USER MOD reduce.3.24.130724 H: found=0, std=0, add=933, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 935 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 NoAdj-H: A 83 HIS HE2 : A 83 HIS NE2 : A1159 ZNZN :(H bumps) USER MOD NoAdj-H: A 86 HIS HE2 : A 86 HIS NE2 : A1159 ZNZN :(H bumps) USER MOD NoAdj-H: A 88 HIS HD1 : A 88 HIS ND1 : A1159 ZNZN :(H bumps) USER MOD Set 1.1: A 60 SER OG : rot 180:sc=-0.00916 USER MOD Set 1.2: A 69 GLN : amide:sc= 1.02 K(o=0.85,f=-1.3) USER MOD Set 1.3: A 90 TYR OH : rot -50:sc= -0.163 USER MOD Set 2.1: A 75 THR OG1 : rot -154:sc= 0.574 USER MOD Set 2.2: A 77 GLN : amide:sc= -3.27! K(o=-1.2!,f=1.4) USER MOD Set 2.3: A 89 TYR OH : rot -145:sc= 1.55 USER MOD Single : A 40 SER OG : rot -35:sc= 0.49 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.0072) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.143 X(o=-0.14,f=-0.13) USER MOD Single : A 55 THR OG1 : rot 134:sc= 0.187 USER MOD Single : A 61 LYS NZ :NH3+ -161:sc= 1.27 (180deg=1.23) USER MOD Single : A 66 ASN : amide:sc= -0.915 K(o=-0.92,f=-0.076) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot -43:sc= 0.685 USER MOD Single : A 81 THR OG1 : rot -98:sc= 0.531 USER MOD Single : A 82 SER OG : rot 74:sc= -3.06! USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= 0.221 X(o=0.22,f=-0.27) USER MOD Single : A 93 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0634) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.00113 USER MOD Single : A 106 MET CE :methyl -139:sc= -0.223 (180deg=-2.18!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.0673 X(o=-0.067,f=-0.056) USER MOD Single : A 111 TYR OH : rot 15:sc= 0.332 USER MOD Single : A 112 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 114 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0599) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -1.18 X(o=-1.2,f=-0.82) USER MOD Single : A 123 LYS NZ :NH3+ 165:sc= 1.29 (180deg=1.12) USER MOD Single : A 126 TYR OH : rot -38:sc= 0.481 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 173:sc= 1.23 (180deg=1.14) USER MOD Single : A 134 TYR OH : rot -16:sc= -2.39! USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 165:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0373) USER MOD Single : A 143 HIS : no HE2:sc= 1 K(o=1,f=-5.7!) USER MOD Single : A 146 ASN : amide:sc= -1.46 K(o=-1.5,f=-0.85) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.0585 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ -160:sc= -0.109 (180deg=-0.585) USER MOD Single : A 156 GLN : amide:sc=-0.00154 X(o=-0.0015,f=-0.0015) USER MOD Single : A 157 LYS NZ :NH3+ -161:sc= 1.93 (180deg=1.47) USER MOD Single : A 158 GLN : amide:sc= -1.29 X(o=-1.3,f=-0.87) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 40 -0.720 -11.867 6.712 1.00 13.12 N ATOM 2 CA SER A 40 -0.794 -12.756 5.536 1.00 12.82 C ATOM 3 C SER A 40 -2.227 -13.210 5.283 1.00 12.18 C ATOM 4 O SER A 40 -2.898 -12.721 4.371 1.00 11.93 O ATOM 5 CB SER A 40 0.126 -13.965 5.741 1.00 13.03 C ATOM 6 OG SER A 40 -0.122 -14.592 6.991 1.00 13.46 O ATOM 0 HA SER A 40 -0.462 -12.201 4.659 1.00 12.82 H new ATOM 0 HB2 SER A 40 -0.026 -14.682 4.935 1.00 13.03 H new ATOM 0 HB3 SER A 40 1.167 -13.646 5.691 1.00 13.03 H new ATOM 0 HG SER A 40 -0.353 -13.912 7.658 1.00 13.46 H new ATOM 13 N TYR A 41 -2.684 -14.136 6.105 1.00 12.10 N ATOM 14 CA TYR A 41 -4.017 -14.704 5.984 1.00 11.74 C ATOM 15 C TYR A 41 -4.465 -15.267 7.327 1.00 11.26 C ATOM 16 O TYR A 41 -3.657 -15.420 8.243 1.00 11.61 O ATOM 17 CB TYR A 41 -4.034 -15.799 4.909 1.00 12.43 C ATOM 18 CG TYR A 41 -2.833 -16.724 4.946 1.00 13.20 C ATOM 19 CD1 TYR A 41 -2.663 -17.618 5.994 1.00 13.72 C ATOM 20 CD2 TYR A 41 -1.878 -16.706 3.939 1.00 13.55 C ATOM 21 CE1 TYR A 41 -1.575 -18.466 6.039 1.00 14.56 C ATOM 22 CE2 TYR A 41 -0.787 -17.552 3.975 1.00 14.41 C ATOM 23 CZ TYR A 41 -0.623 -18.409 5.000 1.00 14.90 C ATOM 24 OH TYR A 41 0.447 -19.273 5.065 1.00 15.87 O ATOM 0 H TYR A 41 -2.140 -14.518 6.879 1.00 12.10 H new ATOM 0 HA TYR A 41 -4.711 -13.919 5.684 1.00 11.74 H new ATOM 0 HB2 TYR A 41 -4.940 -16.393 5.026 1.00 12.43 H new ATOM 0 HB3 TYR A 41 -4.086 -15.328 3.927 1.00 12.43 H new ATOM 0 HD1 TYR A 41 -3.395 -17.651 6.788 1.00 13.72 H new ATOM 0 HD2 TYR A 41 -1.990 -16.019 3.113 1.00 