.00 0.00 H new ATOM 0 HA VAL A 93 5.763 -5.162 3.205 1.00 0.00 H new ATOM 0 HB VAL A 93 3.573 -4.515 2.262 1.00 0.00 H new ATOM 0 HG11 VAL A 93 1.654 -4.106 3.743 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.089 -5.830 3.660 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.540 -4.866 5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.358 -2.372 3.479 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.354 -3.034 4.797 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.058 -2.803 3.179 1.00 0.00 H new ATOM 1418 N GLN A 94 4.416 -6.523 5.854 1.00 0.00 N ATOM 1419 CA GLN A 94 4.599 -6.717 7.286 1.00 0.00 C ATOM 1420 C GLN A 94 5.997 -7.269 7.570 1.00 0.00 C ATOM 1421 O GLN A 94 6.657 -6.854 8.523 1.00 0.00 O ATOM 1422 CB GLN A 94 3.527 -7.662 7.839 1.00 0.00 C ATOM 1423 CG GLN A 94 3.557 -7.805 9.353 1.00 0.00 C ATOM 1424 CD GLN A 94 2.445 -8.690 9.881 1.00 0.00 C ATOM 1425 OE1 GLN A 94 2.610 -9.904 10.007 1.00 0.00 O ATOM 1426 NE2 GLN A 94 1.307 -8.091 10.193 1.00 0.00 N ATOM 0 H GLN A 94 3.754 -7.167 5.421 1.00 0.00 H new ATOM 0 HA GLN A 94 4.498 -5.753 7.784 1.00 0.00 H new ATOM 0 HB2 GLN A 94 2.545 -7.299 7.537 1.00 0.00 H new ATOM 0 HB3 GLN A 94 3.655 -8.646 7.388 1.00 0.00 H new ATOM 0 HG2 GLN A 94 4.519 -8.219 9.655 1.00 0.00 H new ATOM 0 HG3 GLN A 94 3.477 -6.818 9.808 1.00 0.00 H new ATOM 0 HE21 GLN A 94 1.212 -7.082 10.073 1.00 0.00 H new ATOM 0 HE22 GLN A 94 0.525 -8.638 10.553 1.00 0.00 H new ATOM 1435 N VAL A 95 6.444 -8.197 6.728 1.00 0.00 N ATOM 1436 CA VAL A 95 7.786 -8.760 6.845 1.00 0.00 C ATOM 1437 C VAL A 95 8.838 -7.677 6.632 1.00 0.00 C ATOM 1438 O VAL A 95 9.786 -7.557 7.411 1.00 0.00 O ATOM 1439 CB VAL A 95 8.012 -9.909 5.835 1.00 0.00 C ATOM 1440 CG1 VAL A 95 9.462 -10.369 5.850 1.00 0.00 C ATOM 1441 CG2 VAL A 95 7.083 -11.075 6.139 1.00 0.00 C ATOM 0 H VAL A 95 5.895 -8.576 5.956 1.00 0.00 H new ATOM 0 HA VAL A 95 7.882 -9.167 7.852 1.00 0.00 H new ATOM 0 HB VAL A 95 7.785 -9.532 4.838 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.595 -11.178 5.131 1.00 0.00 H new ATOM 0 HG12 VAL A 95 10.111 -9.535 5.582 1.00 0.00 H new ATOM 0 HG13 VAL A 95 9.721 -10.724 6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 95 7.255 -11.875 5.419 1.00 0.00 H new ATOM 0 HG22 VAL A 95 7.280 -11.444 7.145 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.047 -10.742 6.071 1.00 0.00 H new ATOM 1451 N VAL A 96 8.657 -6.885 5.580 1.00 0.00 N ATOM 1452 CA VAL A 96 9.553 -5.769 5.299 1.00 0.00 C ATOM 1453 C VAL A 96 9.560 -4.781 6.462 1.00 0.00 C ATOM 1454 O VAL A 96 10.609 -4.254 6.836 1.00 0.00 O ATOM 1455 CB VAL A 96 9.163 -5.042 3.991 1.00 0.00 C ATOM 1456 CG1 VAL A 96 9.955 -3.753 3.817 1.00 0.00 C ATOM 1457 CG2 VAL A 96 9.385 -5.952 2.796 1.00 0.00 C ATOM 0 H VAL A 96 7.898 -6.995 4.908 1.00 0.00 H new ATOM 0 HA VAL A 96 10.555 -6.179 5.172 1.00 0.00 H new ATOM 0 HB VAL A 96 8.106 -4.785 4.055 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.658 -3.266 2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.755 -3.087 4.656 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.020 -3.982 3.782 1.00 0.00 H new ATOM 0 HG21 VAL A 96 9.106 -5.427 1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.436 -6.236 2.745 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.772 -6.847 2.902 1.00 0.00 H new ATOM 1467 N ALA A 97 8.387 -4.548 7.039 1.00 0.00 N ATOM 1468 CA ALA A 97 8.262 -3.665 8.188 1.00 0.00 C ATOM 1469 C ALA A 97 9.099 -4.175 9.355 1.00 0.00 C ATOM 1470 O ALA A 97 9.872 -3.423 9.941 1.00 0.00 O ATOM 1471 CB ALA A 97 6.804 -3.530 8.602 1.00 0.00 C ATOM 0 H ALA A 97 7.508 -4.960 6.727 1.00 0.00 H new ATOM 0 HA ALA A 97 8.635 -2.681 7.902 1.00 0.00 H new ATOM 0 HB1 ALA A 97 6.730 -2.866 9.463 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.228 -3.117 7.774 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.408 -4.511 8.866 1.00 0.00 H new ATOM 1477 N ASP A 98 8.958 -5.458 9.671 1.00 0.00 N ATOM 1478 CA ASP A 98 9.689 -6.066 10.783 1.00 0.00 C ATOM 1479 C ASP A 98 11.195 -6.069 10.538 1.00 0.00 C ATOM 1480 O ASP A 98 11.974 -5.663 11.402 1.00 0.00 O ATOM 1481 CB ASP A 98 9.208 -7.499 11.021 1.00 0.00 C ATOM 1482 CG ASP A 98 10.039 -8.225 12.064 1.00 0.00 C ATOM 1483 OD1 ASP A 98 9.816 -8.001 13.273 1.00 0.00 O ATOM 1484 OD2 ASP A 98 10.926 -9.018 11.677 1.00 0.00 O ATOM 0 H ASP A 98 8.343 -6.101 9.172 1.00 0.00 H new ATOM 0 HA ASP A 98 9.489 -5.461 11.668 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.166 -7.481 11.340 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.245 -8.052 10.082 1.00 0.00 H new ATOM 1489 N GLU A 99 11.600 -6.516 9.353 1.00 0.00 N ATOM 1490 CA GLU A 99 13.018 -6.638 9.021 1.00 0.00 C ATOM 1491 C GLU A 99 13.690 -5.262 8.998 1.00 0.00 C ATOM 1492 O GLU A 99 14.907 -5.143 9.171 1.00 0.00 O ATOM 1493 CB GLU A 99 13.182 -7.351 7.673 1.00 0.00 C ATOM 1494 CG GLU A 99 14.611 -7.774 7.367 1.00 0.00 C ATOM 1495 CD GLU A 99 14.710 -8.655 6.136 1.00 0.00 C ATOM 1496 OE1 GLU A 99 14.412 -9.863 6.243 1.00 0.00 O ATOM 1497 OE2 GLU A 99 15.106 -8.147 5.067 1.00 0.00 O ATOM 0 H GLU A 99 10.967 -6.800 8.605 1.00 0.00 H new ATOM 0 HA GLU A 99 13.508 -7.235 9.790 1.00 0.00 H new ATOM 0 HB2 GLU A 99 12.542 -8.233 7.660 1.00 0.00 H new ATOM 0 HB3 GLU A 99 12.831 -6.691 6.879 1.00 0.00 H new ATOM 0 HG2 GLU A 99 15.226 -6.885 7.223 1.00 0.00 H new ATOM 0 HG3 GLU A 99 15.019 -8.308 8.225 1.00 0.00 H new ATOM 1766 N LYS B 8 2.741 -4.812 17.960 1.00 0.00 N ATOM 1767 CA LYS B 8 2.379 -4.931 16.550 1.00 0.00 C ATOM 1768 C LYS B 8 1.743 -3.649 16.023 1.00 0.00 C ATOM 1769 O LYS B 8 1.818 -3.365 14.830 1.00 0.00 O ATOM 1770 CB LYS B 8 1.458 -6.121 16.295 1.00 0.00 C ATOM 1771 CG LYS B 8 0.144 -6.082 17.044 1.00 0.00 C ATOM 1772 CD LYS B 8 -0.819 -7.103 16.474 1.00 0.00 C ATOM 1773 CE LYS B 8 -0.221 -8.500 16.487 1.00 0.00 C ATOM 1774 NZ LYS B 8 -1.149 -9.517 15.931 1.00 0.00 N ATOM 0 HA LYS B 8 3.308 -5.102 16.006 1.00 0.00 H new ATOM 0 HB2 LYS B 8 1.249 -6.178 15.227 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.986 -7.035 16.565 1.00 0.00 H new ATOM 0 HG2 LYS B 8 0.315 -6.284 18.101 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -0.291 -5.085 16.976 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -1.743 -7.096 17.052 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -1.081 -6.827 15.452 1.00 0.00 H new ATOM 0 HE2 LYS B 8 0.704 -8.502 15.910 1.00 0.00 H new ATOM 0 HE3 LYS B 8 0.041 -8.771 17.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -0.605 -10.240 15.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -1.677 -9.966 16.706 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -1.816 -9.058 15.278 1.00 0.00 H new ATOM 1788 N ALA B 9 1.150 -2.863 16.915 1.00 0.00 N ATOM 1789 CA ALA B 9 0.544 -1.594 16.528 1.00 0.00 C ATOM 1790 C ALA B 9 1.595 -0.640 15.969 1.00 0.00 C ATOM 1791 O ALA B 9 1.305 0.173 15.090 1.00 0.00 O ATOM 1792 CB ALA B 9 -0.178 -0.966 17.710 1.00 0.00 C ATOM 0 H ALA B 9 1.076 -3.081 17.909 1.00 0.00 H new ATOM 0 HA ALA B 9 -0.187 -1.789 15.743 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -0.624 -0.020 17.403 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -0.961 -1.640 18.058 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.532 -0.787 18.517 1.00 0.00 H new ATOM 1798 N ALA B 10 2.824 -0.759 16.466 1.00 0.00 N ATOM 1799 CA ALA B 10 3.923 0.065 15.984 1.00 0.00 C ATOM 1800 C ALA B 10 4.366 -0.401 14.602 1.00 0.00 C ATOM 1801 O ALA B 10 4.820 0.394 13.777 1.00 0.00 O ATOM 1802 CB ALA B 10 5.086 0.029 16.964 1.00 0.00 C ATOM 0 H ALA B 10 3.081 -1.418 17.201 1.00 0.00 H new ATOM 0 HA ALA B 10 3.577 1.096 15.905 1.00 0.00 H new ATOM 0 HB1 ALA B 10 5.898 0.650 16.587 1.00 0.00 H new ATOM 0 HB2 ALA B 10 4.758 0.408 17.932 1.00 0.00 H new ATOM 0 HB3 ALA B 10 5.436 -0.997 17.076 1.00 0.00 H new ATOM 1808 N LEU B 11 4.212 -1.695 14.347 1.00 0.00 N ATOM 1809 CA LEU B 11 4.536 -2.255 13.043 1.00 0.00 C ATOM 1810 C LEU B 11 3.464 -1.861 12.041 1.00 0.00 C ATOM 1811 O LEU B 11 3.763 -1.490 10.908 1.00 0.00 O ATOM 1812 CB LEU B 11 4.663 -3.784 13.106 1.00 0.00 C ATOM 1813 CG LEU B 11 5.976 -4.329 13.691 1.00 0.00 C ATOM 1814 CD1 LEU B 11 6.096 -4.007 15.175 1.00 0.00 C ATOM 1815 CD2 LEU B 11 6.073 -5.829 13.461 1.00 0.00 C ATOM 0 H LEU B 11 3.866 -2.374 15.025 1.00 0.00 H new ATOM 0 HA LEU B 11 5.499 -1.854 12.727 1.00 0.00 H new ATOM 0 HB2 LEU B 11 3.835 -4.173 13.699 1.00 0.00 H new ATOM 0 HB3 LEU B 11 4.546 -4.180 12.097 1.00 0.00 H new ATOM 0 HG LEU B 11 6.803 -3.840 13.177 1.00 0.00 H new ATOM 0 HD11 LEU B 11 7.035 -4.406 15.559 1.00 0.00 H new ATOM 0 HD12 LEU B 11 6.076 -2.926 15.316 1.00 0.00 H new ATOM 0 HD13 LEU B 11 5.263 -4.458 15.714 1.00 0.00 H new ATOM 0 HD21 LEU B 11 7.008 -6.202 13.880 1.00 0.00 H new ATOM 0 HD22 LEU B 11 5.234 -6.327 13.947 1.00 0.00 H new ATOM 0 HD23 LEU B 11 6.048 -6.035 12.391 1.00 0.00 H new ATOM 1827 N LEU B 12 2.214 -1.920 12.484 1.00 0.00 N ATOM 1828 CA LEU B 12 1.080 -1.512 11.663 1.00 0.00 C ATOM 1829 C LEU B 12 1.181 -0.030 11.318 1.00 0.00 C ATOM 1830 O LEU B 12 0.824 0.386 10.216 1.00 0.00 O ATOM 1831 CB LEU B 12 -0.234 -1.805 12.393 1.00 0.00 C ATOM 1832 CG LEU B 12 -0.473 -3.284 12.724 1.00 0.00 C ATOM 1833 CD1 LEU B 12 -1.729 -3.451 13.562 1.00 0.00 C ATOM 1834 CD2 LEU B 12 -0.575 -4.107 11.448 1.00 0.00 C ATOM 0 H LEU B 12 1.959 -2.249 13.415 1.00 0.00 H new ATOM 0 HA LEU B 12 1.096 -2.083 10.735 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -0.253 -1.232 13.320 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -1.061 -1.447 11.780 1.00 0.00 H new ATOM 0 HG LEU B 12 0.377 -3.645 13.303 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.880 -4.507 13.785 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -1.622 -2.895 14.493 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.588 -3.071 13.009 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.744 -5.153 11.702 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.406 -3.741 10.844 1.00 0.00 H new ATOM 0 HD23 LEU B 12 0.352 -4.017 10.882 1.00 0.00 H new ATOM 1846 N ASP B 13 1.686 0.759 12.265 1.00 0.00 N ATOM 1847 CA ASP B 13 1.928 2.180 12.031 1.00 0.00 C ATOM 1848 C ASP B 13 2.976 2.370 10.943 1.00 0.00 C ATOM 1849 O ASP B 13 2.824 3.220 10.063 1.00 0.00 O ATOM 1850 CB ASP B 13 2.390 2.880 13.312 1.00 0.00 C ATOM 1851 CG ASP B 13 2.720 4.345 13.077 1.00 0.00 C ATOM 1852 OD1 ASP B 13 1.790 5.181 13.089 1.00 0.00 O ATOM 1853 OD2 ASP B 13 3.911 4.672 12.883 1.00 0.00 O ATOM 0 H ASP B 13 1.935 0.438 13.201 1.00 0.00 H new ATOM 0 HA ASP B 13 0.987 2.626 11.709 1.00 0.00 H new ATOM 0 HB2 ASP B 13 1.609 2.802 14.069 1.00 0.00 H new ATOM 0 HB3 ASP B 13 3.269 2.370 13.706 1.00 0.00 H new ATOM 1858 N GLN B 14 4.037 1.569 11.006 1.00 0.00 N ATOM 1859 CA GLN B 14 5.090 1.620 10.001 1.00 0.00 C ATOM 1860 C GLN B 14 4.522 1.259 8.634 1.00 0.00 C ATOM 1861 O GLN B 14 4.794 1.936 7.641 1.00 0.00 O ATOM 1862 CB GLN B 14 6.235 0.669 10.355 1.00 0.00 C ATOM 1863 CG GLN B 14 7.481 0.900 9.516 1.00 0.00 C ATOM 1864 CD GLN B 14 8.459 -0.259 9.563 1.00 0.00 C ATOM 1865 OE1 GLN B 14 9.192 -0.496 8.603 1.00 0.00 O ATOM 1866 NE2 GLN B 14 8.481 -0.988 10.670 1.00 0.00 N ATOM 0 H GLN B 14 4.188 0.879 11.742 1.00 0.00 H new ATOM 0 HA GLN B 14 5.485 2.636 9.973 1.00 0.00 H new ATOM 0 HB2 GLN B 14 6.486 0.788 11.409 1.00 0.00 H new ATOM 0 HB3 GLN B 14 5.900 -0.360 10.222 1.00 0.00 H new ATOM 0 HG2 GLN B 14 7.187 1.076 8.481 1.00 0.00 H new ATOM 0 HG3 GLN B 14 7.982 1.804 9.863 1.00 0.00 H new ATOM 0 HE21 GLN B 14 7.857 -0.759 11.444 1.00 0.00 H new ATOM 0 HE22 GLN B 14 9.122 -1.778 10.748 1.00 0.00 H new ATOM 1875 N VAL B 15 3.718 0.199 8.596 1.00 0.00 N ATOM 1876 CA VAL B 15 3.052 -0.220 7.368 1.00 0.00 C ATOM 1877 C VAL B 15 2.160 0.900 6.841 1.00 0.00 C ATOM 1878 O VAL B 15 2.103 1.150 5.638 1.00 0.00 O ATOM 1879 CB VAL B 15 2.207 -1.499 7.589 1.00 0.00 C ATOM 1880 CG1 VAL B 15 1.473 -1.894 6.318 1.00 0.00 C ATOM 1881 CG2 VAL B 15 3.085 -2.645 8.063 1.00 0.00 C ATOM 0 H VAL B 15 3.512 -0.387 9.405 1.00 0.00 H new ATOM 0 HA VAL B 15 3.826 -0.445 6.634 1.00 0.00 H new ATOM 0 HB VAL B 15 1.467 -1.282 8.359 1.00 0.00 H new ATOM 0 HG11 VAL B 15 0.887 -2.795 6.501 1.00 0.00 H new ATOM 0 HG12 VAL B 15 0.809 -1.085 6.015 1.00 0.00 H new ATOM 0 HG13 VAL B 15 2.196 -2.086 5.525 1.00 0.00 H new ATOM 0 HG21 VAL B 15 2.473 -3.534 8.213 1.00 0.00 H new ATOM 0 HG22 VAL B 15 3.849 -2.852 7.314 1.00 0.00 H new ATOM 0 HG23 VAL B 15 3.564 -2.372 9.003 1.00 0.00 H new ATOM 1891 N ALA B 16 1.486 1.591 7.754 1.00 0.00 N ATOM 1892 CA ALA B 16 0.634 2.715 7.393 1.00 0.00 C ATOM 1893 C ALA B 16 1.453 3.851 6.788 1.00 0.00 C ATOM 1894 O ALA B 16 0.993 4.535 5.878 1.00 0.00 O ATOM 1895 CB ALA B 16 -0.147 3.206 8.603 1.00 0.00 C ATOM 0 H ALA B 16 1.515 1.390 8.754 1.00 0.00 H new ATOM 0 HA ALA B 16 -0.075 2.371 6.640 1.00 0.00 H new ATOM 0 HB1 ALA B 16 -0.778 4.046 8.313 1.00 0.00 H new ATOM 0 HB2 ALA B 16 -0.772 2.399 8.985 1.00 0.00 H new ATOM 0 HB3 ALA B 16 0.548 3.526 9.379 1.00 0.00 H new ATOM 1901 N ARG B 17 2.672 4.047 7.288 1.00 0.00 N ATOM 1902 CA ARG B 17 3.568 5.062 6.737 1.00 0.00 C ATOM 1903 C ARG B 17 3.953 4.696 5.308 1.00 0.00 C ATOM 1904 O ARG B 17 3.989 5.553 4.420 1.00 0.00 O ATOM 1905 CB ARG B 17 4.830 5.209 7.589 1.00 0.00 C ATOM 1906 CG ARG B 17 4.566 5.667 9.015 1.00 0.00 C ATOM 1907 CD ARG B 17 5.868 5.919 9.754 1.00 0.00 C ATOM 1908 NE ARG B 17 5.652 6.297 11.153 1.00 0.00 N ATOM 1909 CZ ARG B 17 6.323 7.271 11.769 1.00 0.00 C ATOM 1910 NH1 ARG B 17 7.208 7.997 11.099 1.00 0.00 N ATOM 1911 NH2 ARG B 17 6.109 7.528 13.055 1.00 0.00 N ATOM 0 H ARG B 17 3.060 3.519 8.070 1.00 0.00 H new ATOM 0 HA ARG B 17 3.040 6.015 6.741 1.00 0.00 H new ATOM 0 HB2 ARG B 17 5.350 4.252 7.617 1.00 0.00 H new ATOM 0 HB3 ARG B 17 5.499 5.922 7.108 1.00 0.00 H new ATOM 0 HG2 ARG B 17 3.968 6.578 9.004 1.00 0.00 H new ATOM 0 HG3 ARG B 17 3.985 4.911 9.542 1.00 0.00 H new ATOM 0 HD2 ARG B 17 6.485 5.021 9.714 1.00 0.00 H new ATOM 0 HD3 ARG B 17 6.423 6.710 9.248 1.00 0.00 H new ATOM 0 HE ARG B 17 4.948 5.786 11.686 1.00 0.00 H new ATOM 0 HH11 ARG B 17 7.377 7.811 10.110 1.00 0.00 H new ATOM 0 HH12 ARG B 17 7.720 8.741 11.572 1.00 0.00 H new ATOM 0 HH21 ARG B 17 5.427 6.979 13.578 1.00 0.00 H new ATOM 0 HH22 ARG B 17 6.626 8.275 13.519 1.00 0.00 H new ATOM 1925 N VAL B 18 4.238 3.414 5.099 1.00 0.00 N ATOM 1926 CA VAL B 18 4.511 2.893 3.767 1.00 0.00 C ATOM 1927 C VAL B 18 3.281 3.074 2.883 1.00 0.00 C ATOM 1928 O VAL B 18 3.380 3.494 1.731 1.00 0.00 O ATOM 1929 CB VAL B 18 4.896 1.396 3.820 1.00 0.00 C ATOM 1930 CG1 VAL B 18 5.151 0.848 2.424 1.00 0.00 C ATOM 1931 CG2 VAL B 18 6.116 1.184 4.708 1.00 0.00 C ATOM 0 H VAL B 18 4.286 2.715 5.840 1.00 0.00 H new ATOM 0 HA VAL B 18 5.352 3.448 3.350 1.00 0.00 H new ATOM 0 HB VAL B 18 4.057 0.849 4.251 1.00 0.00 H new ATOM 0 HG11 VAL B 18 5.420 -0.206 2.490 1.00 0.00 H new ATOM 0 HG12 VAL B 18 4.250 0.955 1.821 1.00 0.00 H new ATOM 0 HG13 VAL B 18 5.967 1.402 1.959 1.00 0.00 H new ATOM 0 HG21 VAL B 18 6.369 0.124 4.731 1.00 0.00 H new ATOM 0 HG22 VAL B 18 6.958 1.750 4.310 1.00 0.00 H new ATOM 0 HG23 VAL B 18 5.894 1.526 5.719 1.00 0.00 H new ATOM 1941 N GLY B 19 2.121 2.778 3.457 1.00 0.00 N ATOM 1942 CA GLY B 19 0.866 2.926 2.750 1.00 0.00 C ATOM 1943 C GLY B 19 0.544 4.367 2.410 1.00 0.00 C ATOM 1944 O GLY B 19 -0.177 4.628 1.460 1.00 0.00 O ATOM 0 H GLY B 19 2.029 2.434 4.413 1.00 0.00 H new ATOM 0 HA2 GLY B 19 0.902 2.341 1.831 1.00 0.00 H new ATOM 0 HA3 GLY B 19 0.061 2.514 3.359 1.00 0.00 H new ATOM 1948 N LYS B 20 1.062 5.308 3.192 1.00 0.00 N ATOM 1949 CA LYS B 20 0.857 6.726 2.906 1.00 0.00 C ATOM 1950 C LYS B 20 1.741 7.180 1.749 1.00 0.00 C ATOM 1951 O LYS B 20 1.373 8.076 0.987 1.00 0.00 O ATOM 1952 CB LYS B 20 1.118 7.586 4.145 1.00 0.00 C ATOM 1953 CG LYS B 20 -0.010 7.532 5.165 1.00 0.00 C ATOM 1954 CD LYS B 20 0.225 8.493 6.317 1.00 0.00 C ATOM 1955 CE LYS B 20 -0.981 8.561 7.243 1.00 0.00 C ATOM 1956 NZ LYS B 20 -2.192 9.085 6.551 1.00 0.00 N ATOM 0 H LYS B 20 1.623 5.118 4.023 1.00 0.00 H new ATOM 0 HA LYS B 20 -0.186 6.856 2.617 1.00 0.00 H new ATOM 0 HB2 LYS B 20 2.043 7.257 4.619 1.00 0.00 H new ATOM 0 HB3 LYS B 20 1.269 8.620 3.835 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -0.954 7.774 4.676 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -0.102 6.517 5.551 1.00 0.00 H new ATOM 0 HD2 LYS B 20 1.102 8.177 6.882 1.00 0.00 H new ATOM 0 HD3 LYS B 20 0.440 9.487 5.925 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -1.191 7.567 7.637 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -0.747 9.199 8.096 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -2.900 9.369 7.258 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -1.932 9.908 5.971 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -2.591 8.344 5.940 1.00 0.00 H new ATOM 1970 N ALA B 21 2.902 6.554 1.616 1.00 0.00 N ATOM 1971 CA ALA B 21 3.789 6.832 0.495 1.00 0.00 C ATOM 1972 C ALA B 21 3.269 6.143 -0.762 1.00 0.00 C ATOM 1973 O ALA B 21 3.250 6.725 -1.844 1.00 0.00 O ATOM 1974 CB ALA B 21 5.209 6.379 0.811 1.00 0.00 C ATOM 0 H ALA B 21 3.251 5.852 2.269 1.00 0.00 H new ATOM 0 HA ALA B 21 3.810 7.908 0.320 1.00 0.00 H new ATOM 0 HB1 ALA B 21 5.857 6.595 -0.038 1.00 0.00 H new ATOM 0 HB2 ALA B 21 5.573 6.911 1.690 1.00 0.00 H new ATOM 0 HB3 ALA B 21 5.214 5.307 1.008 1.00 0.00 H new ATOM 1980 N LEU B 22 2.819 4.907 -0.595 1.00 0.00 N ATOM 1981 CA LEU B 22 2.275 4.119 -1.693 1.00 0.00 C ATOM 1982 C LEU B 22 0.764 4.345 -1.810 1.00 0.00 C ATOM 1983 O LEU B 22 0.050 3.546 -2.412 1.00 0.00 O ATOM 1984 CB LEU B 22 2.575 2.631 -1.447 1.00 0.00 C ATOM 1985 CG LEU B 22 2.217 1.675 -2.588 1.00 0.00 C ATOM 1986 CD1 LEU B 22 3.118 1.907 -3.788 1.00 0.00 C ATOM 1987 CD2 LEU B 22 2.308 0.233 -2.120 1.00 0.00 C ATOM 0 H LEU B 22 2.821 4.423 0.303 1.00 0.00 H new ATOM 0 HA LEU B 22 2.741 4.431 -2.628 1.00 0.00 H new ATOM 0 HB2 LEU B 22 3.638 2.526 -1.232 1.00 0.00 H new ATOM 0 HB3 LEU B 22 2.037 2.316 -0.553 1.00 0.00 H new ATOM 0 HG LEU B 22 1.190 1.874 -2.893 1.00 0.00 H new ATOM 0 HD11 LEU B 22 2.846 1.217 -4.586 1.00 0.00 H new ATOM 0 HD12 LEU B 22 3.000 2.932 -4.139 1.00 0.00 H new ATOM 0 HD13 LEU B 22 4.156 1.739 -3.501 1.00 0.00 H new ATOM 0 HD21 LEU B 22 2.050 -0.434 -2.943 1.00 0.00 H new ATOM 0 HD22 LEU B 22 3.324 0.022 -1.787 1.00 0.00 H new ATOM 0 HD23 LEU B 22 1.615 0.074 -1.294 1.00 0.00 H new ATOM 1999 N ALA B 23 0.283 5.444 -1.235 1.00 0.00 N ATOM 2000 CA ALA B 23 -1.147 5.727 -1.216 1.00 0.00 C ATOM 2001 C ALA B 23 -1.669 6.053 -2.604 1.00 0.00 C ATOM 2002 O ALA B 23 -2.218 5.197 -3.280 1.00 0.00 O ATOM 2003 CB ALA B 23 -1.474 6.860 -0.251 1.00 0.00 C ATOM 0 H ALA B 23 0.861 6.150 -0.778 1.00 0.00 H new ATOM 0 HA ALA B 23 -1.647 4.823 -0.868 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -2.548 7.047 -0.260 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -1.162 6.582 0.756 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -0.946 7.763 -0.558 1.00 0.00 H new ATOM 2009 N ASN B 24 -1.480 7.289 -3.033 1.00 0.00 N ATOM 2010 CA ASN B 24 -2.047 7.742 -4.291 1.00 0.00 C ATOM 2011 C ASN B 24 -1.151 8.762 -4.979 1.00 0.00 C ATOM 2012 O ASN B 24 -0.083 9.124 -4.468 1.00 0.00 O ATOM 2013 CB ASN B 24 -3.437 8.352 -4.055 1.00 0.00 C ATOM 2014 CG ASN B 24 -3.440 9.469 -3.021 1.00 0.00 C ATOM 2015 OD1 ASN B 24 -2.449 10.172 -2.832 1.00 0.00 O ATOM 2016 ND2 ASN B 24 -4.567 9.642 -2.349 1.00 0.00 N ATOM 0 H ASN B 24 -0.940 7.994 -2.531 1.00 0.00 H new ATOM 0 HA ASN B 24 -2.132 6.873 -4.944 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -3.820 8.740 -4.999 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -4.120 7.566 -3.732 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -4.634 10.379 -1.647 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -5.369 9.039 -2.534 1.00 0.00 H new ATOM 2023 N GLY B 25 -1.592 9.204 -6.149 1.00 0.00 N ATOM 2024 CA GLY B 25 -0.936 10.293 -6.833 1.00 0.00 C ATOM 2025 C GLY B 25 -0.007 9.836 -7.933 1.00 0.00 C ATOM 2026 O GLY B 25 0.240 8.641 -8.097 1.00 0.00 O ATOM 0 H GLY B 25 -2.401 8.821 -6.638 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -1.692 10.954 -7.257 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -0.370 10.879 -6.109 1.00 0.00 H new ATOM 2030 N ARG B 26 0.525 10.799 -8.676 1.00 0.00 N ATOM 2031 CA ARG B 26 1.491 10.522 -9.730 1.00 0.00 C ATOM 2032 C ARG B 26 2.827 10.093 -9.136 1.00 0.00 C ATOM 2033 O ARG B 26 3.762 9.761 -9.858 1.00 0.00 O ATOM 2034 CB ARG B 26 1.662 11.735 -10.648 1.00 0.00 C ATOM 2035 CG ARG B 26 0.565 11.854 -11.697 1.00 0.00 C ATOM 2036 CD ARG B 26 0.725 13.108 -12.543 1.00 0.00 C ATOM 2037 NE ARG B 26 -0.054 13.041 -13.781 1.00 0.00 N ATOM 2038 CZ ARG B 26 -0.806 14.041 -14.246 1.00 0.00 C ATOM 2039 NH1 ARG B 26 -0.944 15.157 -13.541 1.00 0.00 N ATOM 2040 NH2 ARG B 26 -1.429 13.922 -15.414 1.00 0.00 N ATOM 0 H ARG B 26 0.300 11.788 -8.565 1.00 0.00 H new ATOM 0 HA ARG B 26 1.109 9.699 -10.334 1.00 0.00 H new ATOM 0 HB2 ARG B 26 1.676 12.641 -10.043 1.00 0.00 H new ATOM 0 HB3 ARG B 26 2.628 11.670 -11.148 1.00 0.00 H new ATOM 0 HG2 ARG B 26 0.583 10.976 -12.342 1.00 0.00 H new ATOM 0 HG3 ARG B 26 -0.408 11.869 -11.205 1.00 0.00 H new ATOM 0 HD2 ARG B 26 0.412 13.977 -11.965 1.00 0.00 H new ATOM 0 HD3 ARG B 26 1.778 13.249 -12.785 1.00 0.00 H new