13.55 H new ATOM 0 HE1 TYR A 41 -1.455 -19.162 6.856 1.00 14.56 H new ATOM 0 HE2 TYR A 41 -0.061 -17.526 3.176 1.00 14.41 H new ATOM 0 HH TYR A 41 1.028 -19.133 4.288 1.00 15.87 H new ATOM 34 N ILE A 42 -5.749 -15.571 7.439 1.00 10.66 N ATOM 35 CA ILE A 42 -6.305 -16.080 8.683 1.00 10.40 C ATOM 36 C ILE A 42 -6.155 -17.598 8.760 1.00 10.44 C ATOM 37 O ILE A 42 -7.059 -18.349 8.378 1.00 10.49 O ATOM 38 CB ILE A 42 -7.792 -15.695 8.840 1.00 9.97 C ATOM 39 CG1 ILE A 42 -7.972 -14.188 8.640 1.00 9.82 C ATOM 40 CG2 ILE A 42 -8.303 -16.108 10.214 1.00 10.25 C ATOM 41 CD1 ILE A 42 -9.413 -13.733 8.704 1.00 10.06 C ATOM 0 H ILE A 42 -6.426 -15.474 6.682 1.00 10.66 H new ATOM 0 HA ILE A 42 -5.745 -15.622 9.499 1.00 10.40 H new ATOM 0 HB ILE A 42 -8.370 -16.221 8.080 1.00 9.97 H new ATOM 0 HG12 ILE A 42 -7.399 -13.659 9.401 1.00 9.82 H new ATOM 0 HG13 ILE A 42 -7.554 -13.906 7.673 1.00 9.82 H new ATOM 0 HG21 ILE A 42 -9.353 -15.830 10.310 1.00 10.25 H new ATOM 0 HG22 ILE A 42 -8.201 -17.187 10.331 1.00 10.25 H new ATOM 0 HG23 ILE A 42 -7.722 -15.603 10.985 1.00 10.25 H new ATOM 0 HD11 ILE A 42 -9.461 -12.654 8.554 1.00 10.06 H new ATOM 0 HD12 ILE A 42 -9.988 -14.234 7.925 1.00 10.06 H new ATOM 0 HD13 ILE A 42 -9.830 -13.982 9.680 1.00 10.06 H new ATOM 53 N ASP A 43 -4.971 -18.024 9.199 1.00 10.68 N ATOM 54 CA ASP A 43 -4.650 -19.436 9.465 1.00 11.02 C ATOM 55 C ASP A 43 -4.507 -20.253 8.181 1.00 11.08 C ATOM 56 O ASP A 43 -3.952 -21.352 8.185 1.00 11.69 O ATOM 57 CB ASP A 43 -5.693 -20.071 10.394 1.00 11.24 C ATOM 58 CG ASP A 43 -5.271 -21.438 10.890 1.00 11.95 C ATOM 59 OD1 ASP A 43 -4.320 -21.512 11.698 1.00 12.35 O ATOM 60 OD2 ASP A 43 -5.889 -22.443 10.491 1.00 12.25 O ATOM 0 H ASP A 43 -4.192 -17.392 9.384 1.00 10.68 H new ATOM 0 HA ASP A 43 -3.682 -19.449 9.965 1.00 11.02 H new ATOM 0 HB2 ASP A 43 -5.862 -19.415 11.248 1.00 11.24 H new ATOM 0 HB3 ASP A 43 -6.642 -20.157 9.865 1.00 11.24 H new ATOM 65 N GLY A 44 -4.997 -19.702 7.088 1.00 10.65 N ATOM 66 CA GLY A 44 -4.896 -20.360 5.801 1.00 10.86 C ATOM 67 C GLY A 44 -6.189 -21.034 5.393 1.00 10.53 C ATOM 68 O GLY A 44 -6.445 -21.232 4.206 1.00 10.64 O ATOM 0 H GLY A 44 -5.470 -18.799 7.066 1.00 10.65 H new ATOM 0 HA2 GLY A 44 -4.616 -19.628 5.043 1.00 10.86 H new ATOM 0 HA3 GLY A 44 -4.099 -21.102 5.837 1.00 10.86 H new ATOM 72 N ASP A 45 -7.016 -21.372 6.372 1.00 10.35 N ATOM 73 CA ASP A 45 -8.285 -22.032 6.092 1.00 10.29 C ATOM 74 C ASP A 45 -9.413 -21.018 5.986 1.00 9.54 C ATOM 75 O ASP A 45 -10.324 -21.166 5.172 1.00 9.39 O ATOM 76 CB ASP A 45 -8.612 -23.060 7.171 1.00 10.94 C ATOM 77 CG ASP A 45 -9.902 -23.795 6.880 1.00 11.21 C ATOM 78 OD1 ASP A 45 -9.942 -24.567 5.902 1.00 11.37 O ATOM 79 OD2 ASP A 45 -10.886 -23.604 7.623 1.00 11.45 O ATOM 0 H ASP A 45 -6.834 -21.202 7.361 1.00 10.35 H new ATOM 0 HA ASP A 45 -8.186 -22.546 5.136 1.00 10.29 H new ATOM 0 HB2 ASP A 45 -7.795 -23.778 7.248 1.00 10.94 H new ATOM 0 HB3 ASP A 45 -8.689 -22.560 8.137 1.00 10.94 H new ATOM 84 N GLN A 46 -9.334 -19.975 6.798 1.00 9.30 N ATOM 85 CA GLN A 46 -10.342 -18.927 6.801 1.00 8.82 C ATOM 86 C GLN A 46 -10.001 -17.853 5.773 1.00 7.96 C ATOM 87 O GLN A 46 -10.427 -16.703 5.883 1.00 7.83 O ATOM 88 CB GLN A 46 -10.461 -18.319 8.196 1.00 9.37 C ATOM 89 CG GLN A 46 -10.964 -19.297 9.238 1.00 9.97 C ATOM 90 CD GLN A 46 -11.096 -18.673 10.611 1.00 10.63 C ATOM 91 OE1 GLN A 46 -10.158 -18.695 11.406 1.00 11.07 O ATOM 92 NE2 GLN A 46 -12.261 -18.123 10.905 1.00 10.92 N ATOM 0 H GLN A 46 -8.577 -19.832 7.467 1.00 9.30 H new ATOM 0 HA GLN A 46 -11.303 -19.364 6.529 1.00 8.82 H new ATOM 0 HB2 GLN A 46 -9.486 -17.941 8.504 1.00 9.37 H new ATOM 0 HB3 GLN A 46 -11.136 -17.464 8.155 1.00 9.37 H new ATOM 0 HG2 GLN A 46 -11.933 -19.687 8.926 1.00 9.97 H new ATOM 0 HG3 GLN A 46 -10.282 -20.145 9.293 1.00 9.97 H new ATOM 0 HE21 GLN A 46 -13.014 -18.125 10.217 1.00 10.92 H new ATOM 0 HE22 GLN A 46 -12.407 -17.696 11.820 1.00 10.92 H new ATOM 101 N ALA A 47 -9.213 -18.242 4.782 1.00 7.63 N ATOM 102 CA ALA A 47 -8.821 -17.343 3.713 1.00 7.10 C ATOM 103 C ALA A 47 -9.743 -17.511 2.515 1.00 6.23 C ATOM 104 O ALA A 47 -10.204 -18.617 2.226 1.00 6.37 O ATOM 105 CB ALA A 47 -7.377 -17.599 3.313 1.00 7.70 C ATOM 0 H ALA A 47 -8.831 -19.184 4.698 1.00 7.63 H new ATOM 0 HA ALA A 47 -8.905 -16.317 4.071 1.00 7.10 H new ATOM 0 HB1 ALA A 47 -7.096 -16.918 2.510 1.00 7.70 H new ATOM 0 HB2 ALA A 47 -6.727 -17.435 4.172 1.00 7.70 H new ATOM 0 HB3 ALA A 47 -7.272 -18.628 2.969 1.00 7.70 H new ATOM 111 N GLY A 48 -10.012 -16.415 1.831 1.00 5.65 N ATOM 112 CA GLY A 48 -10.899 -16.445 0.689 1.00 5.11 C ATOM 113 C GLY A 48 -11.578 -15.112 0.482 1.00 4.06 C ATOM 114 O GLY A 48 -11.520 -14.537 -0.606 1.00 4.07 O ATOM 0 H GLY A 48 -9.628 -15.495 2.048 1.00 5.65 H new ATOM 0 HA2 GLY A 48 -10.334 -16.710 -0.205 1.00 5.11 H new ATOM 0 HA3 GLY A 48 -11.652 -17.220 0.832 1.00 5.11 H new ATOM 118 N GLN A 49 -12.208 -14.615 1.537 1.00 3.63 N ATOM 119 CA GLN A 49 -12.843 -13.305 1.499 1.00 2.96 C ATOM 120 C GLN A 49 -11.783 -12.206 1.500 1.00 2.13 C ATOM 121 O GLN A 49 -10.633 -12.452 1.881 1.00 2.55 O ATOM 122 CB GLN A 49 -13.791 -13.141 2.684 1.00 3.66 C ATOM 123 CG GLN A 49 -13.081 -13.213 4.014 1.00 4.66 C ATOM 124 CD GLN A 49 -14.009 -13.551 5.163 1.00 5.45 C ATOM 125 OE1 GLN A 49 -14.190 -14.721 5.503 1.00 5.88 O ATOM 126 NE2 GLN A 49 -14.610 -12.537 5.765 1.00 6.04 N ATOM 0 H GLN A 49 -12.293 -15.099 2.431 1.00 3.63 H new ATOM 0 HA GLN A 49 -13.425 -13.222 0.581 1.00 2.96 H new ATOM 0 HB2 GLN A 49 -14.305 -12.183 2.603 1.00 3.66 H new ATOM 0 HB3 GLN A 49 -14.555 -13.917 2.643 1.00 3.66 H new ATOM 0 HG2 GLN A 49 -12.292 -13.963 3.958 1.00 4.66 H new ATOM 0 HG3 GLN A 49 -12.598 -12.257 4.214 1.00 4.66 H new ATOM 0 HE21 GLN A 49 -14.434 -11.582 5.454 1.00 6.04 H new ATOM 0 HE22 GLN A 49 -15.250 -12.711 6.540 1.00 6.04 H new ATOM 135 N LYS A 50 -12.176 -11.006 1.071 1.00 1.67 N ATOM 136 CA LYS A 50 -11.277 -9.872 0.965 1.00 1.23 C ATOM 137 C LYS A 50 -10.241 -10.100 -0.125 1.00 1.14 C ATOM 138 O LYS A 50 -10.298 -11.088 -0.863 1.00 1.86 O ATOM 139 CB LYS A 50 -10.607 -9.572 2.312 1.00 1.57 C ATOM 140 CG LYS A 50 -11.573 -9.069 3.363 1.00 1.90 C ATOM 141 CD LYS A 50 -10.905 -8.916 4.719 1.00 2.73 C ATOM 142 CE LYS A 50 -11.863 -8.319 5.736 1.00 3.21 C ATOM 143 NZ LYS A 50 -11.271 -8.269 7.097 1.00 4.04 N ATOM 0 H LYS A 50 -13.134 -10.799 0.787 1.00 1.67 H new ATOM 0 HA LYS A 50 -11.868 -8.999 0.687 1.00 1.23 H new ATOM 0 HB2 LYS A 50 -10.122 -10.477 2.678 1.00 1.57 H new ATOM 0 HB3 LYS A 50 -9.824 -8.829 2.163 1.00 1.57 H new ATOM 0 HG2 LYS A 50 -11.983 -8.109 3.050 1.00 1.90 H new ATOM 0 HG3 LYS A 50 -12.411 -9.761 3.447 1.00 1.90 H new ATOM 0 HD2 LYS A 50 -10.558 -9.888 5.069 1.00 2.73 H new ATOM 0 HD3 LYS A 50 -10.026 -8.279 4.625 1.00 2.73 H new ATOM 0 HE2 LYS A 50 -12.141 -7.312 5.425 1.00 3.21 H new ATOM 0 HE3 LYS A 50 -12.779 -8.909 5.761 1.00 3.21 H new ATOM 0 HZ1 LYS A 50 -11.958 -7.855 7.759 1.00 4.04 H new ATOM 0 HZ2 LYS A 50 -11.029 -9.232 7.406 1.00 4.04 H new ATOM 0 HZ3 LYS A 50 -10.411 -7.685 7.080 1.00 4.04 H new ATOM 157 N ALA A 51 -9.333 -9.150 -0.232 1.00 0.80 N ATOM 158 CA ALA A 51 -8.259 -9.172 -1.217 1.00 0.75 C ATOM 159 C ALA A 51 -8.813 -8.931 -2.617 1.00 0.83 C ATOM 160 O ALA A 51 -8.884 -9.844 -3.444 1.00 1.01 O ATOM 161 CB ALA A 51 -7.459 -10.466 -1.141 1.00 0.84 C ATOM 0 H ALA A 51 -9.317 -8.327 0.370 1.00 0.80 H new ATOM 0 HA ALA A 51 -7.569 -8.360 -0.986 1.00 0.75 H new ATOM 0 HB1 ALA A 51 -6.667 -10.448 -1.889 1.00 0.84 H new ATOM 0 HB2 ALA A 51 -7.019 -10.564 -0.149 1.00 0.84 H new ATOM 0 HB3 ALA A 51 -8.118 -11.313 -1.331 1.00 0.84 H new ATOM 167 N GLU A 52 -9.229 -7.685 -2.839 1.00 0.75 N ATOM 168 CA GLU A 52 -9.768 -7.218 -4.119 1.00 0.86 C ATOM 169 C GLU A 52 -8.962 -7.724 -5.304 1.00 0.97 C ATOM 170 O GLU A 52 -7.752 -7.508 -5.381 1.00 1.04 O ATOM 171 CB GLU A 52 -9.758 -5.688 -4.174 1.00 0.83 C ATOM 172 CG GLU A 52 -10.106 -5.017 -2.863 1.00 0.91 C ATOM 173 CD GLU A 52 -11.484 -5.403 -2.362 1.00 1.63 C ATOM 174 OE1 GLU A 52 -12.474 -4.767 -2.781 1.00 2.04 O ATOM 175 OE2 GLU A 52 -11.591 -6.343 -1.552 1.00 1.98 O ATOM 0 H GLU A 52 -9.201 -6.958 -2.124 1.00 0.75 H new ATOM 0 HA GLU A 52 -10.784 -7.608 -4.184 1.00 0.86 H new ATOM 0 HB2 GLU A 52 -8.770 -5.354 -4.489 1.00 0.83 H new ATOM 0 HB3 GLU A 52 -10.464 -5.359 -4.936 1.00 0.83 H new ATOM 0 HG2 GLU A 52 -9.362 -5.284 -2.113 1.00 0.91 H new ATOM 0 HG3 GLU A 52 -10.058 -3.935 -2.988 1.00 0.91 H new ATOM 182 N ASN A 53 -9.640 -8.378 -6.228 1.00 1.07 N ATOM 183 CA ASN A 53 -9.026 -8.760 -7.489 1.00 1.20 C ATOM 184 C ASN A 53 -9.342 -7.710 -8.548 1.00 1.20 C ATOM 185 O ASN A 53 -8.680 -7.632 -9.583 1.00 1.34 O ATOM 186 CB ASN A 53 -9.503 -10.143 -7.948 1.00 1.31 C ATOM 187 CG ASN A 53 -11.012 -10.259 -8.017 1.00 1.88 C ATOM 188 OD1 ASN A 53 -11.631 -9.904 -9.020 1.00 2.59 O ATOM 189 ND2 ASN A 53 -11.613 -10.775 -6.957 1.00 2.43 N ATOM 0 H ASN A 53 -10.616 -8.657 -6.131 1.00 1.07 H new ATOM 0 HA ASN A 53 -7.947 -8.817 -7.344 1.00 1.20 H new ATOM 0 HB2 ASN A 53 -9.083 -10.358 -8.931 1.00 1.31 H new ATOM 0 HB3 ASN A 53 -9.117 -10.899 -7.264 1.00 1.31 H new ATOM 0 HD21 ASN A 53 -12.626 -10.891 -6.951 1.00 2.43 H new ATOM 0 HD22 ASN A 53 -11.063 -11.057 -6.146 1.00 2.43 H new ATOM 196 N LEU A 54 -10.367 -6.905 -8.277 1.00 1.12 N ATOM 197 CA LEU A 54 -10.728 -5.790 -9.130 1.00 1.15 C ATOM 198 C LEU A 54 -9.654 -4.708 -9.078 1.00 1.13 C ATOM 199 O LEU A 54 -8.844 -4.668 -8.149 1.00 1.13 O ATOM 200 CB LEU A 54 -12.058 -5.219 -8.649 1.00 1.18 C ATOM 201 CG LEU A 54 -12.961 -4.642 -9.722 1.00 1.18 C ATOM 202 CD1 LEU A 54 -13.280 -5.692 -10.773 1.00 1.28 C ATOM 203 CD2 LEU A 54 -14.222 -4.134 -9.066 1.00 1.81 C ATOM 0 H LEU A 54 -10.966 -7.013 -7.459 1.00 1.12 H new ATOM 0 HA LEU A 54 -10.817 -6.135 -10.160 1.00 1.15 H new ATOM 0 HB2 LEU A 54 -12.602 -6.007 -8.129 1.00 1.18 H new ATOM 0 HB3 LEU A 54 -11.852 -4.438 -7.917 1.00 1.18 H new ATOM 0 HG LEU A 54 -12.457 -3.818 -10.227 1.00 1.18 H new ATOM 0 HD11 LEU A 54 -13.929 -5.259 -11.534 1.00 1.28 H new ATOM 0 HD12 LEU A 54 -12.355 -6.035 -11.237 1.00 1.28 H new ATOM 0 HD13 LEU A 54 -13.785 -6.536 -10.303 1.00 1.28 H new ATOM 0 HD21 LEU A 54 -14.883 -3.715 -9.824 1.00 1.81 H new ATOM 0 HD22 LEU A 54 -14.726 -4.957 -8.560 1.00 1.81 H new ATOM 0 HD23 LEU A 54 -13.969 -3.362 -8.339 1.00 1.81 H new ATOM 215 N THR A 55 -9.662 -3.834 -10.070 1.00 1.16 N ATOM 216 CA THR A 55 -8.704 -2.748 -10.152 1.00 1.21 C ATOM 217 C THR A 55 -8.976 -1.708 -9.059 1.00 1.14 C ATOM 218 O THR A 55 -10.126 -1.464 -8.697 1.00 1.09 O ATOM 219 CB THR A 55 -8.776 -2.096 -11.541 1.00 1.31 C ATOM 220 OG1 THR A 55 -10.135 -1.812 -11.863 1.00 1.30 O ATOM 221 CG2 THR A 55 -8.216 -3.012 -12.608 1.00 1.40 C ATOM 0 H THR A 55 -10.332 -3.858 -10.839 1.00 1.16 H new ATOM 0 HA THR A 55 -7.702 -3.149 -9.999 1.00 1.21 H new ATOM 0 HB THR A 55 -8.185 -1.181 -11.512 1.00 1.31 H new ATOM 0 HG1 THR A 55 -10.204 -0.900 -12.215 1.00 1.30 H new ATOM 0 HG21 THR A 55 -8.281 -2.522 -13.579 1.00 1.40 H new ATOM 0 HG22 THR A 55 -7.173 -3.236 -12.384 1.00 1.40 H new ATOM 0 HG23 THR A 55 -8.790 -3.938 -12.630 1.00 1.40 H new ATOM 229 N PRO A 56 -7.903 -1.093 -8.522 1.00 1.18 N ATOM 230 CA PRO A 56 -7.957 -0.286 -7.291 1.00 1.10 C ATOM 231 C PRO A 56 -8.936 0.881 -7.346 1.00 1.05 C ATOM 232 O PRO A 56 -9.504 1.257 -6.324 1.00 0.97 O ATOM 233 CB PRO A 56 -6.526 0.232 -7.117 1.00 1.21 C ATOM 234 CG PRO A 56 -5.867 0.040 -8.436 1.00 1.38 C ATOM 235 CD PRO A 56 -6.546 -1.131 -9.085 1.00 1.34 C ATOM 0 HA PRO A 56 -8.317 -0.894 -6.461 1.00 1.10 H new ATOM 0 HB2 PRO A 56 -6.522 1.283 -6.826 1.00 1.21 H new ATOM 0 HB3 PRO A 56 -6.003 -0.317 -6.334 1.00 1.21 H new ATOM 0 HG2 PRO A 56 -5.963 0.934 -9.052 1.00 1.38 H new ATOM 0 HG3 PRO A 56 -4.801 -0.149 -8.313 1.00 1.38 H new ATOM 0 HD2 PRO A 56 -6.559 -1.037 -10.171 1.00 1.34 H new ATOM 0 HD3 PRO A 56 -6.041 -2.068 -8.852 1.00 1.34 H new ATOM 243 N ASP A 57 -9.140 1.448 -8.525 1.00 1.13 N ATOM 244 CA ASP A 57 -10.079 2.555 -8.675 1.00 1.14 C ATOM 245 C ASP A 57 -11.490 2.018 -8.562 1.00 1.07 C ATOM 246 O ASP A 57 -12.323 2.549 -7.825 1.00 1.05 O ATOM 247 CB ASP A 57 -9.903 3.258 -10.026 1.00 1.30 C ATOM 248 CG ASP A 57 -8.557 3.937 -10.178 1.00 1.61 C ATOM 249 OD1 ASP A 57 -7.591 3.264 -10.586 1.00 2.15 O ATOM 250 OD2 ASP A 57 -8.454 5.142 -9.869 1.00 1.67 O ATOM 0 H ASP A 57 -8.674 1.165 -9.387 1.00 1.13 H new ATOM 0 HA ASP A 57 -9.885 3.286 -7.890 1.00 1.14 H new ATOM 0 HB2 ASP A 57 -10.026 2.528 -10.826 1.00 1.30 H new ATOM 0 HB3 ASP A 57 -10.692 4.000 -10.147 1.00 1.30 H new ATOM 255 N GLU A 58 -11.732 0.950 -9.309 1.00 1.09 N ATOM 256 CA GLU A 58 -12.983 0.221 -9.290 1.00 1.05 C ATOM 257 C GLU A 58 -13.358 -0.177 -7.870 1.00 0.93 C ATOM 258 O GLU A 58 -14.529 -0.185 -7.512 1.00 0.93 O ATOM 259 CB GLU A 58 -12.827 -1.024 -10.167 1.00 1.12 C ATOM 260 CG GLU A 58 -12.862 -0.750 -11.669 1.00 1.26 C ATOM 261 CD GLU A 58 -12.182 0.547 -12.076 1.00 1.83 C ATOM 262 OE1 GLU A 58 -10.936 0.636 -11.966 1.00 2.17 O ATOM 263 OE2 GLU A 58 -12.889 1.483 -12.507 1.00 2.54 O ATOM 0 H GLU A 58 -11.047 0.562 -9.957 1.00 1.09 H new ATOM 0 HA GLU A 58 -13.781 0.855 -9.675 1.00 1.05 H new ATOM 0 HB2 GLU A 58 -11.883 -1.510 -9.921 1.00 1.12 H new ATOM 0 HB3 GLU A 58 -13.622 -1.728 -9.920 1.00 1.12 H new ATOM 0 HG2 GLU A 58 -12.383 -1.579 -12.191 1.00 1.26 H new ATOM 0 HG3 GLU A 58 -13.900 -0.723 -11.999 1.00 1.26 H new ATOM 270 N VAL A 59 -12.351 -0.491 -7.066 1.00 0.86 N ATOM 271 CA VAL A 59 -12.565 -0.877 -5.674 1.00 0.75 C ATOM 272 C VAL A 59 -13.327 0.199 -4.918 1.00 0.71 C ATOM 273 O VAL A 59 -14.450 -0.020 -4.461 1.00 0.71 O ATOM 274 CB VAL A 59 -11.227 -1.101 -4.947 1.00 0.72 C ATOM 275 CG1 VAL A 59 -11.451 -1.439 -3.480 1.00 0.63 C ATOM 276 CG2 VAL A 59 -10.418 -2.188 -5.634 1.00 0.82 C ATOM 0 H VAL A 59 -11.373 -0.486 -7.354 1.00 0.86 H new ATOM 0 HA VAL A 59 -13.141 -1.802 -5.692 1.00 0.75 H new ATOM 0 HB VAL A 59 -10.659 -0.172 -4.993 1.00 0.72 H new ATOM 0 HG11 VAL A 59 -10.489 -1.592 -2.991 1.00 0.63 H new ATOM 0 HG12 VAL A 59 -11.979 -0.618 -2.994 1.00 0.63 H new ATOM 0 HG13 VAL A 59 -12.046 -2.349 -3.403 1.00 0.63 H new ATOM 0 HG21 VAL A 59 -9.476 -2.330 -5.104 1.00 0.82 H new ATOM 0 HG22 VAL A 59 -10.982 -3.120 -5.628 1.00 0.82 H new ATOM 0 HG23 VAL A 59 -10.214 -1.894 -6.664 1.00 0.82 H new ATOM 286 N SER A 60 -12.707 1.359 -4.818 1.00 0.70 N ATOM 287 CA SER A 60 -13.218 2.450 -4.046 1.00 0.70 C ATOM 288 C SER A 60 -14.551 2.956 -4.582 1.00 0.74 C ATOM 289 O SER A 60 -15.559 2.971 -3.874 1.00 0.72 O ATOM 290 CB SER A 60 -12.187 3.549 -4.095 1.00 0.76 C ATOM 291 OG SER A 60 -10.996 3.178 -3.419 1.00 0.97 O ATOM 0 H SER A 60 -11.822 1.562 -5.282 1.00 0.70 H new ATOM 0 HA SER A 60 -13.402 2.120 -3.024 1.00 0.70 H new ATOM 0 HB2 SER A 60 -11.957 3.787 -5.134 1.00 0.76 H new ATOM 0 HB3 SER A 60 -12.596 4.453 -3.643 1.00 0.76 H new ATOM 0 HG SER A 60 -10.348 3.912 -3.471 1.00 0.97 H new ATOM 297 N LYS A 61 -14.536 3.361 -5.837 1.00 0.87 N ATOM 298 CA LYS A 61 -15.713 3.919 -6.499 1.00 0.96 C ATOM 299 C LYS A 61 -16.951 3.029 -6.343 1.00 0.94 C ATOM 300 O LYS A 61 -18.069 3.531 -6.217 1.00 1.01 O ATOM 301 CB LYS A 61 -15.431 4.131 -7.987 1.00 1.10 C ATOM 302 CG LYS A 61 -14.289 5.092 -8.270 1.00 1.17 C ATOM 303 CD LYS A 61 -14.050 5.246 -9.763 1.00 1.36 C ATOM 304 CE LYS A 61 -13.672 3.919 -10.403 1.00 2.01 C ATOM 305 NZ LYS A 61 -13.464 4.042 -11.866 1.00 2.54 N ATOM 0 H LYS A 61 -13.709 3.315 -6.433 1.00 0.87 H new ATOM 0 HA LYS A 61 -15.924 4.873 -6.015 1.00 0.96 H new ATOM 0 HB2 LYS A 61 -15.203 3.168 -8.444 1.00 1.10 H new ATOM 0 HB3 LYS A 61 -16.335 4.506 -8.468 1.00 1.10 H new ATOM 0 HG2 LYS A 61 -14.514 6.065 -7.834 1.00 1.17 H new ATOM 0 HG3 LYS A 61 -13.380 4.730 -7.790 1.00 1.17 H new ATOM 0 HD2 LYS A 61 -14.949 5.638 -10.239 1.00 1.36 H new ATOM 0 HD3 LYS A 61 -13.256 5.973 -9.933 1.00 1.36 H new ATOM 0 HE2 LYS A 61 -12.761 3.540 -9.939 1.00 2.01 H new ATOM 0 HE3 LYS A 61 -14.457 3.188 -10.209 1.00 2.01 H new ATOM 0 HZ1 LYS A 61 -13.528 3.102 -12.306 1.00 2.54 H new ATOM 0 HZ2 LYS A 61 -14.194 4.664 -12.269 1.00 2.54 H new ATOM 0 HZ3 LYS A 61 -12.524 4.447 -12.050 1.00 2.54 H new ATOM 319 N ARG A 62 -16.755 1.714 -6.355 1.00 0.88 N ATOM 320 CA ARG A 62 -17.870 0.782 -6.285 1.00 0.89 C ATOM 321 C ARG A 62 -18.302 0.507 -4.844 1.00 0.77 C ATOM 322 O ARG A 62 -19.423 0.057 -4.606 1.00 0.82 O ATOM 323 CB ARG A 62 -17.522 -0.537 -6.981 1.00 0.93 C ATOM 324 CG ARG A 62 -17.350 -0.412 -8.482 1.00 1.21 C ATOM 325 CD ARG A 62 -17.059 -1.759 -9.110 1.00 1.21 C ATOM 326 NE ARG A 62 -16.771 -1.665 -10.541 1.00 1.85 N ATOM 327 CZ ARG A 62 -16.795 -2.711 -11.367 1.00 2.40 C ATOM 328 NH1 ARG A 62 -17.125 -3.912 -10.903 1.00 2.53 N ATOM 329 NH2 ARG A 62 -16.494 -2.560 -12.650 1.00 3.33 N ATOM 0 H ARG A 62 -15.837 1.273 -6.412 1.00 0.88 H new ATOM 0 HA ARG A 62 -18.706 1.253 -6.802 1.00 0.89 H new ATOM 0 HB2 ARG A 62 -16.601 -0.932 -6.551 1.00 0.93 H new ATOM 0 HB3 ARG A 62 -18.307 -1.264 -6.774 1.00 0.93 H new ATOM 0 HG2 ARG A 62 -18.254 0.010 -8.921 1.00 1.21 H new ATOM 0 HG3 ARG A 62 -16.536 0.279 -8.702 1.00 1.21 H new ATOM 0 HD2 ARG A 62 -16.210 -2.216 -8.602 