ATOM 0 HE ARG B 26 -0.020 12.177 -14.322 1.00 0.00 H new ATOM 0 HH11 ARG B 26 -0.475 15.253 -12.641 1.00 0.00 H new ATOM 0 HH12 ARG B 26 -1.519 15.919 -13.900 1.00 0.00 H new ATOM 0 HH21 ARG B 26 -1.333 13.065 -15.958 1.00 0.00 H new ATOM 0 HH22 ARG B 26 -2.003 14.688 -15.766 1.00 0.00 H new ATOM 2054 N ARG B 27 2.909 10.107 -7.811 1.00 0.00 N ATOM 2055 CA ARG B 27 4.051 9.534 -7.111 1.00 0.00 C ATOM 2056 C ARG B 27 4.179 8.063 -7.480 1.00 0.00 C ATOM 2057 O ARG B 27 5.279 7.534 -7.620 1.00 0.00 O ATOM 2058 CB ARG B 27 3.873 9.669 -5.600 1.00 0.00 C ATOM 2059 CG ARG B 27 3.607 11.089 -5.143 1.00 0.00 C ATOM 2060 CD ARG B 27 3.474 11.179 -3.635 1.00 0.00 C ATOM 2061 NE ARG B 27 2.400 10.333 -3.126 1.00 0.00 N ATOM 2062 CZ ARG B 27 2.211 10.073 -1.834 1.00 0.00 C ATOM 2063 NH1 ARG B 27 3.001 10.624 -0.916 1.00 0.00 N ATOM 2064 NH2 ARG B 27 1.220 9.278 -1.462 1.00 0.00 N ATOM 0 H ARG B 27 2.198 10.509 -7.200 1.00 0.00 H new ATOM 0 HA ARG B 27 4.953 10.070 -7.405 1.00 0.00 H new ATOM 0 HB2 ARG B 27 3.046 9.033 -5.282 1.00 0.00 H new ATOM 0 HB3 ARG B 27 4.769 9.298 -5.103 1.00 0.00 H new ATOM 0 HG2 ARG B 27 4.419 11.736 -5.476 1.00 0.00 H new ATOM 0 HG3 ARG B 27 2.694 11.457 -5.611 1.00 0.00 H new ATOM 0 HD2 ARG B 27 4.416 10.887 -3.171 1.00 0.00 H new ATOM 0 HD3 ARG B 27 3.286 12.214 -3.350 1.00 0.00 H new ATOM 0 HE ARG B 27 1.757 9.917 -3.799 1.00 0.00 H new ATOM 0 HH11 ARG B 27 3.755 11.249 -1.201 1.00 0.00 H new ATOM 0 HH12 ARG B 27 2.852 10.422 0.073 1.00 0.00 H new ATOM 0 HH21 ARG B 27 0.605 8.867 -2.164 1.00 0.00 H new ATOM 0 HH22 ARG B 27 1.072 9.076 -0.473 1.00 0.00 H new ATOM 2078 N LEU B 28 3.028 7.424 -7.660 1.00 0.00 N ATOM 2079 CA LEU B 28 2.973 6.031 -8.072 1.00 0.00 C ATOM 2080 C LEU B 28 3.512 5.889 -9.493 1.00 0.00 C ATOM 2081 O LEU B 28 4.144 4.891 -9.843 1.00 0.00 O ATOM 2082 CB LEU B 28 1.530 5.521 -7.997 1.00 0.00 C ATOM 2083 CG LEU B 28 0.862 5.642 -6.624 1.00 0.00 C ATOM 2084 CD1 LEU B 28 -0.521 5.018 -6.649 1.00 0.00 C ATOM 2085 CD2 LEU B 28 1.717 4.994 -5.545 1.00 0.00 C ATOM 0 H LEU B 28 2.114 7.856 -7.525 1.00 0.00 H new ATOM 0 HA LEU B 28 3.591 5.434 -7.401 1.00 0.00 H new ATOM 0 HB2 LEU B 28 0.930 6.069 -8.724 1.00 0.00 H new ATOM 0 HB3 LEU B 28 1.516 4.473 -8.298 1.00 0.00 H new ATOM 0 HG LEU B 28 0.762 6.701 -6.388 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -0.981 5.113 -5.665 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -1.137 5.529 -7.389 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -0.440 3.963 -6.911 1.00 0.00 H new ATOM 0 HD21 LEU B 28 1.221 5.093 -4.579 1.00 0.00 H new ATOM 0 HD22 LEU B 28 1.855 3.938 -5.775 1.00 0.00 H new ATOM 0 HD23 LEU B 28 2.689 5.486 -5.506 1.00 0.00 H new ATOM 2097 N GLN B 29 3.272 6.918 -10.298 1.00 0.00 N ATOM 2098 CA GLN B 29 3.773 6.966 -11.665 1.00 0.00 C ATOM 2099 C GLN B 29 5.296 7.065 -11.651 1.00 0.00 C ATOM 2100 O GLN B 29 5.981 6.494 -12.502 1.00 0.00 O ATOM 2101 CB GLN B 29 3.179 8.175 -12.394 1.00 0.00 C ATOM 2102 CG GLN B 29 3.296 8.108 -13.905 1.00 0.00 C ATOM 2103 CD GLN B 29 2.934 9.422 -14.566 1.00 0.00 C ATOM 2104 OE1 GLN B 29 1.769 9.679 -14.869 1.00 0.00 O ATOM 2105 NE2 GLN B 29 3.932 10.254 -14.812 1.00 0.00 N ATOM 0 H GLN B 29 2.729 7.736 -10.023 1.00 0.00 H new ATOM 0 HA GLN B 29 3.478 6.056 -12.188 1.00 0.00 H new ATOM 0 HB2 GLN B 29 2.126 8.266 -12.126 1.00 0.00 H new ATOM 0 HB3 GLN B 29 3.677 9.078 -12.042 1.00 0.00 H new ATOM 0 HG2 GLN B 29 4.316 7.835 -14.177 1.00 0.00 H new ATOM 0 HG3 GLN B 29 2.644 7.321 -14.284 1.00 0.00 H new ATOM 0 HE21 GLN B 29 4.884 10.002 -14.544 1.00 0.00 H new ATOM 0 HE22 GLN B 29 3.750 11.147 -15.269 1.00 0.00 H new ATOM 2114 N ILE B 30 5.813 7.800 -10.670 1.00 0.00 N ATOM 2115 CA ILE B 30 7.252 7.939 -10.487 1.00 0.00 C ATOM 2116 C ILE B 30 7.866 6.600 -10.092 1.00 0.00 C ATOM 2117 O ILE B 30 8.944 6.239 -10.560 1.00 0.00 O ATOM 2118 CB ILE B 30 7.590 8.991 -9.404 1.00 0.00 C ATOM 2119 CG1 ILE B 30 6.968 10.347 -9.752 1.00 0.00 C ATOM 2120 CG2 ILE B 30 9.097 9.125 -9.244 1.00 0.00 C ATOM 2121 CD1 ILE B 30 7.177 11.404 -8.688 1.00 0.00 C ATOM 0 H ILE B 30 5.252 8.310 -9.987 1.00 0.00 H new ATOM 0 HA ILE B 30 7.670 8.273 -11.437 1.00 0.00 H new ATOM 0 HB ILE B 30 7.168 8.653 -8.457 1.00 0.00 H new ATOM 0 HG12 ILE B 30 7.392 10.701 -10.691 1.00 0.00 H new ATOM 0 HG13 ILE B 30 5.898 10.215 -9.915 1.00 0.00 H new ATOM 0 HG21 ILE B 30 9.317 9.869 -8.478 1.00 0.00 H new ATOM 0 HG22 ILE B 30 9.518 8.164 -8.948 1.00 0.00 H new ATOM 0 HG23 ILE B 30 9.537 9.438 -10.191 1.00 0.00 H new ATOM 0 HD11 ILE B 30 6.709 12.336 -9.004 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.728 11.072 -7.752 1.00 0.00 H new ATOM 0 HD13 ILE B 30 8.245 11.566 -8.540 1.00 0.00 H new ATOM 2133 N LEU B 31 7.159 5.863 -9.240 1.00 0.00 N ATOM 2134 CA LEU B 31 7.616 4.556 -8.781 1.00 0.00 C ATOM 2135 C LEU B 31 7.874 3.619 -9.955 1.00 0.00 C ATOM 2136 O LEU B 31 8.913 2.963 -10.013 1.00 0.00 O ATOM 2137 CB LEU B 31 6.594 3.935 -7.829 1.00 0.00 C ATOM 2138 CG LEU B 31 6.405 4.678 -6.505 1.00 0.00 C ATOM 2139 CD1 LEU B 31 5.279 4.051 -5.701 1.00 0.00 C ATOM 2140 CD2 LEU B 31 7.697 4.672 -5.698 1.00 0.00 C ATOM 0 H LEU B 31 6.261 6.152 -8.852 1.00 0.00 H new ATOM 0 HA LEU B 31 8.555 4.701 -8.247 1.00 0.00 H new ATOM 0 HB2 LEU B 31 5.632 3.882 -8.338 1.00 0.00 H new ATOM 0 HB3 LEU B 31 6.898 2.911 -7.613 1.00 0.00 H new ATOM 0 HG LEU B 31 6.141 5.712 -6.727 1.00 0.00 H new ATOM 0 HD11 LEU B 31 5.158 4.591 -4.762 1.00 0.00 H new ATOM 0 HD12 LEU B 31 4.352 4.103 -6.272 1.00 0.00 H new ATOM 0 HD13 LEU B 31 5.518 3.009 -5.491 1.00 0.00 H new ATOM 0 HD21 LEU B 31 7.543 5.205 -4.760 1.00 0.00 H new ATOM 0 HD22 LEU B 31 7.989 3.643 -5.487 1.00 0.00 H new ATOM 0 HD23 LEU B 31 8.485 5.163 -6.269 1.00 0.00 H new ATOM 2152 N ASP B 32 6.934 3.568 -10.894 1.00 0.00 N ATOM 2153 CA ASP B 32 7.105 2.753 -12.098 1.00 0.00 C ATOM 2154 C ASP B 32 8.304 3.243 -12.901 1.00 0.00 C ATOM 2155 O ASP B 32 9.105 2.451 -13.396 1.00 0.00 O ATOM 2156 CB ASP B 32 5.843 2.793 -12.970 1.00 0.00 C ATOM 2157 CG ASP B 32 6.002 2.002 -14.261 1.00 0.00 C ATOM 2158 OD1 ASP B 32 5.771 0.772 -14.247 1.00 0.00 O ATOM 2159 OD2 ASP B 32 6.359 2.606 -15.296 1.00 0.00 O ATOM 0 H ASP B 32 6.051 4.077 -10.848 1.00 0.00 H new ATOM 0 HA ASP B 32 7.279 1.723 -11.787 1.00 0.00 H new ATOM 0 HB2 ASP B 32 5.001 2.394 -12.404 1.00 0.00 H new ATOM 0 HB3 ASP B 32 5.603 3.829 -13.209 1.00 0.00 H new ATOM 2164 N LEU B 33 8.436 4.559 -12.993 1.00 0.00 N ATOM 2165 CA LEU B 33 9.518 5.182 -13.744 1.00 0.00 C ATOM 2166 C LEU B 33 10.880 4.845 -13.133 1.00 0.00 C ATOM 2167 O LEU B 33 11.877 4.708 -13.847 1.00 0.00 O ATOM 2168 CB LEU B 33 9.314 6.699 -13.777 1.00 0.00 C ATOM 2169 CG LEU B 33 10.243 7.473 -14.711 1.00 0.00 C ATOM 2170 CD1 LEU B 33 9.987 7.093 -16.161 1.00 0.00 C ATOM 2171 CD2 LEU B 33 10.064 8.971 -14.509 1.00 0.00 C ATOM 0 H LEU B 33 7.799 5.223 -12.552 1.00 0.00 H new ATOM 0 HA LEU B 33 9.502 4.791 -14.761 1.00 0.00 H new ATOM 0 HB2 LEU B 33 8.284 6.902 -14.069 1.00 0.00 H new ATOM 0 HB3 LEU B 33 9.441 7.086 -12.766 1.00 0.00 H new ATOM 0 HG LEU B 33 11.273 7.211 -14.470 1.00 0.00 H new ATOM 0 HD11 LEU B 33 10.659 7.656 -16.809 1.00 0.00 H new ATOM 0 HD12 LEU B 33 10.164 6.026 -16.294 1.00 0.00 H new ATOM 0 HD13 LEU B 33 8.954 7.325 -16.421 1.00 0.00 H new ATOM 0 HD21 LEU B 33 10.732 9.511 -15.180 1.00 0.00 H new ATOM 0 HD22 LEU B 33 9.032 9.246 -14.725 1.00 0.00 H new ATOM 0 HD23 LEU B 33 10.300 9.230 -13.477 1.00 0.00 H new ATOM 2183 N LEU B 34 10.916 4.706 -11.814 1.00 0.00 N ATOM 2184 CA LEU B 34 12.150 4.378 -11.110 1.00 0.00 C ATOM 2185 C LEU B 34 12.379 2.872 -11.081 1.00 0.00 C ATOM 2186 O LEU B 34 13.495 2.405 -10.845 1.00 0.00 O ATOM 2187 CB LEU B 34 12.118 4.935 -9.687 1.00 0.00 C ATOM 2188 CG LEU B 34 11.953 6.453 -9.592 1.00 0.00 C ATOM 2189 CD1 LEU B 34 12.031 6.910 -8.145 1.00 0.00 C ATOM 2190 CD2 LEU B 34 13.006 7.157 -10.431 1.00 0.00 C ATOM 0 H LEU B 34 10.103 4.816 -11.208 1.00 0.00 H new ATOM 0 HA LEU B 34 12.978 4.839 -11.649 1.00 0.00 H new ATOM 0 HB2 LEU B 34 11.300 4.461 -9.145 1.00 0.00 H new ATOM 0 HB3 LEU B 34 13.041 4.652 -9.181 1.00 0.00 H new ATOM 0 HG LEU B 34 10.970 6.716 -9.982 1.00 0.00 H new ATOM 0 HD11 LEU B 34 11.911 7.992 -8.098 1.00 0.00 H new ATOM 0 HD12 LEU B 34 11.238 6.432 -7.569 1.00 0.00 H new ATOM 0 HD13 LEU B 34 12.999 6.634 -7.728 1.00 0.00 H new ATOM 0 HD21 LEU B 34 12.873 8.236 -10.351 1.00 0.00 H new ATOM 0 HD22 LEU B 34 13.999 6.886 -10.071 1.00 0.00 H new ATOM 0 HD23 LEU B 34 12.903 6.855 -11.473 1.00 0.00 H new ATOM 2202 N ALA B 35 11.317 2.112 -11.306 1.00 0.00 N ATOM 2203 CA ALA B 35 11.429 0.667 -11.430 1.00 0.00 C ATOM 2204 C ALA B 35 12.042 0.310 -12.776 1.00 0.00 C ATOM 2205 O ALA B 35 12.681 -0.733 -12.929 1.00 0.00 O ATOM 2206 CB ALA B 35 10.068 0.007 -11.260 1.00 0.00 C ATOM 0 H ALA B 35 10.368 2.473 -11.406 1.00 0.00 H new ATOM 0 HA ALA B 35 12.081 0.294 -10.641 1.00 0.00 H new ATOM 0 HB1 ALA B 35 10.173 -1.074 -11.356 1.00 0.00 H new ATOM 0 HB2 ALA B 35 9.668 0.246 -10.275 1.00 0.00 H new ATOM 0 HB3 ALA B 35 9.387 0.375 -12.027 1.00 0.00 H new ATOM 2212 N GLN B 36 11.848 1.199 -13.744 1.00 0.00 N ATOM 2213 CA GLN B 36 12.417 1.041 -15.075 1.00 0.00 C ATOM 2214 C GLN B 36 13.935 1.215 -15.037 1.00 0.00 C ATOM 2215 O GLN B 36 14.657 0.658 -15.863 1.00 0.00 O ATOM 2216 CB GLN B 36 11.807 2.063 -16.039 1.00 0.00 C ATOM 2217 CG GLN B 36 10.294 1.963 -16.166 1.00 0.00 C ATOM 2218 CD GLN B 36 9.711 3.034 -17.066 1.00 0.00 C ATOM 2219 OE1 GLN B 36 10.359 3.495 -18.004 1.00 0.00 O ATOM 2220 NE2 GLN B 36 8.483 3.444 -16.790 1.00 0.00 N ATOM 0 H GLN B 36 11.293 2.047 -13.627 1.00 0.00 H new ATOM 0 HA GLN B 36 12.186 0.035 -15.425 1.00 0.00 H new ATOM 0 HB2 GLN B 36 12.068 3.066 -15.703 1.00 0.00 H new ATOM 0 HB3 GLN B 36 12.254 1.931 -17.024 1.00 0.00 H new ATOM 0 HG2 GLN B 36 10.031 0.981 -16.559 1.00 0.00 H new ATOM 0 HG3 GLN B 36 9.844 2.042 -15.176 1.00 0.00 H new ATOM 0 HE21 GLN B 36 7.975 3.039 -16.004 1.00 0.00 H new ATOM 0 HE22 GLN B 36 8.045 4.165 -17.364 1.00 0.00 H new ATOM 2229 N GLY B 37 14.415 1.994 -14.079 1.00 0.00 N ATOM 2230 CA GLY B 37 15.838 2.223 -13.967 1.00 0.00 C ATOM 2231 C GLY B 37 16.163 3.368 -13.034 1.00 0.00 C ATOM 2232 O GLY B 37 15.268 4.086 -12.589 1.00 0.00 O ATOM 0 H GLY B 37 13.845 2.470 -13.380 1.00 0.00 H new ATOM 0 HA2 GLY B 37 16.323 1.315 -13.607 1.00 0.00 H new ATOM 0 HA3 GLY B 37 16.249 2.434 -14.954 1.00 0.00 H new ATOM 2236 N GLU B 38 17.446 3.533 -12.748 1.00 0.00 N ATOM 2237 CA GLU B 38 17.913 4.583 -11.855 1.00 0.00 C ATOM 2238 C GLU B 38 17.867 5.926 -12.571 1.00 0.00 C ATOM 2239 O GLU B 38 18.440 6.080 -13.651 1.00 0.00 O ATOM 2240 CB GLU B 38 19.335 4.262 -11.405 1.00 0.00 C ATOM 2241 CG GLU B 38 19.766 4.966 -10.132 1.00 0.00 C ATOM 2242 CD GLU B 38 21.010 4.338 -9.545 1.00 0.00 C ATOM 2243 OE1 GLU B 38 21.136 3.094 -9.625 1.00 0.00 O ATOM 2244 OE2 GLU B 38 21.868 5.069 -9.016 1.00 0.00 O ATOM 0 H GLU B 38 18.189 2.946 -13.126 1.00 0.00 H new ATOM 0 HA GLU B 38 17.267 4.638 -10.978 1.00 0.00 H new ATOM 0 HB2 GLU B 38 19.421 3.186 -11.257 1.00 0.00 H new ATOM 0 HB3 GLU B 38 20.025 4.530 -12.205 1.00 0.00 H new ATOM 0 HG2 GLU B 38 19.954 6.019 -10.343 1.00 0.00 H new ATOM 0 HG3 GLU B 38 18.958 4.926 -9.402 1.00 0.00 H new ATOM 2251 N ARG B 39 17.191 6.894 -11.972 1.00 0.00 N ATOM 2252 CA ARG B 39 16.930 8.148 -12.654 1.00 0.00 C ATOM 2253 C ARG B 39 17.197 9.343 -11.746 1.00 0.00 C ATOM 2254 O ARG B 39 16.841 9.339 -10.568 1.00 0.00 O ATOM 2255 CB ARG B 39 15.482 8.161 -13.138 1.00 0.00 C ATOM 2256 CG ARG B 39 15.258 9.014 -14.369 1.00 0.00 C ATOM 2257 CD ARG B 39 13.857 8.822 -14.918 1.00 0.00 C ATOM 2258 NE ARG B 39 13.507 7.405 -15.035 1.00 0.00 N ATOM 2259 CZ ARG B 39 13.673 6.679 -16.140 1.00 0.00 C ATOM 2260 NH1 ARG B 39 14.220 7.215 -17.221 1.00 0.00 N ATOM 2261 NH2 ARG B 39 13.298 5.407 -16.157 1.00 0.00 N ATOM 0 H ARG B 39 16.817 6.835 -11.025 1.00 0.00 H new ATOM 0 HA ARG B 39 17.605 8.230 -13.506 1.00 0.00 H new ATOM 0 HB2 ARG B 39 15.171 7.139 -13.354 1.00 0.00 H new ATOM 0 HB3 ARG B 39 14.843 8.525 -12.334 1.00 0.00 H new ATOM 0 HG2 ARG B 39 15.414 10.064 -14.121 1.00 0.00 H new ATOM 0 HG3 ARG B 39 15.990 8.754 -15.133 1.00 0.00 H new ATOM 0 HD2 ARG B 39 13.140 9.321 -14.266 1.00 0.00 H new ATOM 0 HD3 ARG B 39 13.782 9.297 -15.896 1.00 0.00 H new ATOM 0 HE ARG B 39 13.110 6.943 -14.217 1.00 0.00 H new ATOM 0 HH11 ARG B 39 14.518 8.191 -17.212 1.00 0.00 H new ATOM 0 HH12 ARG B 39 14.343 6.652 -18.063 1.00 0.00 H new ATOM 0 HH21 ARG B 39 12.883 4.986 -15.325 1.00 0.00 H new ATOM 0 HH22 ARG B 39 13.424 4.849 -17.002 1.00 0.00 H new ATOM 2275 N ALA B 40 17.838 10.362 -12.304 1.00 0.00 N ATOM 2276 CA ALA B 40 18.130 11.581 -11.563 1.00 0.00 C ATOM 2277 C ALA B 40 16.886 12.457 -11.455 1.00 0.00 C ATOM 2278 O ALA B 40 16.020 12.413 -12.330 1.00 0.00 O ATOM 2279 CB ALA B 40 19.262 12.347 -12.234 1.00 0.00 C ATOM 0 H ALA B 40 18.166 10.368 -13.270 1.00 0.00 H new ATOM 0 HA ALA B 40 18.443 11.306 -10.556 1.00 0.00 H new ATOM 0 HB1 ALA B 40 19.470 13.256 -11.670 1.00 0.00 H new ATOM 0 HB2 ALA B 40 20.156 11.724 -12.262 1.00 0.00 H new ATOM 0 HB3 ALA B 40 18.971 12.610 -13.251 1.00 0.00 H new ATOM 2285 N VAL B 41 16.813 13.253 -10.386 1.00 0.00 N ATOM 2286 CA VAL B 41 15.657 14.117 -10.114 1.00 0.00 C ATOM 2287 C VAL B 41 15.258 14.946 -11.336 1.00 0.00 C ATOM 2288 O VAL B 41 14.082 15.015 -11.687 1.00 0.00 O ATOM 2289 CB VAL B 41 15.934 15.075 -8.935 1.00 0.00 C ATOM 2290 CG1 VAL B 41 14.716 15.937 -8.641 1.00 0.00 C ATOM 2291 CG2 VAL B 41 16.338 14.297 -7.696 1.00 0.00 C ATOM 0 H VAL B 41 17.551 13.318 -9.685 1.00 0.00 H new ATOM 0 HA VAL B 41 14.835 13.449 -9.857 1.00 0.00 H new ATOM 0 HB VAL B 41 16.759 15.729 -9.219 1.00 0.00 H new ATOM 0 HG11 VAL B 41 14.935 16.604 -7.807 1.00 0.00 H new ATOM 0 HG12 VAL B 41 14.467 16.528 -9.522 1.00 0.00 H new ATOM 0 HG13 VAL B 41 13.872 15.298 -8.383 1.00 0.00 H new ATOM 0 HG21 VAL B 41 16.529 14.991 -6.877 1.00 0.00 H new ATOM 0 HG22 VAL B 41 15.534 13.616 -7.416 1.00 0.00 H new ATOM 0 HG23 VAL B 41 17.242 13.725 -7.904 1.00 0.00 H new ATOM 2301 N GLU B 42 16.245 15.561 -11.982 1.00 0.00 N ATOM 2302 CA GLU B 42 16.002 16.390 -13.162 1.00 0.00 C ATOM 2303 C GLU B 42 15.322 15.586 -14.269 1.00 0.00 C ATOM 2304 O GLU B 42 14.389 16.065 -14.917 1.00 0.00 O ATOM 2305 CB GLU B 42 17.319 16.979 -13.668 1.00 0.00 C ATOM 2306 CG GLU B 42 17.940 17.986 -12.713 1.00 0.00 C ATOM 2307 CD GLU B 42 19.337 18.403 -13.124 1.00 0.00 C ATOM 2308 OE1 GLU B 42 19.474 19.263 -14.022 1.00 0.00 O ATOM 2309 OE2 GLU B 42 20.309 17.875 -12.548 1.00 0.00 O ATOM 0 H GLU B 42 17.226 15.501 -11.707 1.00 0.00 H new ATOM 0 HA GLU B 42 15.334 17.202 -12.877 1.00 0.00 H new ATOM 0 HB2 GLU B 42 18.028 16.169 -13.840 1.00 0.00 H new ATOM 0 HB3 GLU B 42 17.146 17.461 -14.630 1.00 0.00 H new ATOM 0 HG2 GLU B 42 17.303 18.869 -12.660 1.00 0.00 H new ATOM 0 HG3 GLU B 42 17.974 17.557 -11.712 1.00 0.00 H new ATOM 2316 N ALA B 43 15.779 14.357 -14.464 1.00 0.00 N ATOM 2317 CA ALA B 43 15.208 13.485 -15.481 1.00 0.00 C ATOM 2318 C ALA B 43 13.810 13.026 -15.073 1.00 0.00 C ATOM 2319 O ALA B 43 12.897 12.978 -15.897 1.00 0.00 O ATOM 2320 CB ALA B 43 16.115 12.291 -15.726 1.00 0.00 C ATOM 0 H ALA B 43 16.543 13.941 -13.932 1.00 0.00 H new ATOM 0 HA ALA B 43 15.123 14.048 -16.410 1.00 0.00 H new ATOM 0 HB1 ALA B 43 15.674 11.649 -16.489 1.00 0.00 H new ATOM 0 HB2 ALA B 43 17.091 12.639 -16.065 1.00 0.00 H new ATOM 0 HB3 ALA B 43 16.232 11.727 -14.801 1.00 0.00 H new ATOM 2326 N ILE B 44 13.655 12.702 -13.791 1.00 0.00 N ATOM 2327 CA ILE B 44 12.363 12.304 -13.243 1.00 0.00 C ATOM 2328 C ILE B 44 11.339 13.415 -13.444 1.00 0.00 C ATOM 2329 O ILE B 44 10.251 13.185 -13.973 1.00 0.00 O ATOM 2330 CB ILE B 44 12.456 11.990 -11.731 1.00 0.00 C ATOM 2331 CG1 ILE B 44 13.469 10.876 -11.471 1.00 0.00 C ATOM 2332 CG2 ILE B 44 11.090 11.603 -11.183 1.00 0.00 C ATOM 2333 CD1 ILE B 44 13.724 10.623 -10.001 1.00 0.00 C ATOM 0 H ILE B 44 14.414 12.708 -13.110 1.00 0.00 H new ATOM 0 HA ILE B 44 12.054 11.403 -13.773 1.00 0.00 H new ATOM 0 HB ILE B 44 12.795 12.889 -11.216 1.00 0.00 H new ATOM 0 HG12 ILE B 44 13.112 9.956 -11.933 1.00 0.00 H new ATOM 0 HG13 ILE B 44 14.411 11.132 -11.956 1.00 0.00 H new ATOM 0 HG21 ILE B 44 11.173 11.385 -10.118 1.00 0.00 H new ATOM 0 HG22 ILE B 44 10.392 12.427 -11.331 1.00 0.00 H new ATOM 0 HG23 ILE B 44 10.725 10.719 -11.706 1.00 0.00 H new ATOM 0 HD11 ILE B 44 14.453 9.820 -9.891 1.00 0.00 H new ATOM 0 HD12 ILE B 44 14.111 11.530 -9.537 1.00 0.00 H new ATOM 0 HD13 ILE B 44 12.792 10.336 -9.514 1.00 0.00 H new ATOM 2345 N ALA B 45 11.713 14.617 -13.022 1.00 0.00 N ATOM 2346 CA ALA B 45 10.849 15.784 -13.115 1.00 0.00 C ATOM 2347 C ALA B 45 10.391 16.023 -14.549 1.00 0.00 C ATOM 2348 O ALA B 45 9.201 16.189 -14.811 1.00 0.00 O ATOM 2349 CB ALA B 45 11.572 17.008 -12.576 1.00 0.00 C ATOM 0 H ALA B 45 12.624 14.808 -12.606 1.00 0.00 H new ATOM 0 HA ALA B 45 9.960 15.599 -12.511 1.00 0.00 H new ATOM 0 HB1 ALA B 45 10.919 17.878 -12.649 1.00 0.00 H new ATOM 0 HB2 ALA B 45 11.840 16.842 -11.533 1.00 0.00 H new ATOM 0 HB3 ALA B 45 12.476 17.183 -13.160 1.00 0.00 H new ATOM 2355 N THR B 46 11.340 16.015 -15.474 1.00 0.00 N ATOM 2356 CA THR B 46 11.042 16.258 -16.876 1.00 0.00 C ATOM 2357 C THR B 46 10.078 15.206 -17.434 1.00 0.00 C ATOM 2358 O THR B 46 9.065 15.546 -18.049 1.00 0.00 O ATOM 2359 CB THR B 46 12.335 16.276 -17.716 1.00 0.00 C ATOM 2360 OG1 THR B 46 13.281 17.186 -17.137 1.00 0.00 O ATOM 2361 CG2 THR B 46 12.048 16.692 -19.152 1.00 0.00 C ATOM 0 H THR B 46 12.326 15.842 -15.277 1.00 0.00 H new ATOM 0 HA THR B 46 10.562 17.234 -16.940 1.00 0.00 H new ATOM 0 HB THR B 46 12.749 15.268 -17.722 1.00 0.00 H new ATOM 0 HG1 THR B 46 13.712 16.763 -16.365 1.00 0.00 H new ATOM 0 HG21 THR B 46 12.977 16.696 -19.722 1.00 0.00 H new ATOM 0 HG22 THR B 46 11.349 15.987 -19.602 1.00 0.00 H new ATOM 0 HG23 THR B 46 11.612 17.691 -19.161 1.00 0.00 H new ATOM 2369 N ALA B 47 10.378 13.936 -17.188 1.00 0.00 N ATOM 2370 CA ALA B 47 9.578 12.840 -17.729 1.00 0.00 C ATOM 2371 C ALA B 47 8.159 12.843 -17.166 1.00 0.00 C ATOM 2372 O ALA B 47 7.204 12.480 -17.854 1.00 0.00 O ATOM 2373 CB ALA B 47 10.253 11.510 -17.441 1.00 0.00 C ATOM 0 H ALA B 47 11.169 13.638 -16.617 1.00 0.00 H new ATOM 0 HA ALA B 47 9.505 12.983 -18.807 1.00 0.00 H new ATOM 0 HB1 ALA B 47 9.649 10.700 -17.848 1.00 0.00 H new ATOM 0 HB2 ALA B 47 11.240 11.495 -17.904 1.00 0.00 H new ATOM 0 HB3 ALA B 47 10.356 11.380 -16.364 1.00 0.00 H new ATOM 2379 N THR B 48 8.022 13.257 -15.916 1.00 0.00 N ATOM 2380 CA THR B 48 6.721 13.275 -15.261 1.00 0.00 C ATOM 2381 C THR B 48 5.965 14.572 -15.554 1.00 0.00 C ATOM 2382 O THR B 48 4.755 14.659 -15.338 1.00 0.00 O ATOM 2383 CB THR B 48 6.857 13.084 -13.737 1.00 0.00 C ATOM 2384 OG1 THR B 48 7.819 14.004 -13.204 1.00 0.00 O ATOM 2385 CG2 THR B 48 7.276 11.659 -13.405 1.00 0.00 C ATOM 0 H THR B 48 8.793 13.585 -15.335 1.00 0.00 H new ATOM 0 HA THR B 48 6.150 12.441 -15.668 1.00 0.00 H new ATOM 0 HB THR B 48 5.884 13.278 -13.285 1.00 0.00 H new ATOM 0 HG1 THR B 48 8.718 13.623 -13.289 1.00 0.00 H new ATOM 0 HG21 THR B 48 7.365 11.548 -12.324 1.00 0.00 H new ATOM 0 HG22 THR B 48 6.526 10.963 -13.780 1.00 0.00 H new ATOM 0 HG23 THR B 48 8.237 11.444 -13.872 1.00 0.00 H new ATOM 2393 N GLY B 49 6.681 15.573 -16.054 1.00 0.00 N ATOM 2394 CA GLY B 49 6.060 16.846 -16.367 1.00 0.00 C ATOM 2395 C GLY B 49 5.876 17.718 -15.142 1.00 0.00 C ATOM 2396 O GLY B 49 5.064 18.644 -15.144 1.00 0.00 O ATOM 0 H GLY B 49 7.681 15.525 -16.248 1.00 0.00 H new ATOM 0 HA2 GLY B 49 6.672 17.375 -17.097 1.00 0.00 H new ATOM 0 HA3 GLY B 49 5.090 16.669 -16.832 1.00 0.00 H new ATOM 2400 N MET B 50 6.630 17.424 -14.093 1.00 0.00 N ATOM 2401 CA MET B 50 6.552 18.186 -12.854 1.00 0.00 C ATOM 2402 C MET B 50 7.873 18.895 -12.597 1.00 0.00 C ATOM 2403 O MET B 50 8.919 18.443 -13.051 1.00 0.00 O ATOM 2404 CB MET B 50 6.200 17.266 -11.680 1.00 0.00 C ATOM 2405 CG MET B 50 4.821 16.628 -11.801 1.00 0.00 C ATOM 2406 SD MET B 50 4.399 15.565 -10.402 1.00 0.00 S ATOM 2407 CE MET B 50 5.578 14.230 -10.601 1.00 0.00 C ATOM 0 H MET B 50 7.306 16.660 -14.075 1.00 0.00 H new ATOM 0 HA MET B 50 5.765 18.934 -12.950 1.00 0.00 H new ATOM 0 HB2 MET B 50 6.951 16.479 -11.607 1.00 0.00 H new ATOM 0 HB3 MET B 50 6.247 17.838 -10.753 1.00 0.00 H new ATOM 0 HG2 MET B 50 4.071 17.414 -11.890 1.00 0.00 H new ATOM 0 HG3 MET B 50 4.779 16.042 -12.719 1.00 0.00 H new ATOM 0 HE1 MET B 50 5.044 13.285 -10.698 1.00 0.00 H new ATOM 0 HE2 MET B 50 6.176 14.403 -11.496 1.00 0.00 H new ATOM 0 HE3 MET B 50 6.232 14.190 -9.730 1.00 0.00 H new ATOM 2417 N ASN B 51 7.827 20.016 -11.895 1.00 0.00 N ATOM 2418 CA ASN B 51 9.044 20.759 -11.575 1.00 0.00 C ATOM 2419 C ASN B 51 9.849 20.021 -10.510 1.00 0.00 C ATOM 2420 O ASN B 51 9.301 19.202 -9.772 1.00 0.00 O ATOM 2421 CB ASN B 51 8.707 22.177 -11.096 1.00 0.00 C ATOM 2422 CG ASN B 51 9.945 23.022 -10.834 1.00 0.00 C ATOM 2423 OD1 ASN B 51 10.495 23.022 -9.733 1.00 0.00 O ATOM 2424 ND2 ASN B 51 10.394 23.754 -11.839 1.00 0.00 N ATOM 0 H ASN B 51 6.968 20.433 -11.536 1.00 0.00 H new ATOM 0 HA ASN B 51 9.645 20.837 -12.481 1.00 0.00 H new ATOM 0 HB2 ASN B 51 8.088 22.671 -11.845 1.00 0.00 H new ATOM 0 HB3 ASN B 51 8.115 