1.00 1.21 H new ATOM 0 HD3 ARG A 62 -17.914 -2.418 -8.958 1.00 1.21 H new ATOM 0 HE ARG A 62 -16.539 -0.750 -10.928 1.00 1.85 H new ATOM 0 HH11 ARG A 62 -17.359 -4.031 -9.917 1.00 2.53 H new ATOM 0 HH12 ARG A 62 -17.144 -4.714 -11.533 1.00 2.53 H new ATOM 0 HH21 ARG A 62 -16.242 -1.639 -13.010 1.00 3.33 H new ATOM 0 HH22 ARG A 62 -16.514 -3.365 -13.277 1.00 3.33 H new ATOM 343 N GLU A 63 -17.427 0.766 -3.882 1.00 0.68 N ATOM 344 CA GLU A 63 -17.764 0.511 -2.485 1.00 0.63 C ATOM 345 C GLU A 63 -18.321 1.758 -1.814 1.00 0.66 C ATOM 346 O GLU A 63 -18.990 1.670 -0.784 1.00 0.73 O ATOM 347 CB GLU A 63 -16.557 -0.015 -1.711 1.00 0.59 C ATOM 348 CG GLU A 63 -15.375 0.937 -1.651 1.00 0.58 C ATOM 349 CD GLU A 63 -14.230 0.357 -0.859 1.00 0.65 C ATOM 350 OE1 GLU A 63 -14.239 0.524 0.377 1.00 1.25 O ATOM 351 OE2 GLU A 63 -13.356 -0.279 -1.436 1.00 1.21 O ATOM 0 H GLU A 63 -16.493 1.146 -4.037 1.00 0.68 H new ATOM 0 HA GLU A 63 -18.538 -0.257 -2.474 1.00 0.63 H new ATOM 0 HB2 GLU A 63 -16.869 -0.249 -0.693 1.00 0.59 H new ATOM 0 HB3 GLU A 63 -16.230 -0.950 -2.167 1.00 0.59 H new ATOM 0 HG2 GLU A 63 -15.039 1.164 -2.663 1.00 0.58 H new ATOM 0 HG3 GLU A 63 -15.689 1.879 -1.200 1.00 0.58 H new ATOM 358 N GLY A 64 -18.034 2.914 -2.390 1.00 0.69 N ATOM 359 CA GLY A 64 -18.590 4.150 -1.883 1.00 0.74 C ATOM 360 C GLY A 64 -17.530 5.179 -1.561 1.00 0.72 C ATOM 361 O GLY A 64 -17.554 6.289 -2.094 1.00 0.86 O ATOM 0 H GLY A 64 -17.425 3.019 -3.201 1.00 0.69 H new ATOM 0 HA2 GLY A 64 -19.279 4.563 -2.620 1.00 0.74 H new ATOM 0 HA3 GLY A 64 -19.172 3.941 -0.985 1.00 0.74 H new ATOM 365 N ILE A 65 -16.597 4.815 -0.691 1.00 0.62 N ATOM 366 CA ILE A 65 -15.542 5.734 -0.293 1.00 0.67 C ATOM 367 C ILE A 65 -14.515 5.889 -1.403 1.00 0.81 C ATOM 368 O ILE A 65 -14.063 4.910 -1.989 1.00 1.76 O ATOM 369 CB ILE A 65 -14.824 5.288 1.002 1.00 0.61 C ATOM 370 CG1 ILE A 65 -14.207 3.898 0.845 1.00 0.53 C ATOM 371 CG2 ILE A 65 -15.782 5.310 2.178 1.00 0.89 C ATOM 372 CD1 ILE A 65 -13.455 3.438 2.072 1.00 0.49 C ATOM 0 H ILE A 65 -16.550 3.896 -0.251 1.00 0.62 H new ATOM 0 HA ILE A 65 -16.027 6.691 -0.098 1.00 0.67 H new ATOM 0 HB ILE A 65 -14.017 5.995 1.194 1.00 0.61 H new ATOM 0 HG12 ILE A 65 -14.996 3.181 0.620 1.00 0.53 H new ATOM 0 HG13 ILE A 65 -13.529 3.903 -0.008 1.00 0.53 H new ATOM 0 HG21 ILE A 65 -15.258 4.993 3.080 1.00 0.89 H new ATOM 0 HG22 ILE A 65 -16.164 6.321 2.317 1.00 0.89 H new ATOM 0 HG23 ILE A 65 -16.613 4.631 1.983 1.00 0.89 H new ATOM 0 HD11 ILE A 65 -13.042 2.445 1.895 1.00 0.49 H new ATOM 0 HD12 ILE A 65 -12.645 4.135 2.285 1.00 0.49 H new ATOM 0 HD13 ILE A 65 -14.135 3.402 2.923 1.00 0.49 H new ATOM 384 N ASN A 66 -14.158 7.124 -1.693 1.00 0.75 N ATOM 385 CA ASN A 66 -13.171 7.409 -2.722 1.00 0.69 C ATOM 386 C ASN A 66 -11.904 7.956 -2.088 1.00 0.61 C ATOM 387 O ASN A 66 -11.070 8.571 -2.758 1.00 0.64 O ATOM 388 CB ASN A 66 -13.721 8.400 -3.740 1.00 0.83 C ATOM 389 CG ASN A 66 -14.894 7.841 -4.516 1.00 1.38 C ATOM 390 OD1 ASN A 66 -16.050 7.997 -4.122 1.00 2.09 O ATOM 391 ND2 ASN A 66 -14.609 7.184 -5.627 1.00 2.10 N ATOM 0 H ASN A 66 -14.536 7.951 -1.230 1.00 0.75 H new ATOM 0 HA ASN A 66 -12.937 6.481 -3.243 1.00 0.69 H new ATOM 0 HB2 ASN A 66 -14.030 9.310 -3.226 1.00 0.83 H new ATOM 0 HB3 ASN A 66 -12.929 8.679 -4.435 1.00 0.83 H new ATOM 0 HD21 ASN A 66 -15.360 6.785 -6.191 1.00 2.10 H new ATOM 0 HD22 ASN A 66 -13.638 7.076 -5.921 1.00 2.10 H new ATOM 398 N ALA A 67 -11.776 7.738 -0.783 1.00 0.54 N ATOM 399 CA ALA A 67 -10.609 8.190 -0.034 1.00 0.49 C ATOM 400 C ALA A 67 -9.344 7.482 -0.507 1.00 0.44 C ATOM 401 O ALA A 67 -9.410 6.400 -1.096 1.00 0.45 O ATOM 402 CB ALA A 67 -10.820 7.956 1.450 1.00 0.47 C ATOM 0 H ALA A 67 -12.471 7.248 -0.220 1.00 0.54 H new ATOM 0 HA ALA A 67 -10.483 9.258 -0.212 1.00 0.49 H new ATOM 0 HB1 ALA A 67 -9.943 8.297 2.000 1.00 0.47 H new ATOM 0 HB2 ALA A 67 -11.697 8.511 1.785 1.00 0.47 H new ATOM 0 HB3 ALA A 67 -10.972 6.892 1.633 1.00 0.47 H new ATOM 408 N GLU A 68 -8.196 8.094 -0.234 1.00 0.44 N ATOM 409 CA GLU A 68 -6.923 7.575 -0.712 1.00 0.42 C ATOM 410 C GLU A 68 -6.574 6.257 -0.048 1.00 0.34 C ATOM 411 O GLU A 68 -6.651 6.115 1.172 1.00 0.35 O ATOM 412 CB GLU A 68 -5.798 8.579 -0.488 1.00 0.50 C ATOM 413 CG GLU A 68 -5.986 9.869 -1.258 1.00 0.78 C ATOM 414 