22.116 -10.183 1.00 0.00 H new ATOM 0 HD21 ASN B 51 11.219 24.341 -11.714 1.00 0.00 H new ATOM 0 HD22 ASN B 51 9.916 23.732 -12.740 1.00 0.00 H new ATOM 2431 N LEU B 52 11.145 20.318 -10.439 1.00 0.00 N ATOM 2432 CA LEU B 52 12.039 19.695 -9.466 1.00 0.00 C ATOM 2433 C LEU B 52 11.515 19.855 -8.042 1.00 0.00 C ATOM 2434 O LEU B 52 11.664 18.955 -7.223 1.00 0.00 O ATOM 2435 CB LEU B 52 13.454 20.285 -9.563 1.00 0.00 C ATOM 2436 CG LEU B 52 14.279 19.861 -10.787 1.00 0.00 C ATOM 2437 CD1 LEU B 52 13.709 20.441 -12.075 1.00 0.00 C ATOM 2438 CD2 LEU B 52 15.728 20.280 -10.608 1.00 0.00 C ATOM 0 H LEU B 52 11.603 20.994 -11.051 1.00 0.00 H new ATOM 0 HA LEU B 52 12.079 18.632 -9.703 1.00 0.00 H new ATOM 0 HB2 LEU B 52 13.373 21.372 -9.563 1.00 0.00 H new ATOM 0 HB3 LEU B 52 14.005 20.006 -8.665 1.00 0.00 H new ATOM 0 HG LEU B 52 14.229 18.775 -10.868 1.00 0.00 H new ATOM 0 HD11 LEU B 52 14.318 20.120 -12.920 1.00 0.00 H new ATOM 0 HD12 LEU B 52 12.686 20.089 -12.211 1.00 0.00 H new ATOM 0 HD13 LEU B 52 13.714 21.529 -12.017 1.00 0.00 H new ATOM 0 HD21 LEU B 52 16.305 19.975 -11.481 1.00 0.00 H new ATOM 0 HD22 LEU B 52 15.783 21.363 -10.497 1.00 0.00 H new ATOM 0 HD23 LEU B 52 16.137 19.803 -9.718 1.00 0.00 H new ATOM 2450 N THR B 53 10.889 20.994 -7.756 1.00 0.00 N ATOM 2451 CA THR B 53 10.334 21.241 -6.432 1.00 0.00 C ATOM 2452 C THR B 53 9.206 20.259 -6.129 1.00 0.00 C ATOM 2453 O THR B 53 9.154 19.659 -5.052 1.00 0.00 O ATOM 2454 CB THR B 53 9.812 22.688 -6.302 1.00 0.00 C ATOM 2455 OG1 THR B 53 8.896 22.982 -7.367 1.00 0.00 O ATOM 2456 CG2 THR B 53 10.959 23.686 -6.327 1.00 0.00 C ATOM 0 H THR B 53 10.755 21.756 -8.421 1.00 0.00 H new ATOM 0 HA THR B 53 11.137 21.098 -5.710 1.00 0.00 H new ATOM 0 HB THR B 53 9.296 22.774 -5.346 1.00 0.00 H new ATOM 0 HG1 THR B 53 9.393 23.092 -8.205 1.00 0.00 H new ATOM 0 HG21 THR B 53 10.563 24.697 -6.234 1.00 0.00 H new ATOM 0 HG22 THR B 53 11.636 23.483 -5.497 1.00 0.00 H new ATOM 0 HG23 THR B 53 11.501 23.594 -7.268 1.00 0.00 H new ATOM 2464 N THR B 54 8.315 20.084 -7.097 1.00 0.00 N ATOM 2465 CA THR B 54 7.212 19.152 -6.961 1.00 0.00 C ATOM 2466 C THR B 54 7.743 17.721 -6.906 1.00 0.00 C ATOM 2467 O THR B 54 7.346 16.933 -6.048 1.00 0.00 O ATOM 2468 CB THR B 54 6.219 19.297 -8.131 1.00 0.00 C ATOM 2469 OG1 THR B 54 5.882 20.680 -8.315 1.00 0.00 O ATOM 2470 CG2 THR B 54 4.949 18.497 -7.875 1.00 0.00 C ATOM 0 H THR B 54 8.339 20.580 -7.988 1.00 0.00 H new ATOM 0 HA THR B 54 6.686 19.379 -6.034 1.00 0.00 H new ATOM 0 HB THR B 54 6.697 18.910 -9.031 1.00 0.00 H new ATOM 0 HG1 THR B 54 5.252 20.767 -9.061 1.00 0.00 H new ATOM 0 HG21 THR B 54 4.267 18.618 -8.717 1.00 0.00 H new ATOM 0 HG22 THR B 54 5.200 17.443 -7.760 1.00 0.00 H new ATOM 0 HG23 THR B 54 4.469 18.857 -6.965 1.00 0.00 H new ATOM 2478 N ALA B 55 8.666 17.410 -7.810 1.00 0.00 N ATOM 2479 CA ALA B 55 9.269 16.086 -7.873 1.00 0.00 C ATOM 2480 C ALA B 55 9.940 15.722 -6.552 1.00 0.00 C ATOM 2481 O ALA B 55 9.644 14.679 -5.975 1.00 0.00 O ATOM 2482 CB ALA B 55 10.273 16.019 -9.015 1.00 0.00 C ATOM 0 H ALA B 55 9.014 18.062 -8.513 1.00 0.00 H new ATOM 0 HA ALA B 55 8.476 15.361 -8.057 1.00 0.00 H new ATOM 0 HB1 ALA B 55 10.717 15.024 -9.051 1.00 0.00 H new ATOM 0 HB2 ALA B 55 9.766 16.225 -9.958 1.00 0.00 H new ATOM 0 HB3 ALA B 55 11.056 16.760 -8.855 1.00 0.00 H new ATOM 2488 N SER B 56 10.818 16.599 -6.071 1.00 0.00 N ATOM 2489 CA SER B 56 11.564 16.353 -4.840 1.00 0.00 C ATOM 2490 C SER B 56 10.624 16.084 -3.669 1.00 0.00 C ATOM 2491 O SER B 56 10.787 15.097 -2.959 1.00 0.00 O ATOM 2492 CB SER B 56 12.477 17.542 -4.518 1.00 0.00 C ATOM 2493 OG SER B 56 13.279 17.286 -3.377 1.00 0.00 O ATOM 0 H SER B 56 11.031 17.491 -6.518 1.00 0.00 H new ATOM 0 HA SER B 56 12.178 15.466 -4.996 1.00 0.00 H new ATOM 0 HB2 SER B 56 13.117 17.753 -5.374 1.00 0.00 H new ATOM 0 HB3 SER B 56 11.871 18.432 -4.346 1.00 0.00 H new ATOM 0 HG SER B 56 12.716 17.283 -2.575 1.00 0.00 H new ATOM 2499 N ALA B 57 9.630 16.952 -3.487 1.00 0.00 N ATOM 2500 CA ALA B 57 8.685 16.820 -2.377 1.00 0.00 C ATOM 2501 C ALA B 57 8.003 15.455 -2.385 1.00 0.00 C ATOM 2502 O ALA B 57 7.870 14.804 -1.347 1.00 0.00 O ATOM 2503 CB ALA B 57 7.648 17.931 -2.441 1.00 0.00 C ATOM 0 H ALA B 57 9.457 17.754 -4.093 1.00 0.00 H new ATOM 0 HA ALA B 57 9.244 16.906 -1.445 1.00 0.00 H new ATOM 0 HB1 ALA B 57 6.949 17.825 -1.611 1.00 0.00 H new ATOM 0 HB2 ALA B 57 8.146 18.898 -2.374 1.00 0.00 H new ATOM 0 HB3 ALA B 57 7.104 17.867 -3.384 1.00 0.00 H new ATOM 2509 N ASN B 58 7.593 15.014 -3.566 1.00 0.00 N ATOM 2510 CA ASN B 58 6.916 13.733 -3.703 1.00 0.00 C ATOM 2511 C ASN B 58 7.901 12.576 -3.543 1.00 0.00 C ATOM 2512 O ASN B 58 7.567 11.544 -2.959 1.00 0.00 O ATOM 2513 CB ASN B 58 6.190 13.642 -5.050 1.00 0.00 C ATOM 2514 CG ASN B 58 4.932 14.498 -5.093 1.00 0.00 C ATOM 2515 OD1 ASN B 58 3.853 14.055 -4.712 1.00 0.00 O ATOM 2516 ND2 ASN B 58 5.052 15.723 -5.568 1.00 0.00 N ATOM 0 H ASN B 58 7.717 15.523 -4.441 1.00 0.00 H new ATOM 0 HA ASN B 58 6.173 13.659 -2.909 1.00 0.00 H new ATOM 0 HB2 ASN B 58 6.866 13.955 -5.845 1.00 0.00 H new ATOM 0 HB3 ASN B 58 5.926 12.603 -5.247 1.00 0.00 H new ATOM 0 HD21 ASN B 58 4.234 16.330 -5.626 1.00 0.00 H new ATOM 0 HD22 ASN B 58 5.963 16.063 -5.877 1.00 0.00 H new ATOM 2523 N LEU B 59 9.118 12.762 -4.047 1.00 0.00 N ATOM 2524 CA LEU B 59 10.177 11.765 -3.903 1.00 0.00 C ATOM 2525 C LEU B 59 10.557 11.589 -2.437 1.00 0.00 C ATOM 2526 O LEU B 59 10.733 10.468 -1.961 1.00 0.00 O ATOM 2527 CB LEU B 59 11.413 12.172 -4.711 1.00 0.00 C ATOM 2528 CG LEU B 59 11.252 12.092 -6.231 1.00 0.00 C ATOM 2529 CD1 LEU B 59 12.469 12.678 -6.931 1.00 0.00 C ATOM 2530 CD2 LEU B 59 11.035 10.653 -6.667 1.00 0.00 C ATOM 0 H LEU B 59 9.397 13.598 -4.561 1.00 0.00 H new ATOM 0 HA LEU B 59 9.799 10.817 -4.285 1.00 0.00 H new ATOM 0 HB2 LEU B 59 11.682 13.194 -4.443 1.00 0.00 H new ATOM 0 HB3 LEU B 59 12.247 11.535 -4.416 1.00 0.00 H new ATOM 0 HG LEU B 59 10.377 12.677 -6.513 1.00 0.00 H new ATOM 0 HD11 LEU B 59 12.335 12.612 -8.011 1.00 0.00 H new ATOM 0 HD12 LEU B 59 12.586 13.723 -6.643 1.00 0.00 H new ATOM 0 HD13 LEU B 59 13.359 12.120 -6.641 1.00 0.00 H new ATOM 0 HD21 LEU B 59 10.922 10.614 -7.750 1.00 0.00 H new ATOM 0 HD22 LEU B 59 11.892 10.049 -6.369 1.00 0.00 H new ATOM 0 HD23 LEU B 59 10.134 10.262 -6.194 1.00 0.00 H new ATOM 2542 N GLN B 60 10.666 12.704 -1.722 1.00 0.00 N ATOM 2543 CA GLN B 60 11.003 12.687 -0.303 1.00 0.00 C ATOM 2544 C GLN B 60 9.930 11.961 0.501 1.00 0.00 C ATOM 2545 O GLN B 60 10.224 11.306 1.500 1.00 0.00 O ATOM 2546 CB GLN B 60 11.176 14.116 0.216 1.00 0.00 C ATOM 2547 CG GLN B 60 12.406 14.814 -0.341 1.00 0.00 C ATOM 2548 CD GLN B 60 12.423 16.298 -0.039 1.00 0.00 C ATOM 2549 OE1 GLN B 60 11.926 17.111 -0.820 1.00 0.00 O ATOM 2550 NE2 GLN B 60 12.992 16.664 1.098 1.00 0.00 N ATOM 0 H GLN B 60 10.524 13.638 -2.106 1.00 0.00 H new ATOM 0 HA GLN B 60 11.944 12.150 -0.181 1.00 0.00 H new ATOM 0 HB2 GLN B 60 10.290 14.697 -0.039 1.00 0.00 H new ATOM 0 HB3 GLN B 60 11.241 14.095 1.304 1.00 0.00 H new ATOM 0 HG2 GLN B 60 13.301 14.352 0.076 1.00 0.00 H new ATOM 0 HG3 GLN B 60 12.445 14.667 -1.420 1.00 0.00 H new ATOM 0 HE21 GLN B 60 13.392 15.960 1.718 1.00 0.00 H new ATOM 0 HE22 GLN B 60 13.030 17.650 1.355 1.00 0.00 H new ATOM 2559 N ALA B 61 8.685 12.078 0.055 1.00 0.00 N ATOM 2560 CA ALA B 61 7.581 11.364 0.682 1.00 0.00 C ATOM 2561 C ALA B 61 7.730 9.857 0.485 1.00 0.00 C ATOM 2562 O ALA B 61 7.639 9.082 1.438 1.00 0.00 O ATOM 2563 CB ALA B 61 6.252 11.845 0.124 1.00 0.00 C ATOM 0 H ALA B 61 8.415 12.660 -0.738 1.00 0.00 H new ATOM 0 HA ALA B 61 7.603 11.572 1.752 1.00 0.00 H new ATOM 0 HB1 ALA B 61 5.438 11.301 0.603 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.140 12.912 0.319 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.223 11.668 -0.951 1.00 0.00 H new ATOM 2569 N LEU B 62 7.981 9.457 -0.757 1.00 0.00 N ATOM 2570 CA LEU B 62 8.199 8.052 -1.087 1.00 0.00 C ATOM 2571 C LEU B 62 9.412 7.516 -0.332 1.00 0.00 C ATOM 2572 O LEU B 62 9.430 6.371 0.123 1.00 0.00 O ATOM 2573 CB LEU B 62 8.413 7.891 -2.595 1.00 0.00 C ATOM 2574 CG LEU B 62 7.267 8.389 -3.479 1.00 0.00 C ATOM 2575 CD1 LEU B 62 7.673 8.365 -4.945 1.00 0.00 C ATOM 2576 CD2 LEU B 62 6.020 7.546 -3.261 1.00 0.00 C ATOM 0 H LEU B 62 8.039 10.089 -1.556 1.00 0.00 H new ATOM 0 HA LEU B 62 7.317 7.484 -0.791 1.00 0.00 H new ATOM 0 HB2 LEU B 62 9.322 8.423 -2.874 1.00 0.00 H new ATOM 0 HB3 LEU B 62 8.583 6.836 -2.810 1.00 0.00 H new ATOM 0 HG LEU B 62 7.042 9.418 -3.200 1.00 0.00 H new ATOM 0 HD11 LEU B 62 6.845 8.722 -5.558 1.00 0.00 H new ATOM 0 HD12 LEU B 62 8.539 9.010 -5.093 1.00 0.00 H new ATOM 0 HD13 LEU B 62 7.926 7.345 -5.236 1.00 0.00 H new ATOM 0 HD21 LEU B 62 5.216 7.915 -3.898 1.00 0.00 H new ATOM 0 HD22 LEU B 62 6.235 6.507 -3.512 1.00 0.00 H new ATOM 0 HD23 LEU B 62 5.715 7.611 -2.217 1.00 0.00 H new ATOM 2588 N LYS B 63 10.420 8.367 -0.199 1.00 0.00 N ATOM 2589 CA LYS B 63 11.647 8.025 0.504 1.00 0.00 C ATOM 2590 C LYS B 63 11.398 7.868 2.004 1.00 0.00 C ATOM 2591 O LYS B 63 11.991 7.005 2.648 1.00 0.00 O ATOM 2592 CB LYS B 63 12.702 9.100 0.233 1.00 0.00 C ATOM 2593 CG LYS B 63 13.980 8.945 1.037 1.00 0.00 C ATOM 2594 CD LYS B 63 15.054 9.900 0.546 1.00 0.00 C ATOM 2595 CE LYS B 63 16.187 10.025 1.547 1.00 0.00 C ATOM 2596 NZ LYS B 63 16.753 8.705 1.926 1.00 0.00 N ATOM 0 H LYS B 63 10.409 9.315 -0.576 1.00 0.00 H new ATOM 0 HA LYS B 63 12.011 7.066 0.135 1.00 0.00 H new ATOM 0 HB2 LYS B 63 12.951 9.087 -0.828 1.00 0.00 H new ATOM 0 HB3 LYS B 63 12.270 10.077 0.447 1.00 0.00 H new ATOM 0 HG2 LYS B 63 13.775 9.134 2.091 1.00 0.00 H new ATOM 0 HG3 LYS B 63 14.339 7.919 0.961 1.00 0.00 H new ATOM 0 HD2 LYS B 63 15.447 9.548 -0.408 1.00 0.00 H new ATOM 0 HD3 LYS B 63 14.615 10.882 0.367 1.00 0.00 H new ATOM 0 HE2 LYS B 63 16.975 10.648 1.124 1.00 0.00 H new ATOM 0 HE3 LYS B 63 15.825 10.533 2.441 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 17.349 8.813 2.772 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 15.979 8.041 2.130 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 17.328 8.336 1.142 1.00 0.00 H new ATOM 2610 N SER B 64 10.508 8.686 2.551 1.00 0.00 N ATOM 2611 CA SER B 64 10.171 8.604 3.969 1.00 0.00 C ATOM 2612 C SER B 64 9.378 7.332 4.267 1.00 0.00 C ATOM 2613 O SER B 64 9.352 6.856 5.403 1.00 0.00 O ATOM 2614 CB SER B 64 9.375 9.834 4.403 1.00 0.00 C ATOM 2615 OG SER B 64 10.124 11.023 4.194 1.00 0.00 O ATOM 0 H SER B 64 10.007 9.412 2.038 1.00 0.00 H new ATOM 0 HA SER B 64 11.102 8.571 4.535 1.00 0.00 H new ATOM 0 HB2 SER B 64 8.442 9.884 3.842 1.00 0.00 H new ATOM 0 HB3 SER B 64 9.110 9.747 5.457 1.00 0.00 H new ATOM 0 HG SER B 64 10.192 11.202 3.233 1.00 0.00 H new ATOM 2621 N GLY B 65 8.724 6.795 3.244 1.00 0.00 N ATOM 2622 CA GLY B 65 8.021 5.536 3.395 1.00 0.00 C ATOM 2623 C GLY B 65 8.943 4.347 3.208 1.00 0.00 C ATOM 2624 O GLY B 65 8.587 3.217 3.535 1.00 0.00 O ATOM 0 H GLY B 65 8.668 7.209 2.313 1.00 0.00 H new ATOM 0 HA2 GLY B 65 7.566 5.491 4.385 1.00 0.00 H new ATOM 0 HA3 GLY B 65 7.210 5.484 2.669 1.00 0.00 H new ATOM 2628 N GLY B 66 10.135 4.608 2.681 1.00 0.00 N ATOM 2629 CA GLY B 66 11.096 3.548 2.454 1.00 0.00 C ATOM 2630 C GLY B 66 10.898 2.870 1.115 1.00 0.00 C ATOM 2631 O GLY B 66 11.322 1.729 0.919 1.00 0.00 O ATOM 0 H GLY B 66 10.452 5.538 2.407 1.00 0.00 H new ATOM 0 HA2 GLY B 66 12.105 3.958 2.506 1.00 0.00 H new ATOM 0 HA3 GLY B 66 11.012 2.808 3.250 1.00 0.00 H new ATOM 2635 N LEU B 67 10.256 3.575 0.195 1.00 0.00 N ATOM 2636 CA LEU B 67 9.987 3.039 -1.130 1.00 0.00 C ATOM 2637 C LEU B 67 11.162 3.280 -2.067 1.00 0.00 C ATOM 2638 O LEU B 67 11.623 2.365 -2.751 1.00 0.00 O ATOM 2639 CB LEU B 67 8.715 3.661 -1.713 1.00 0.00 C ATOM 2640 CG LEU B 67 7.405 2.937 -1.377 1.00 0.00 C ATOM 2641 CD1 LEU B 67 7.255 2.732 0.122 1.00 0.00 C ATOM 2642 CD2 LEU B 67 6.223 3.724 -1.919 1.00 0.00 C ATOM 0 H LEU B 67 9.911 4.523 0.343 1.00 0.00 H new ATOM 0 HA LEU B 67 9.841 1.963 -1.032 1.00 0.00 H new ATOM 0 HB2 LEU B 67 8.641 4.690 -1.360 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.817 3.703 -2.797 1.00 0.00 H new ATOM 0 HG LEU B 67 7.431 1.955 -1.849 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.317 2.216 0.327 1.00 0.00 H new ATOM 0 HD12 LEU B 67 8.087 2.133 0.492 1.00 0.00 H new ATOM 0 HD13 LEU B 67 7.254 3.700 0.623 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.297 3.203 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU B 67 6.210 4.717 -1.469 1.00 0.00 H new ATOM 0 HD23 LEU B 67 6.314 3.817 -3.001 1.00 0.00 H new ATOM 2654 N VAL B 68 11.654 4.507 -2.093 1.00 0.00 N ATOM 2655 CA VAL B 68 12.772 4.854 -2.954 1.00 0.00 C ATOM 2656 C VAL B 68 13.882 5.512 -2.152 1.00 0.00 C ATOM 2657 O VAL B 68 13.636 6.087 -1.091 1.00 0.00 O ATOM 2658 CB VAL B 68 12.352 5.793 -4.109 1.00 0.00 C ATOM 2659 CG1 VAL B 68 11.343 5.110 -5.023 1.00 0.00 C ATOM 2660 CG2 VAL B 68 11.793 7.104 -3.573 1.00 0.00 C ATOM 0 H VAL B 68 11.298 5.278 -1.529 1.00 0.00 H new ATOM 0 HA VAL B 68 13.133 3.922 -3.389 1.00 0.00 H new ATOM 0 HB VAL B 68 13.242 6.022 -4.695 1.00 0.00 H new ATOM 0 HG11 VAL B 68 11.063 5.790 -5.828 1.00 0.00 H new ATOM 0 HG12 VAL B 68 11.787 4.210 -5.447 1.00 0.00 H new ATOM 0 HG13 VAL B 68 10.456 4.841 -4.449 1.00 0.00 H new ATOM 0 HG21 VAL B 68 11.506 7.745 -4.407 1.00 0.00 H new ATOM 0 HG22 VAL B 68 10.919 6.901 -2.954 1.00 0.00 H new ATOM 0 HG23 VAL B 68 12.553 7.606 -2.975 1.00 0.00 H new ATOM 2670 N GLU B 69 15.099 5.420 -2.656 1.00 0.00 N ATOM 2671 CA GLU B 69 16.238 6.037 -2.001 1.00 0.00 C ATOM 2672 C GLU B 69 16.890 7.066 -2.905 1.00 0.00 C ATOM 2673 O GLU B 69 16.612 7.121 -4.104 1.00 0.00 O ATOM 2674 CB GLU B 69 17.266 4.990 -1.574 1.00 0.00 C ATOM 2675 CG GLU B 69 17.226 4.689 -0.085 1.00 0.00 C ATOM 2676 CD GLU B 69 17.300 5.947 0.759 1.00 0.00 C ATOM 2677 OE1 GLU B 69 18.007 6.905 0.363 1.00 0.00 O ATOM 2678 OE2 GLU B 69 16.630 6.004 1.808 1.00 0.00 O ATOM 0 H GLU B 69 15.324 4.923 -3.518 1.00 0.00 H new ATOM 0 HA GLU B 69 15.868 6.540 -1.107 1.00 0.00 H new ATOM 0 HB2 GLU B 69 17.090 4.069 -2.130 1.00 0.00 H new ATOM 0 HB3 GLU B 69 18.264 5.338 -1.842 1.00 0.00 H new ATOM 0 HG2 GLU B 69 16.308 4.150 0.150 1.00 0.00 H new ATOM 0 HG3 GLU B 69 18.056 4.032 0.173 1.00 0.00 H new ATOM 2685 N ALA B 70 17.765 7.868 -2.322 1.00 0.00 N ATOM 2686 CA ALA B 70 18.422 8.938 -3.048 1.00 0.00 C ATOM 2687 C ALA B 70 19.929 8.739 -3.059 1.00 0.00 C ATOM 2688 O ALA B 70 20.588 8.841 -2.021 1.00 0.00 O ATOM 2689 CB ALA B 70 18.077 10.289 -2.437 1.00 0.00 C ATOM 0 H ALA B 70 18.037 7.796 -1.342 1.00 0.00 H new ATOM 0 HA ALA B 70 18.063 8.916 -4.077 1.00 0.00 H new ATOM 0 HB1 ALA B 70 18.579 11.079 -2.995 1.00 0.00 H new ATOM 0 HB2 ALA B 70 16.999 10.443 -2.480 1.00 0.00 H new ATOM 0 HB3 ALA B 70 18.406 10.313 -1.398 1.00 0.00 H new ATOM 2695 N ARG B 71 20.461 8.451 -4.233 1.00 0.00 N ATOM 2696 CA ARG B 71 21.894 8.312 -4.415 1.00 0.00 C ATOM 2697 C ARG B 71 22.473 9.616 -4.948 1.00 0.00 C ATOM 2698 O ARG B 71 22.250 9.988 -6.101 1.00 0.00 O ATOM 2699 CB ARG B 71 22.202 7.150 -5.366 1.00 0.00 C ATOM 2700 CG ARG B 71 23.653 7.087 -5.814 1.00 0.00 C ATOM 2701 CD ARG B 71 23.938 5.820 -6.603 1.00 0.00 C ATOM 2702 NE ARG B 71 23.967 4.640 -5.741 1.00 0.00 N ATOM 2703 CZ ARG B 71 23.549 3.431 -6.111 1.00 0.00 C ATOM 2704 NH1 ARG B 71 22.969 3.255 -7.292 1.00 0.00 N ATOM 2705 NH2 ARG B 71 23.674 2.404 -5.278 1.00 0.00 N ATOM 0 H ARG B 71 19.915 8.308 -5.083 1.00 0.00 H new ATOM 0 HA ARG B 71 22.357 8.091 -3.453 1.00 0.00 H new ATOM 0 HB2 ARG B 71 21.943 6.213 -4.874 1.00 0.00 H new ATOM 0 HB3 ARG B 71 21.564 7.235 -6.246 1.00 0.00 H new ATOM 0 HG2 ARG B 71 23.884 7.958 -6.427 1.00 0.00 H new ATOM 0 HG3 ARG B 71 24.306 7.129 -4.942 1.00 0.00 H new ATOM 0 HD2 ARG B 71 23.175 5.691 -7.371 1.00 0.00 H new ATOM 0 HD3 ARG B 71 24.894 5.919 -7.117 1.00 0.00 H new ATOM 0 HE ARG B 71 24.331 4.750 -4.795 1.00 0.00 H new ATOM 0 HH11 ARG B 71 22.842 4.048 -7.921 1.00 0.00 H new ATOM 0 HH12 ARG B 71 22.651 2.327 -7.571 1.00 0.00 H new ATOM 0 HH21 ARG B 71 24.090 2.542 -4.357 1.00 0.00 H new ATOM 0 HH22 ARG B 71 23.354 1.477 -5.560 1.00 0.00 H new ATOM 2719 N ARG B 72 23.189 10.320 -4.092 1.00 0.00 N ATOM 2720 CA ARG B 72 23.764 11.604 -4.453 1.00 0.00 C ATOM 2721 C ARG B 72 25.168 11.403 -4.994 1.00 0.00 C ATOM 2722 O ARG B 72 26.110 11.166 -4.239 1.00 0.00 O ATOM 2723 CB ARG B 72 23.791 12.533 -3.239 1.00 0.00 C ATOM 2724 CG ARG B 72 22.482 12.545 -2.478 1.00 0.00 C ATOM 2725 CD ARG B 72 22.564 13.401 -1.229 1.00 0.00 C ATOM 2726 NE ARG B 72 21.518 13.049 -0.272 1.00 0.00 N ATOM 2727 CZ ARG B 72 20.946 13.904 0.568 1.00 0.00 C ATOM 2728 NH1 ARG B 72 21.249 15.196 0.527 1.00 0.00 N ATOM 2729 NH2 ARG B 72 20.049 13.457 1.435 1.00 0.00 N ATOM 0 H ARG B 72 23.388 10.023 -3.137 1.00 0.00 H new ATOM 0 HA ARG B 72 23.148 12.064 -5.226 1.00 0.00 H new ATOM 0 HB2 ARG B 72 24.593 12.223 -2.568 1.00 0.00 H new ATOM 0 HB3 ARG B 72 24.024 13.546 -3.568 1.00 0.00 H new ATOM 0 HG2 ARG B 72 21.689 12.921 -3.125 1.00 0.00 H new ATOM 0 HG3 ARG B 72 22.212 11.525 -2.203 1.00 0.00 H new ATOM 0 HD2 ARG B 72 23.542 13.276 -0.764 1.00 0.00 H new ATOM 0 HD3 ARG B 72 22.472 14.453 -1.500 1.00 0.00 H new ATOM 0 HE ARG B 72 21.205 12.079 -0.247 1.00 0.00 H new ATOM 0 HH11 ARG B 72 21.926 15.540 -0.154 1.00 0.00 H new ATOM 0 HH12 ARG B 72 20.804 15.845 1.176 1.00 0.00 H new ATOM 0 HH21 ARG B 72 19.805 12.467 1.452 1.00 0.00 H new ATOM 0 HH22 ARG B 72 19.602 14.103 2.086 1.00 0.00 H new ATOM 2743 N GLU B 73 25.294 11.475 -6.303 1.00 0.00 N ATOM 2744 CA GLU B 73 26.569 11.255 -6.954 1.00 0.00 C ATOM 2745 C GLU B 73 26.981 12.519 -7.694 1.00 0.00 C ATOM 2746 O GLU B 73 26.402 12.863 -8.729 1.00 0.00 O ATOM 2747 CB GLU B 73 26.472 10.069 -7.914 1.00 0.00 C ATOM 2748 CG GLU B 73 27.708 9.181 -7.927 1.00 0.00 C ATOM 2749 CD GLU B 73 28.949 9.900 -8.412 1.00 0.00 C ATOM 2750 OE1 GLU B 73 29.160 9.960 -9.639 1.00 0.00 O ATOM 2751 OE2 GLU B 73 29.720 10.405 -7.571 1.00 0.00 O ATOM 0 H GLU B 73 24.525 11.685 -6.940 1.00 0.00 H new ATOM 0 HA GLU B 73 27.327 11.022 -6.206 1.00 0.00 H new ATOM 0 HB2 GLU B 73 25.606 9.465 -7.643 1.00 0.00 H new ATOM 0 HB3 GLU B 73 26.296 10.444 -8.922 1.00 0.00 H new ATOM 0 HG2 GLU B 73 27.885 8.800 -6.921 1.00 0.00 H new ATOM 0 HG3 GLU B 73 27.522 8.318 -8.566 1.00 0.00 H new ATOM 2758 N GLY B 74 27.969 13.212 -7.152 1.00 0.00 N ATOM 2759 CA GLY B 74 28.370 14.486 -7.705 1.00 0.00 C ATOM 2760 C GLY B 74 27.363 15.569 -7.386 1.00 0.00 C ATOM 2761 O GLY B 74 27.164 15.915 -6.222 1.00 0.00 O ATOM 0 H GLY B 74 28.502 12.913 -6.335 1.00 0.00 H new ATOM 0 HA2 GLY B 74 29.346 14.766 -7.307 1.00 0.00 H new ATOM 0 HA3 GLY B 74 28.480 14.397 -8.786 1.00 0.00 H new ATOM 2765 N THR B 75 26.722 16.097 -8.415 1.00 0.00 N ATOM 2766 CA THR B 75 25.696 17.108 -8.230 1.00 0.00 C ATOM 2767 C THR B 75 24.313 16.507 -8.478 1.00 0.00 C ATOM 2768 O THR B 75 23.287 17.147 -8.241 1.00 0.00 O ATOM 2769 CB THR B 75 25.911 18.294 -9.193 1.00 0.00 C ATOM 2770 OG1 THR B 75 27.312 18.582 -9.314 1.00 0.00 O ATOM 2771 CG2 THR B 75 25.188 19.540 -8.701 1.00 0.00 C ATOM 0 H THR B 75 26.894 15.842 -9.387 1.00 0.00 H new ATOM 0 HA THR B 75 25.762 17.468 -7.203 1.00 0.00 H new ATOM 0 HB THR B 75 25.504 18.012 -10.164 1.00 0.00 H new ATOM 0 HG1 THR B 75 27.439 19.335 -9.928 1.00 0.00 H new ATOM 0 HG21 THR B 75 25.358 20.359 -9.400 1.00 0.00 H new ATOM 0 HG22 THR B 75 24.119 19.337 -8.632 1.00 0.00 H new ATOM 0 HG23 THR B 75 25.569 19.817 -7.718 1.00 0.00 H new ATOM 2779 N ARG B 76 24.293 15.265 -8.943 1.00 0.00 N ATOM 2780 CA ARG B 76 23.049 14.628 -9.344 1.00 0.00 C ATOM 2781 C ARG B 76 22.498 13.732 -8.247 1.00 0.00 C ATOM 2782 O ARG B 76 23.233 12.979 -7.606 1.00 0.00 O ATOM 2783 CB ARG B 76 23.251 13.804 -10.611 1.00 0.00 C ATOM 2784 CG ARG B 76 23.744 14.608 -11.799 1.00 0.00 C ATOM 2785 CD ARG B 76 23.712 13.771 -13.059 1.00 0.00 C ATOM 2786 NE ARG B 76 24.248 14.484 -14.213 1.00 0.00 N ATOM 2787 CZ ARG B 76 23.870 14.251 -15.468 1.00 0.00 C ATOM 2788 NH1 ARG B 76 22.926 13.353 -15.718 1.00 0.00 N ATOM 2789 NH2 ARG B 76 24.428 14.920 -16.468 1.00 0.00 N ATOM 0 H ARG B 76 25.122 14.681 -9.051 1.00 0.00 H new ATOM 0 HA ARG B 76 22.329 15.424 -9.536 1.00 0.00 H new ATOM 0 HB2 ARG B 76 23.965 13.007 -10.404 1.00 0.00 H new ATOM 0 HB3 ARG B 76 22.308 13.326 -10.875 1.00 0.00 H new ATOM 0 HG2 ARG B 76 23.122 15.494 -11.929 1.00 0.00 H new ATOM 0 HG3 ARG B 76 24.760 14.956 -11.613 1.00 0.00 H new ATOM 0 HD2 ARG B 76 24.286 12.858 -12.900 1.00 0.00 H new ATOM 0 HD3 ARG B 76 22.685 13.470 -13.266 1.00 0.00 H new ATOM 0 HE ARG B 76 24.953 15.203 -14.049 1.00 0.00 H new ATOM 0 HH11 ARG B 76 22.491 12.843 -14.949 1.00 0.00 H new ATOM 0 HH12 ARG B 76 22.635 13.173 -16.679 1.00 0.00 H new ATOM 0 HH21 ARG B 76 25.149 15.616 -16.277 1.00 0.00 H new ATOM 0 HH22 ARG B 76 24.136 14.739 -17.428 1.00 0.00 H new ATOM 2803 N GLN B 77 21.198 13.821 -8.042 1.00 0.00 N ATOM 2804 CA GLN B 77 20.509 12.946 -7.110 1.00 0.00 C ATOM 2805 C GLN B 77 19.749 11.879 -7.883 1.00 0.00 C ATOM 2806 O GLN B 77 18.769 12.180 -8.568 1.00 0.00 O ATOM 2807 CB GLN B 77 19.536 13.734 -6.231 1.00 0.00 C ATOM 2808 CG GLN B 77 20.200 14.801 -5.375 1.00 0.00 C ATOM 2809 CD GLN B 77 19.200 15.600 -4.560 1.00 0.00 C ATOM 2810 OE1 GLN B 77 