CD GLU A 68 -6.431 9.636 -2.686 1.00 1.79 C ATOM 415 OE1 GLU A 68 -5.706 8.955 -3.440 1.00 2.28 O ATOM 416 OE2 GLU A 68 -7.511 10.132 -3.060 1.00 2.59 O ATOM 0 H GLU A 68 -8.123 8.950 0.316 1.00 0.44 H new ATOM 0 HA GLU A 68 -7.033 7.404 -1.783 1.00 0.42 H new ATOM 0 HB2 GLU A 68 -5.729 8.806 0.576 1.00 0.50 H new ATOM 0 HB3 GLU A 68 -4.851 8.124 -0.779 1.00 0.50 H new ATOM 0 HG2 GLU A 68 -6.724 10.488 -0.748 1.00 0.78 H new ATOM 0 HG3 GLU A 68 -5.049 10.426 -1.260 1.00 0.78 H new ATOM 423 N GLN A 69 -6.175 5.308 -0.873 1.00 0.31 N ATOM 424 CA GLN A 69 -5.853 3.966 -0.421 1.00 0.24 C ATOM 425 C GLN A 69 -4.448 3.917 0.159 1.00 0.21 C ATOM 426 O GLN A 69 -3.470 3.746 -0.566 1.00 0.27 O ATOM 427 CB GLN A 69 -5.993 2.987 -1.586 1.00 0.29 C ATOM 428 CG GLN A 69 -7.422 2.865 -2.084 1.00 0.43 C ATOM 429 CD GLN A 69 -7.514 2.282 -3.483 1.00 0.80 C ATOM 430 OE1 GLN A 69 -6.627 2.480 -4.317 1.00 1.64 O ATOM 431 NE2 GLN A 69 -8.587 1.560 -3.748 1.00 0.76 N ATOM 0 H GLN A 69 -6.064 5.445 -1.878 1.00 0.31 H new ATOM 0 HA GLN A 69 -6.549 3.680 0.368 1.00 0.24 H new ATOM 0 HB2 GLN A 69 -5.354 3.312 -2.407 1.00 0.29 H new ATOM 0 HB3 GLN A 69 -5.637 2.005 -1.274 1.00 0.29 H new ATOM 0 HG2 GLN A 69 -7.988 2.237 -1.396 1.00 0.43 H new ATOM 0 HG3 GLN A 69 -7.890 3.850 -2.075 1.00 0.43 H new ATOM 0 HE21 GLN A 69 -9.298 1.420 -3.030 1.00 0.76 H new ATOM 0 HE22 GLN A 69 -8.705 1.142 -4.671 1.00 0.76 H new ATOM 440 N ILE A 70 -4.362 4.081 1.472 1.00 0.19 N ATOM 441 CA ILE A 70 -3.084 4.107 2.168 1.00 0.17 C ATOM 442 C ILE A 70 -2.666 2.703 2.588 1.00 0.14 C ATOM 443 O ILE A 70 -3.149 2.183 3.592 1.00 0.14 O ATOM 444 CB ILE A 70 -3.162 4.991 3.427 1.00 0.21 C ATOM 445 CG1 ILE A 70 -3.803 6.337 3.090 1.00 0.27 C ATOM 446 CG2 ILE A 70 -1.772 5.196 4.017 1.00 0.21 C ATOM 447 CD1 ILE A 70 -4.100 7.179 4.308 1.00 0.36 C ATOM 0 H ILE A 70 -5.171 4.199 2.081 1.00 0.19 H new ATOM 0 HA ILE A 70 -2.348 4.518 1.477 1.00 0.17 H new ATOM 0 HB ILE A 70 -3.782 4.488 4.169 1.00 0.21 H new ATOM 0 HG12 ILE A 70 -3.139 6.892 2.427 1.00 0.27 H new ATOM 0 HG13 ILE A 70 -4.729 6.163 2.542 1.00 0.27 H new ATOM 0 HG21 ILE A 70 -1.843 5.823 4.906 1.00 0.21 H new ATOM 0 HG22 ILE A 70 -1.345 4.230 4.287 1.00 0.21 H new ATOM 0 HG23 ILE A 70 -1.132 5.682 3.281 1.00 0.21 H new ATOM 0 HD11 ILE A 70 -4.554 8.120 3.998 1.00 0.36 H new ATOM 0 HD12 ILE A 70 -4.788 6.643 4.962 1.00 0.36 H new ATOM 0 HD13 ILE A 70 -3.173 7.382 4.845 1.00 0.36 H new ATOM 459 N VAL A 71 -1.785 2.088 1.814 1.00 0.15 N ATOM 460 CA VAL A 71 -1.282 0.761 2.136 1.00 0.15 C ATOM 461 C VAL A 71 -0.516 0.797 3.458 1.00 0.14 C ATOM 462 O VAL A 71 0.568 1.372 3.543 1.00 0.17 O ATOM 463 CB VAL A 71 -0.364 0.204 1.020 1.00 0.18 C ATOM 464 CG1 VAL A 71 0.127 -1.186 1.376 1.00 0.19 C ATOM 465 CG2 VAL A 71 -1.075 0.181 -0.326 1.00 0.20 C ATOM 0 H VAL A 71 -1.403 2.487 0.957 1.00 0.15 H new ATOM 0 HA VAL A 71 -2.143 0.098 2.224 1.00 0.15 H new ATOM 0 HB VAL A 71 0.494 0.871 0.937 1.00 0.18 H new ATOM 0 HG11 VAL A 71 0.770 -1.560 0.579 1.00 0.19 H new ATOM 0 HG12 VAL A 71 0.690 -1.145 2.308 1.00 0.19 H new ATOM 0 HG13 VAL A 71 -0.726 -1.853 1.497 1.00 0.19 H new ATOM 0 HG21 VAL A 71 -0.402 -0.215 -1.086 1.00 0.20 H new ATOM 0 HG22 VAL A 71 -1.960 -0.452 -0.259 1.00 0.20 H new ATOM 0 HG23 VAL A 71 -1.373 1.194 -0.598 1.00 0.20 H new ATOM 475 N ILE A 72 -1.103 0.204 4.491 1.00 0.14 N ATOM 476 CA ILE A 72 -0.499 0.184 5.817 1.00 0.17 C ATOM 477 C ILE A 72 0.239 -1.125 6.059 1.00 0.22 C ATOM 478 O ILE A 72 1.111 -1.211 6.924 1.00 0.29 O ATOM 479 CB ILE A 72 -1.558 0.369 6.917 1.00 0.18 C ATOM 480 CG1 ILE A 72 -2.702 -0.625 6.706 1.00 0.19 C ATOM 481 CG2 ILE A 72 -2.067 1.802 6.918 1.00 0.19 C ATOM 482 CD1 ILE A 72 -3.660 -0.724 7.869 1.00 0.21 C ATOM 0 H ILE A 72 -2.003 -0.272 4.434 1.00 0.14 H new ATOM 0 HA ILE A 72 0.207 1.013 5.858 1.00 0.17 H new ATOM 0 HB ILE A 72 -1.108 0.172 7.890 1.00 0.18 H new ATOM 0 HG12 ILE A 72 -3.259 -0.336 5.815 1.00 0.19 H new ATOM 0 HG13 ILE A 72 -2.280 -1.611 6.513 1.00 0.19 H new ATOM 0 HG21 ILE A 72 -2.816 1.921 7.701 1.00 0.19 H new ATOM 0 HG22 ILE A 72 -1.236 2.483 7.104 1.00 0.19 H new ATOM 0 HG23 ILE A 72 -2.514 2.030 5.950 1.00 0.19 H new ATOM 0 HD11 ILE A 72 -4.440 -1.450 7.637 1.00 0.21 H new ATOM 0 HD12 ILE A 72 -3.119 -1.044 8.760 1.00 0.21 H