18.100 14.969 -4.175 1.00 0.00 O flip ATOM 2811 NE2 GLN B 77 19.413 16.775 -4.279 1.00 0.00 N flip ATOM 0 H GLN B 77 20.593 14.495 -8.511 1.00 0.00 H new ATOM 0 HA GLN B 77 21.252 12.479 -6.464 1.00 0.00 H new ATOM 0 HB2 GLN B 77 18.789 14.207 -6.868 1.00 0.00 H new ATOM 0 HB3 GLN B 77 19.006 13.039 -5.580 1.00 0.00 H new ATOM 0 HG2 GLN B 77 20.916 14.329 -4.703 1.00 0.00 H new ATOM 0 HG3 GLN B 77 20.764 15.478 -6.017 1.00 0.00 H new ATOM 0 HE21 GLN B 77 20.272 17.227 -4.593 1.00 0.00 H new ATOM 0 HE22 GLN B 77 18.731 17.300 -3.731 1.00 0.00 H new ATOM 2820 N TYR B 78 20.220 10.650 -7.793 1.00 0.00 N ATOM 2821 CA TYR B 78 19.576 9.536 -8.469 1.00 0.00 C ATOM 2822 C TYR B 78 18.593 8.855 -7.531 1.00 0.00 C ATOM 2823 O TYR B 78 18.967 8.406 -6.449 1.00 0.00 O ATOM 2824 CB TYR B 78 20.614 8.514 -8.943 1.00 0.00 C ATOM 2825 CG TYR B 78 21.613 9.052 -9.945 1.00 0.00 C ATOM 2826 CD1 TYR B 78 21.321 9.075 -11.303 1.00 0.00 C ATOM 2827 CD2 TYR B 78 22.852 9.524 -9.533 1.00 0.00 C ATOM 2828 CE1 TYR B 78 22.238 9.553 -12.221 1.00 0.00 C ATOM 2829 CE2 TYR B 78 23.773 10.006 -10.445 1.00 0.00 C ATOM 2830 CZ TYR B 78 23.460 10.017 -11.787 1.00 0.00 C ATOM 2831 OH TYR B 78 24.374 10.496 -12.700 1.00 0.00 O ATOM 0 H TYR B 78 21.049 10.395 -7.257 1.00 0.00 H new ATOM 0 HA TYR B 78 19.044 9.927 -9.336 1.00 0.00 H new ATOM 0 HB2 TYR B 78 21.156 8.136 -8.076 1.00 0.00 H new ATOM 0 HB3 TYR B 78 20.093 7.666 -9.388 1.00 0.00 H new ATOM 0 HD1 TYR B 78 20.363 8.714 -11.647 1.00 0.00 H new ATOM 0 HD2 TYR B 78 23.101 9.515 -8.482 1.00 0.00 H new ATOM 0 HE1 TYR B 78 21.997 9.562 -13.274 1.00 0.00 H new ATOM 0 HE2 TYR B 78 24.732 10.372 -10.108 1.00 0.00 H new ATOM 0 HH TYR B 78 25.184 10.786 -12.231 1.00 0.00 H new ATOM 2841 N TYR B 79 17.338 8.789 -7.932 1.00 0.00 N ATOM 2842 CA TYR B 79 16.341 8.088 -7.148 1.00 0.00 C ATOM 2843 C TYR B 79 16.037 6.738 -7.770 1.00 0.00 C ATOM 2844 O TYR B 79 15.861 6.620 -8.985 1.00 0.00 O ATOM 2845 CB TYR B 79 15.063 8.916 -7.001 1.00 0.00 C ATOM 2846 CG TYR B 79 15.119 9.921 -5.869 1.00 0.00 C ATOM 2847 CD1 TYR B 79 15.706 11.168 -6.043 1.00 0.00 C ATOM 2848 CD2 TYR B 79 14.584 9.618 -4.621 1.00 0.00 C ATOM 2849 CE1 TYR B 79 15.759 12.082 -5.008 1.00 0.00 C ATOM 2850 CE2 TYR B 79 14.634 10.527 -3.581 1.00 0.00 C ATOM 2851 CZ TYR B 79 15.222 11.757 -3.782 1.00 0.00 C ATOM 2852 OH TYR B 79 15.275 12.668 -2.751 1.00 0.00 O ATOM 0 H TYR B 79 16.986 9.210 -8.792 1.00 0.00 H new ATOM 0 HA TYR B 79 16.747 7.930 -6.149 1.00 0.00 H new ATOM 0 HB2 TYR B 79 14.872 9.444 -7.935 1.00 0.00 H new ATOM 0 HB3 TYR B 79 14.221 8.243 -6.837 1.00 0.00 H new ATOM 0 HD1 TYR B 79 16.128 11.427 -7.003 1.00 0.00 H new ATOM 0 HD2 TYR B 79 14.121 8.655 -4.462 1.00 0.00 H new ATOM 0 HE1 TYR B 79 16.220 13.047 -5.160 1.00 0.00 H new ATOM 0 HE2 TYR B 79 14.215 10.275 -2.618 1.00 0.00 H new ATOM 0 HH TYR B 79 14.852 12.285 -1.954 1.00 0.00 H new ATOM 2862 N ARG B 80 16.006 5.722 -6.932 1.00 0.00 N ATOM 2863 CA ARG B 80 15.725 4.369 -7.369 1.00 0.00 C ATOM 2864 C ARG B 80 15.072 3.620 -6.217 1.00 0.00 C ATOM 2865 O ARG B 80 15.236 4.012 -5.059 1.00 0.00 O ATOM 2866 CB ARG B 80 17.031 3.686 -7.812 1.00 0.00 C ATOM 2867 CG ARG B 80 16.864 2.640 -8.911 1.00 0.00 C ATOM 2868 CD ARG B 80 16.488 1.272 -8.365 1.00 0.00 C ATOM 2869 NE ARG B 80 17.506 0.738 -7.465 1.00 0.00 N ATOM 2870 CZ ARG B 80 18.000 -0.500 -7.539 1.00 0.00 C ATOM 2871 NH1 ARG B 80 17.599 -1.331 -8.494 1.00 0.00 N ATOM 2872 NH2 ARG B 80 18.902 -0.898 -6.652 1.00 0.00 N ATOM 0 H ARG B 80 16.175 5.810 -5.930 1.00 0.00 H new ATOM 0 HA ARG B 80 15.046 4.372 -8.222 1.00 0.00 H new ATOM 0 HB2 ARG B 80 17.725 4.451 -8.160 1.00 0.00 H new ATOM 0 HB3 ARG B 80 17.489 3.211 -6.944 1.00 0.00 H new ATOM 0 HG2 ARG B 80 16.096 2.972 -9.609 1.00 0.00 H new ATOM 0 HG3 ARG B 80 17.794 2.559 -9.475 1.00 0.00 H new ATOM 0 HD2 ARG B 80 15.538 1.343 -7.835 1.00 0.00 H new ATOM 0 HD3 ARG B 80 16.340 0.580 -9.194 1.00 0.00 H new ATOM 0 HE ARG B 80 17.863 1.351 -6.732 1.00 0.00 H new ATOM 0 HH11 ARG B 80 16.908 -1.025 -9.179 1.00 0.00 H new ATOM 0 HH12 ARG B 80 17.982 -2.275 -8.543 1.00 0.00 H new ATOM 0 HH21 ARG B 80 19.214 -0.260 -5.920 1.00 0.00 H new ATOM 0 HH22 ARG B 80 19.284 -1.842 -6.702 1.00 0.00 H new ATOM 2886 N ILE B 81 14.315 2.576 -6.533 1.00 0.00 N ATOM 2887 CA ILE B 81 13.627 1.781 -5.518 1.00 0.00 C ATOM 2888 C ILE B 81 14.603 1.346 -4.419 1.00 0.00 C ATOM 2889 O ILE B 81 15.671 0.800 -4.704 1.00 0.00 O ATOM 2890 CB ILE B 81 12.959 0.537 -6.146 1.00 0.00 C ATOM 2891 CG1 ILE B 81 12.109 0.934 -7.361 1.00 0.00 C ATOM 2892 CG2 ILE B 81 12.102 -0.176 -5.116 1.00 0.00 C ATOM 2893 CD1 ILE B 81 10.977 1.893 -7.039 1.00 0.00 C ATOM 0 H ILE B 81 14.160 2.257 -7.490 1.00 0.00 H new ATOM 0 HA ILE B 81 12.851 2.407 -5.077 1.00 0.00 H new ATOM 0 HB ILE B 81 13.743 -0.142 -6.481 1.00 0.00 H new ATOM 0 HG12 ILE B 81 12.756 1.391 -8.110 1.00 0.00 H new ATOM 0 HG13 ILE B 81 11.691 0.032 -7.809 1.00 0.00 H new ATOM 0 HG21 ILE B 81 11.637 -1.050 -5.572 1.00 0.00 H new ATOM 0 HG22 ILE B 81 12.725 -0.491 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE B 81 11.327 0.501 -4.756 1.00 0.00 H new ATOM 0 HD11 ILE B 81 10.425 2.124 -7.950 1.00 0.00 H new ATOM 0 HD12 ILE B 81 10.305 1.433 -6.315 1.00 0.00 H new ATOM 0 HD13 ILE B 81 11.387 2.812 -6.621 1.00 0.00 H new ATOM 2905 N ALA B 82 14.233 1.612 -3.167 1.00 0.00 N ATOM 2906 CA ALA B 82 15.113 1.376 -2.023 1.00 0.00 C ATOM 2907 C ALA B 82 15.426 -0.107 -1.855 1.00 0.00 C ATOM 2908 O ALA B 82 16.551 -0.480 -1.514 1.00 0.00 O ATOM 2909 CB ALA B 82 14.488 1.937 -0.753 1.00 0.00 C ATOM 0 H ALA B 82 13.321 1.995 -2.918 1.00 0.00 H new ATOM 0 HA ALA B 82 16.054 1.892 -2.212 1.00 0.00 H new ATOM 0 HB1 ALA B 82 15.153 1.755 0.091 1.00 0.00 H new ATOM 0 HB2 ALA B 82 14.332 3.010 -0.867 1.00 0.00 H new ATOM 0 HB3 ALA B 82 13.530 1.449 -0.572 1.00 0.00 H new ATOM 2915 N GLY B 83 14.430 -0.945 -2.103 1.00 0.00 N ATOM 2916 CA GLY B 83 14.612 -2.378 -2.004 1.00 0.00 C ATOM 2917 C GLY B 83 13.817 -3.107 -3.063 1.00 0.00 C ATOM 2918 O GLY B 83 12.737 -2.654 -3.448 1.00 0.00 O ATOM 0 H GLY B 83 13.491 -0.654 -2.374 1.00 0.00 H new ATOM 0 HA2 GLY B 83 15.669 -2.621 -2.109 1.00 0.00 H new ATOM 0 HA3 GLY B 83 14.303 -2.719 -1.016 1.00 0.00 H new ATOM 2922 N GLU B 84 14.330 -4.234 -3.531 1.00 0.00 N ATOM 2923 CA GLU B 84 13.673 -4.973 -4.601 1.00 0.00 C ATOM 2924 C GLU B 84 12.301 -5.452 -4.148 1.00 0.00 C ATOM 2925 O GLU B 84 11.365 -5.507 -4.941 1.00 0.00 O ATOM 2926 CB GLU B 84 14.525 -6.158 -5.052 1.00 0.00 C ATOM 2927 CG GLU B 84 13.939 -6.901 -6.243 1.00 0.00 C ATOM 2928 CD GLU B 84 14.843 -7.999 -6.751 1.00 0.00 C ATOM 2929 OE1 GLU B 84 15.813 -7.686 -7.470 1.00 0.00 O ATOM 2930 OE2 GLU B 84 14.593 -9.176 -6.428 1.00 0.00 O ATOM 0 H GLU B 84 15.194 -4.656 -3.190 1.00 0.00 H new ATOM 0 HA GLU B 84 13.549 -4.301 -5.450 1.00 0.00 H new ATOM 0 HB2 GLU B 84 15.523 -5.802 -5.309 1.00 0.00 H new ATOM 0 HB3 GLU B 84 14.639 -6.852 -4.220 1.00 0.00 H new ATOM 0 HG2 GLU B 84 12.978 -7.330 -5.960 1.00 0.00 H new ATOM 0 HG3 GLU B 84 13.747 -6.192 -7.049 1.00 0.00 H new ATOM 2937 N ASP B 85 12.185 -5.772 -2.866 1.00 0.00 N ATOM 2938 CA ASP B 85 10.916 -6.210 -2.290 1.00 0.00 C ATOM 2939 C ASP B 85 9.868 -5.109 -2.392 1.00 0.00 C ATOM 2940 O ASP B 85 8.680 -5.385 -2.549 1.00 0.00 O ATOM 2941 CB ASP B 85 11.108 -6.626 -0.832 1.00 0.00 C ATOM 2942 CG ASP B 85 12.073 -7.785 -0.698 1.00 0.00 C ATOM 2943 OD1 ASP B 85 13.298 -7.536 -0.663 1.00 0.00 O ATOM 2944 OD2 ASP B 85 11.613 -8.944 -0.650 1.00 0.00 O ATOM 0 H ASP B 85 12.957 -5.737 -2.201 1.00 0.00 H new ATOM 0 HA ASP B 85 10.564 -7.072 -2.856 1.00 0.00 H new ATOM 0 HB2 ASP B 85 11.479 -5.777 -0.258 1.00 0.00 H new ATOM 0 HB3 ASP B 85 10.145 -6.904 -0.404 1.00 0.00 H new ATOM 2949 N VAL B 86 10.318 -3.858 -2.321 1.00 0.00 N ATOM 2950 CA VAL B 86 9.431 -2.715 -2.510 1.00 0.00 C ATOM 2951 C VAL B 86 8.918 -2.692 -3.945 1.00 0.00 C ATOM 2952 O VAL B 86 7.732 -2.466 -4.195 1.00 0.00 O ATOM 2953 CB VAL B 86 10.146 -1.381 -2.211 1.00 0.00 C ATOM 2954 CG1 VAL B 86 9.201 -0.207 -2.413 1.00 0.00 C ATOM 2955 CG2 VAL B 86 10.712 -1.378 -0.799 1.00 0.00 C ATOM 0 H VAL B 86 11.290 -3.612 -2.134 1.00 0.00 H new ATOM 0 HA VAL B 86 8.601 -2.824 -1.812 1.00 0.00 H new ATOM 0 HB VAL B 86 10.975 -1.276 -2.911 1.00 0.00 H new ATOM 0 HG11 VAL B 86 9.726 0.724 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL B 86 8.851 -0.195 -3.445 1.00 0.00 H new ATOM 0 HG13 VAL B 86 8.348 -0.307 -1.742 1.00 0.00 H new ATOM 0 HG21 VAL B 86 11.212 -0.428 -0.609 1.00 0.00 H new ATOM 0 HG22 VAL B 86 9.902 -1.511 -0.082 1.00 0.00 H new ATOM 0 HG23 VAL B 86 11.428 -2.193 -0.692 1.00 0.00 H new ATOM 2965 N ALA B 87 9.823 -2.945 -4.886 1.00 0.00 N ATOM 2966 CA ALA B 87 9.460 -3.024 -6.295 1.00 0.00 C ATOM 2967 C ALA B 87 8.505 -4.191 -6.532 1.00 0.00 C ATOM 2968 O ALA B 87 7.562 -4.085 -7.318 1.00 0.00 O ATOM 2969 CB ALA B 87 10.703 -3.166 -7.160 1.00 0.00 C ATOM 0 H ALA B 87 10.813 -3.099 -4.697 1.00 0.00 H new ATOM 0 HA ALA B 87 8.953 -2.100 -6.574 1.00 0.00 H new ATOM 0 HB1 ALA B 87 10.412 -3.223 -8.209 1.00 0.00 H new ATOM 0 HB2 ALA B 87 11.351 -2.303 -7.010 1.00 0.00 H new ATOM 0 HB3 ALA B 87 11.238 -4.074 -6.882 1.00 0.00 H new ATOM 2975 N ARG B 88 8.751 -5.297 -5.834 1.00 0.00 N ATOM 2976 CA ARG B 88 7.880 -6.469 -5.904 1.00 0.00 C ATOM 2977 C ARG B 88 6.481 -6.112 -5.422 1.00 0.00 C ATOM 2978 O ARG B 88 5.489 -6.555 -5.987 1.00 0.00 O ATOM 2979 CB ARG B 88 8.436 -7.616 -5.052 1.00 0.00 C ATOM 2980 CG ARG B 88 9.826 -8.072 -5.461 1.00 0.00 C ATOM 2981 CD ARG B 88 10.389 -9.086 -4.477 1.00 0.00 C ATOM 2982 NE ARG B 88 11.778 -9.432 -4.768 1.00 0.00 N ATOM 2983 CZ ARG B 88 12.481 -10.314 -4.060 1.00 0.00 C ATOM 2984 NH1 ARG B 88 11.937 -10.908 -3.011 1.00 0.00 N ATOM 2985 NH2 ARG B 88 13.734 -10.588 -4.394 1.00 0.00 N ATOM 0 H ARG B 88 9.550 -5.407 -5.210 1.00 0.00 H new ATOM 0 HA ARG B 88 7.836 -6.794 -6.943 1.00 0.00 H new ATOM 0 HB2 ARG B 88 8.460 -7.301 -4.009 1.00 0.00 H new ATOM 0 HB3 ARG B 88 7.754 -8.464 -5.113 1.00 0.00 H new ATOM 0 HG2 ARG B 88 9.788 -8.512 -6.457 1.00 0.00 H new ATOM 0 HG3 ARG B 88 10.491 -7.210 -5.518 1.00 0.00 H new ATOM 0 HD2 ARG B 88 10.322 -8.684 -3.466 1.00 0.00 H new ATOM 0 HD3 ARG B 88 9.780 -9.989 -4.502 1.00 0.00 H new ATOM 0 HE ARG B 88 12.234 -8.973 -5.556 1.00 0.00 H new ATOM 0 HH11 ARG B 88 10.977 -10.691 -2.743 1.00 0.00 H new ATOM 0 HH12 ARG B 88 12.477 -11.583 -2.470 1.00 0.00 H new ATOM 0 HH21 ARG B 88 14.162 -10.123 -5.195 1.00 0.00 H new ATOM 0 HH22 ARG B 88 14.271 -11.264 -3.850 1.00 0.00 H new ATOM 2999 N LEU B 89 6.418 -5.303 -4.370 1.00 0.00 N ATOM 3000 CA LEU B 89 5.148 -4.852 -3.817 1.00 0.00 C ATOM 3001 C LEU B 89 4.386 -4.003 -4.836 1.00 0.00 C ATOM 3002 O LEU B 89 3.194 -4.214 -5.065 1.00 0.00 O ATOM 3003 CB LEU B 89 5.384 -4.047 -2.535 1.00 0.00 C ATOM 3004 CG LEU B 89 4.119 -3.553 -1.833 1.00 0.00 C ATOM 3005 CD1 LEU B 89 3.305 -4.722 -1.302 1.00 0.00 C ATOM 3006 CD2 LEU B 89 4.472 -2.592 -0.711 1.00 0.00 C ATOM 0 H LEU B 89 7.238 -4.945 -3.881 1.00 0.00 H new ATOM 0 HA LEU B 89 4.547 -5.730 -3.579 1.00 0.00 H new ATOM 0 HB2 LEU B 89 5.950 -4.664 -1.837 1.00 0.00 H new ATOM 0 HB3 LEU B 89 6.006 -3.185 -2.776 1.00 0.00 H new ATOM 0 HG LEU B 89 3.510 -3.020 -2.563 1.00 0.00 H new ATOM 0 HD11 LEU B 89 2.410 -4.347 -0.806 1.00 0.00 H new ATOM 0 HD12 LEU B 89 3.017 -5.370 -2.129 1.00 0.00 H new ATOM 0 HD13 LEU B 89 3.904 -5.288 -0.589 1.00 0.00 H new ATOM 0 HD21 LEU B 89 3.559 -2.251 -0.223 1.00 0.00 H new ATOM 0 HD22 LEU B 89 5.105 -3.099 0.017 1.00 0.00 H new ATOM 0 HD23 LEU B 89 5.006 -1.735 -1.121 1.00 0.00 H new ATOM 3018 N PHE B 90 5.085 -3.053 -5.453 1.00 0.00 N ATOM 3019 CA PHE B 90 4.477 -2.189 -6.460 1.00 0.00 C ATOM 3020 C PHE B 90 4.047 -3.004 -7.678 1.00 0.00 C ATOM 3021 O PHE B 90 2.994 -2.755 -8.261 1.00 0.00 O ATOM 3022 CB PHE B 90 5.447 -1.076 -6.878 1.00 0.00 C ATOM 3023 CG PHE B 90 4.878 -0.134 -7.905 1.00 0.00 C ATOM 3024 CD1 PHE B 90 3.960 0.840 -7.543 1.00 0.00 C ATOM 3025 CD2 PHE B 90 5.255 -0.232 -9.236 1.00 0.00 C ATOM 3026 CE1 PHE B 90 3.432 1.699 -8.488 1.00 0.00 C ATOM 3027 CE2 PHE B 90 4.729 0.624 -10.183 1.00 0.00 C ATOM 3028 CZ PHE B 90 3.817 1.590 -9.809 1.00 0.00 C ATOM 0 H PHE B 90 6.071 -2.863 -5.273 1.00 0.00 H new ATOM 0 HA PHE B 90 3.592 -1.727 -6.022 1.00 0.00 H new ATOM 0 HB2 PHE B 90 5.735 -0.506 -5.995 1.00 0.00 H new ATOM 0 HB3 PHE B 90 6.356 -1.528 -7.276 1.00 0.00 H new ATOM 0 HD1 PHE B 90 3.654 0.928 -6.511 1.00 0.00 H new ATOM 0 HD2 PHE B 90 5.968 -0.986 -9.535 1.00 0.00 H new ATOM 0 HE1 PHE B 90 2.719 2.455 -8.193 1.00 0.00 H new ATOM 0 HE2 PHE B 90 5.031 0.538 -11.216 1.00 0.00 H new ATOM 0 HZ PHE B 90 3.405 2.260 -10.549 1.00 0.00 H new ATOM 3038 N ALA B 91 4.860 -3.983 -8.051 1.00 0.00 N ATOM 3039 CA ALA B 91 4.531 -4.866 -9.160 1.00 0.00 C ATOM 3040 C ALA B 91 3.325 -5.728 -8.809 1.00 0.00 C ATOM 3041 O ALA B 91 2.444 -5.950 -9.637 1.00 0.00 O ATOM 3042 CB ALA B 91 5.728 -5.734 -9.519 1.00 0.00 C ATOM 0 H ALA B 91 5.753 -4.185 -7.601 1.00 0.00 H new ATOM 0 HA ALA B 91 4.277 -4.258 -10.028 1.00 0.00 H new ATOM 0 HB1 ALA B 91 5.466 -6.389 -10.350 1.00 0.00 H new ATOM 0 HB2 ALA B 91 6.565 -5.098 -9.808 1.00 0.00 H new ATOM 0 HB3 ALA B 91 6.011 -6.338 -8.657 1.00 0.00 H new ATOM 3048 N LEU B 92 3.284 -6.190 -7.565 1.00 0.00 N ATOM 3049 CA LEU B 92 2.181 -7.008 -7.087 1.00 0.00 C ATOM 3050 C LEU B 92 0.877 -6.222 -7.127 1.00 0.00 C ATOM 3051 O LEU B 92 -0.097 -6.663 -7.733 1.00 0.00 O ATOM 3052 CB LEU B 92 2.459 -7.501 -5.664 1.00 0.00 C ATOM 3053 CG LEU B 92 1.404 -8.442 -5.071 1.00 0.00 C ATOM 3054 CD1 LEU B 92 1.271 -9.706 -5.907 1.00 0.00 C ATOM 3055 CD2 LEU B 92 1.755 -8.789 -3.634 1.00 0.00 C ATOM 0 H LEU B 92 4.006 -6.010 -6.868 1.00 0.00 H new ATOM 0 HA LEU B 92 2.085 -7.873 -7.743 1.00 0.00 H new ATOM 0 HB2 LEU B 92 3.421 -8.013 -5.658 1.00 0.00 H new ATOM 0 HB3 LEU B 92 2.555 -6.634 -5.011 1.00 0.00 H new ATOM 0 HG LEU B 92 0.443 -7.927 -5.082 1.00 0.00 H new ATOM 0 HD11 LEU B 92 0.516 -10.357 -5.465 1.00 0.00 H new ATOM 0 HD12 LEU B 92 0.973 -9.442 -6.922 1.00 0.00 H new ATOM 0 HD13 LEU B 92 2.228 -10.227 -5.934 1.00 0.00 H new ATOM 0 HD21 LEU B 92 0.997 -9.458 -3.226 1.00 0.00 H new ATOM 0 HD22 LEU B 92 2.727 -9.282 -3.606 1.00 0.00 H new ATOM 0 HD23 LEU B 92 1.793 -7.877 -3.038 1.00 0.00 H new ATOM 3067 N VAL B 93 0.869 -5.044 -6.506 1.00 0.00 N ATOM 3068 CA VAL B 93 -0.332 -4.213 -6.466 1.00 0.00 C ATOM 3069 C VAL B 93 -0.718 -3.744 -7.874 1.00 0.00 C ATOM 3070 O VAL B 93 -1.891 -3.496 -8.159 1.00 0.00 O ATOM 3071 CB VAL B 93 -0.162 -3.000 -5.514 1.00 0.00 C ATOM 3072 CG1 VAL B 93 0.879 -2.019 -6.032 1.00 0.00 C ATOM 3073 CG2 VAL B 93 -1.492 -2.298 -5.286 1.00 0.00 C ATOM 0 H VAL B 93 1.676 -4.645 -6.026 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.140 -4.830 -6.072 1.00 0.00 H new ATOM 0 HB VAL B 93 0.194 -3.385 -4.559 1.00 0.00 H new ATOM 0 HG11 VAL B 93 0.969 -1.184 -5.338 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.842 -2.523 -6.120 1.00 0.00 H new ATOM 0 HG13 VAL B 93 0.573 -1.647 -7.010 1.00 0.00 H new ATOM 0 HG21 VAL B 93 -1.346 -1.451 -4.615 1.00 0.00 H new ATOM 0 HG22 VAL B 93 -1.884 -1.943 -6.239 1.00 0.00 H new ATOM 0 HG23 VAL B 93 -2.200 -2.996 -4.840 1.00 0.00 H new ATOM 3083 N GLN B 94 0.274 -3.649 -8.754 1.00 0.00 N ATOM 3084 CA GLN B 94 0.036 -3.333 -10.158 1.00 0.00 C ATOM 3085 C GLN B 94 -0.839 -4.414 -10.791 1.00 0.00 C ATOM 3086 O GLN B 94 -1.820 -4.118 -11.477 1.00 0.00 O ATOM 3087 CB GLN B 94 1.371 -3.233 -10.902 1.00 0.00 C ATOM 3088 CG GLN B 94 1.241 -2.888 -12.375 1.00 0.00 C ATOM 3089 CD GLN B 94 2.572 -2.935 -13.103 1.00 0.00 C ATOM 3090 OE1 GLN B 94 3.654 -2.644 -12.396 1.00 0.00 O flip ATOM 3091 NE2 GLN B 94 2.629 -3.229 -14.295 1.00 0.00 N flip ATOM 0 H GLN B 94 1.256 -3.787 -8.517 1.00 0.00 H new ATOM 0 HA GLN B 94 -0.479 -2.375 -10.228 1.00 0.00 H new ATOM 0 HB2 GLN B 94 1.988 -2.477 -10.417 1.00 0.00 H new ATOM 0 HB3 GLN B 94 1.898 -4.183 -10.808 1.00 0.00 H new ATOM 0 HG2 GLN B 94 0.547 -3.583 -12.848 1.00 0.00 H new ATOM 0 HG3 GLN B 94 0.811 -1.891 -12.475 1.00 0.00 H new ATOM 0 HE21 GLN B 94 1.775 -3.447 -14.808 1.00 0.00 H new ATOM 0 HE22 GLN B 94 3.531 -3.255 -14.771 1.00 0.00 H new ATOM 3100 N VAL B 95 -0.482 -5.669 -10.539 1.00 0.00 N ATOM 3101 CA VAL B 95 -1.250 -6.802 -11.034 1.00 0.00 C ATOM 3102 C VAL B 95 -2.602 -6.873 -10.330 1.00 0.00 C ATOM 3103 O VAL B 95 -3.633 -7.091 -10.968 1.00 0.00 O ATOM 3104 CB VAL B 95 -0.489 -8.133 -10.833 1.00 0.00 C ATOM 3105 CG1 VAL B 95 -1.283 -9.307 -11.389 1.00 0.00 C ATOM 3106 CG2 VAL B 95 0.886 -8.067 -11.482 1.00 0.00 C ATOM 0 H VAL B 95 0.339 -5.926 -9.992 1.00 0.00 H new ATOM 0 HA VAL B 95 -1.404 -6.654 -12.103 1.00 0.00 H new ATOM 0 HB VAL B 95 -0.361 -8.288 -9.762 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -0.724 -10.230 -11.234 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -2.242 -9.373 -10.876 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -1.452 -9.160 -12.456 1.00 0.00 H new ATOM 0 HG21 VAL B 95 1.406 -9.013 -11.330 1.00 0.00 H new ATOM 0 HG22 VAL B 95 0.776 -7.882 -12.550 1.00 0.00 H new ATOM 0 HG23 VAL B 95 1.463 -7.259 -11.031 1.00 0.00 H new ATOM 3116 N VAL B 96 -2.588 -6.651 -9.015 1.00 0.00 N ATOM 3117 CA VAL B 96 -3.809 -6.670 -8.203 1.00 0.00 C ATOM 3118 C VAL B 96 -4.787 -5.582 -8.659 1.00 0.00 C ATOM 3119 O VAL B 96 -5.965 -5.597 -8.315 1.00 0.00 O ATOM 3120 CB VAL B 96 -3.482 -6.501 -6.695 1.00 0.00 C ATOM 3121 CG1 VAL B 96 -4.743 -6.474 -5.839 1.00 0.00 C ATOM 3122 CG2 VAL B 96 -2.560 -7.616 -6.224 1.00 0.00 C ATOM 0 H VAL B 96 -1.739 -6.454 -8.485 1.00 0.00 H new ATOM 0 HA VAL B 96 -4.282 -7.642 -8.343 1.00 0.00 H new ATOM 0 HB VAL B 96 -2.979 -5.541 -6.578 1.00 0.00 H new ATOM 0 HG11 VAL B 96 -4.469 -6.354 -4.791 1.00 0.00 H new ATOM 0 HG12 VAL B 96 -5.374 -5.640 -6.147 1.00 0.00 H new ATOM 0 HG13 VAL B 96 -5.289 -7.408 -5.967 1.00 0.00 H new ATOM 0 HG21 VAL B 96 -2.340 -7.483 -5.165 1.00 0.00 H new ATOM 0 HG22 VAL B 96 -3.047 -8.579 -6.376 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -1.631 -7.585 -6.794 1.00 0.00 H new ATOM 3132 N ALA B 97 -4.302 -4.631 -9.435 1.00 0.00 N ATOM 3133 CA ALA B 97 -5.179 -3.644 -10.031 1.00 0.00 C ATOM 3134 C ALA B 97 -5.757 -4.159 -11.345 1.00 0.00 C ATOM 3135 O ALA B 97 -6.970 -4.262 -11.500 1.00 0.00 O ATOM 3136 CB ALA B 97 -4.446 -2.331 -10.249 1.00 0.00 C ATOM 0 H ALA B 97 -3.314 -4.522 -9.665 1.00 0.00 H new ATOM 0 HA ALA B 97 -6.003 -3.464 -9.341 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -5.125 -1.605 -10.697 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -4.089 -1.951 -9.292 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -3.598 -2.494 -10.914 1.00 0.00 H new ATOM 3142 N ASP B 98 -4.879 -4.525 -12.269 1.00 0.00 N ATOM 3143 CA ASP B 98 -5.288 -4.840 -13.637 1.00 0.00 C ATOM 3144 C ASP B 98 -6.133 -6.113 -13.731 1.00 0.00 C ATOM 3145 O ASP B 98 -7.152 -6.130 -14.421 1.00 0.00 O ATOM 3146 CB ASP B 98 -4.062 -4.969 -14.544 1.00 0.00 C ATOM 3147 CG ASP B 98 -4.438 -5.200 -15.998 1.00 0.00 C ATOM 3148 OD1 ASP B 98 -4.977 -4.270 -16.635 1.00 0.00 O ATOM 3149 OD2 ASP B 98 -4.179 -6.309 -16.518 1.00 0.00 O ATOM 0 H ASP B 98 -3.877 -4.612 -12.099 1.00 0.00 H new ATOM 0 HA ASP B 98 -5.913 -4.012 -13.970 1.00 0.00 H new ATOM 0 HB2 ASP B 98 -3.460 -4.064 -14.467 1.00 0.00 H new ATOM 0 HB3 ASP B 98 -3.442 -5.795 -14.196 1.00 0.00 H new ATOM 3154 N GLU B 99 -5.729 -7.176 -13.043 1.00 0.00 N ATOM 3155 CA GLU B 99 -6.394 -8.466 -13.221 1.00 0.00 C ATOM 3156 C GLU B 99 -7.531 -8.665 -12.220 1.00 0.00 C ATOM 3157 O GLU B 99 -8.364 -9.554 -12.390 1.00 0.00 O ATOM 3158 CB GLU B 99 -5.376 -9.618 -13.143 1.00 0.00 C ATOM 3159 CG GLU B 99 -4.738 -9.834 -11.774 1.00 0.00 C ATOM 3160 CD GLU B 99 -5.514 -10.807 -10.907 1.00 0.00 C ATOM 3161 OE1 GLU B 99 -5.477 -12.024 -11.196 1.00 0.00 O ATOM 3162 OE2 GLU B 99 -6.163 -10.365 -9.939 1.00 0.00 O ATOM 0 H GLU B 99 -4.962 -7.175 -12.371 1.00 0.00 H new ATOM 0 HA GLU B 99 -6.841 -8.470 -14.215 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -5.873 -10.541 -13.443 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -4.585 -9.431 -13.869 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -3.722 -10.205 -11.907 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -4.663 -8.876 -11.259 1.00 0.00 H new ATOM 3169 N HIS B 100 -7.580 -7.829 -11.192 1.00 0.00 N ATOM 3170 CA HIS B 100 -8.591 -7.971 -10.147 1.00 0.00 C ATOM 3171 C HIS B 100 -9.867 -7.232 -10.536 1.00 0.00 C ATOM 3172 O HIS B 100 -10.943 -7.500 -10.000 1.00 0.00 O ATOM 3173 CB HIS B 100 -8.050 -7.443 -8.819 1.00 0.00 C ATOM 3174 CG HIS B 100 -8.769 -7.944 -7.603 1.00 0.00 C ATOM 3175 ND1 HIS B 100 -9.511 -7.130 -6.776 1.00 0.00 N ATOM 3176 CD2 HIS B 100 -8.814 -9.178 -7.050 1.00 0.00 C ATOM 3177 CE1 HIS B 100 -9.979 -7.841 -5.766 1.00 0.00 C ATOM 3178 NE2 HIS B 100 -9.572 -9.090 -5.906 1.00 0.00 N ATOM 0 H HIS B 100 -6.937 -7.049 -11.057 1.00 0.00 H new ATOM 0 HA HIS B 100 -8.830 -9.028 -10.031 1.00 0.00 H new ATOM 0 HB2 HIS B 100 -6.997 -7.714 -8.738 1.00 0.00 H new ATOM 0 HB3 HIS B 100 -8.099 -6.354 -8.830 1.00 0.00 H new ATOM 0 HD2 HIS B 100 -8.341 -10.069 -7.436 1.00 0.00 H new ATOM 0 HE1 HIS B 100 -10.592 -7.464 -4.960 1.00 0.00 H new ATOM 0 HE2 HIS B 100 -9.784 -9.860 -5.272 1.00 0.00 H new