new ATOM 0 HD13 ILE A 72 -4.114 0.250 8.051 1.00 0.21 H new ATOM 494 N LYS A 73 -0.127 -2.141 5.295 1.00 0.21 N ATOM 495 CA LYS A 73 0.529 -3.437 5.367 1.00 0.26 C ATOM 496 C LYS A 73 0.657 -4.045 3.974 1.00 0.24 C ATOM 497 O LYS A 73 -0.232 -3.883 3.139 1.00 0.25 O ATOM 498 CB LYS A 73 -0.254 -4.377 6.285 1.00 0.35 C ATOM 499 CG LYS A 73 0.159 -5.837 6.161 1.00 0.41 C ATOM 500 CD LYS A 73 -0.577 -6.717 7.151 1.00 0.59 C ATOM 501 CE LYS A 73 -0.222 -6.363 8.585 1.00 1.22 C ATOM 502 NZ LYS A 73 -1.058 -7.104 9.562 1.00 1.94 N ATOM 0 H LYS A 73 -0.882 -2.092 4.611 1.00 0.21 H new ATOM 0 HA LYS A 73 1.528 -3.298 5.779 1.00 0.26 H new ATOM 0 HB2 LYS A 73 -0.120 -4.057 7.318 1.00 0.35 H new ATOM 0 HB3 LYS A 73 -1.317 -4.289 6.060 1.00 0.35 H new ATOM 0 HG2 LYS A 73 -0.039 -6.186 5.148 1.00 0.41 H new ATOM 0 HG3 LYS A 73 1.233 -5.926 6.324 1.00 0.41 H new ATOM 0 HD2 LYS A 73 -1.652 -6.610 7.005 1.00 0.59 H new ATOM 0 HD3 LYS A 73 -0.332 -7.762 6.962 1.00 0.59 H new ATOM 0 HE2 LYS A 73 0.830 -6.586 8.764 1.00 1.22 H new ATOM 0 HE3 LYS A 73 -0.350 -5.291 8.737 1.00 1.22 H new ATOM 0 HZ1 LYS A 73 -0.784 -6.834 10.528 1.00 1.94 H new ATOM 0 HZ2 LYS A 73 -2.060 -6.872 9.408 1.00 1.94 H new ATOM 0 HZ3 LYS A 73 -0.916 -8.126 9.435 1.00 1.94 H new ATOM 516 N ILE A 74 1.757 -4.745 3.736 1.00 0.28 N ATOM 517 CA ILE A 74 1.991 -5.395 2.451 1.00 0.31 C ATOM 518 C ILE A 74 2.321 -6.862 2.673 1.00 0.38 C ATOM 519 O ILE A 74 3.010 -7.209 3.633 1.00 0.41 O ATOM 520 CB ILE A 74 3.169 -4.783 1.660 1.00 0.35 C ATOM 521 CG1 ILE A 74 3.194 -3.255 1.723 1.00 0.38 C ATOM 522 CG2 ILE A 74 3.096 -5.239 0.211 1.00 0.40 C ATOM 523 CD1 ILE A 74 4.492 -2.668 1.217 1.00 0.44 C ATOM 0 H ILE A 74 2.504 -4.879 4.417 1.00 0.28 H new ATOM 0 HA ILE A 74 1.076 -5.257 1.876 1.00 0.31 H new ATOM 0 HB ILE A 74 4.090 -5.135 2.124 1.00 0.35 H new ATOM 0 HG12 ILE A 74 2.367 -2.858 1.134 1.00 0.38 H new ATOM 0 HG13 ILE A 74 3.033 -2.936 2.753 1.00 0.38 H new ATOM 0 HG21 ILE A 74 3.926 -4.808 -0.348 1.00 0.40 H new ATOM 0 HG22 ILE A 74 3.155 -6.327 0.168 1.00 0.40 H new ATOM 0 HG23 ILE A 74 2.154 -4.910 -0.227 1.00 0.40 H new ATOM 0 HD11 ILE A 74 4.451 -1.581 1.286 1.00 0.44 H new ATOM 0 HD12 ILE A 74 5.319 -3.039 1.822 1.00 0.44 H new ATOM 0 HD13 ILE A 74 4.643 -2.960 0.178 1.00 0.44 H new ATOM 535 N THR A 75 1.832 -7.719 1.794 1.00 0.45 N ATOM 536 CA THR A 75 2.174 -9.130 1.824 1.00 0.54 C ATOM 537 C THR A 75 2.291 -9.648 0.397 1.00 0.60 C ATOM 538 O THR A 75 2.190 -8.875 -0.556 1.00 0.71 O ATOM 539 CB THR A 75 1.118 -9.966 2.585 1.00 0.69 C ATOM 540 OG1 THR A 75 -0.166 -9.820 1.964 1.00 0.79 O ATOM 541 CG2 THR A 75 1.024 -9.558 4.052 1.00 0.72 C ATOM 0 H THR A 75 1.191 -7.459 1.044 1.00 0.45 H new ATOM 0 HA THR A 75 3.123 -9.233 2.350 1.00 0.54 H new ATOM 0 HB THR A 75 1.433 -11.009 2.543 1.00 0.69 H new ATOM 0 HG1 THR A 75 -0.870 -9.974 2.628 1.00 0.79 H new ATOM 0 HG21 THR A 75 0.272 -10.168 4.552 1.00 0.72 H new ATOM 0 HG22 THR A 75 1.990 -9.707 4.534 1.00 0.72 H new ATOM 0 HG23 THR A 75 0.743 -8.507 4.120 1.00 0.72 H new ATOM 549 N ASP A 76 2.508 -10.943 0.234 1.00 0.70 N ATOM 550 CA ASP A 76 2.495 -11.535 -1.093 1.00 0.82 C ATOM 551 C ASP A 76 1.066 -11.889 -1.504 1.00 0.90 C ATOM 552 O ASP A 76 0.822 -12.356 -2.615 1.00 1.08 O ATOM 553 CB ASP A 76 3.414 -12.760 -1.166 1.00 1.00 C ATOM 554 CG ASP A 76 3.072 -13.829 -0.155 1.00 1.46 C ATOM 555 OD1 ASP A 76 3.509 -13.708 1.013 1.00 2.15 O ATOM 556 OD2 ASP A 76 2.386 -14.803 -0.523 1.00 2.01 O ATOM 0 H ASP A 76 2.693 -11.597 0.994 1.00 0.70 H new ATOM 0 HA ASP A 76 2.881 -10.799 -1.798 1.00 0.82 H new ATOM 0 HB2 ASP A 76 3.359 -13.187 -2.167 1.00 1.00 H new ATOM 0 HB3 ASP A 76 4.445 -12.441 -1.012 1.00 1.00 H new ATOM 561 N GLN A 77 0.117 -11.638 -0.599 1.00 0.94 N ATOM 562 CA GLN A 77 -1.305 -11.768 -0.916 1.00 1.14 C ATOM 563 C GLN A 77 -1.839 -10.439 -1.433 1.00 1.11 C ATOM 564 O GLN A 77 -3.012 -10.317 -1.778 1.00 1.49 O ATOM 565 CB GLN A 77 -2.136 -12.185 0.307 1.00 1.36 C ATOM 566 CG GLN A 77 -1.926 -13.614 0.776 1.00 1.89 C ATOM 567 CD GLN A 77 -0.634 -13.813 1.539 1.00 2.52 C ATOM 568 OE1 GLN A 77 -0.059 -14.897 1.527 1.00 2.98 O ATOM 569 NE2 GLN A 77 -0.177 -12.776 2.221 1.00 3.19 N ATOM 0 H GLN A 77 0.309 -11.344 0.359 1.00 0.94 H new ATOM 0 HA GLN A 77 -1.396 -12.546 -1.674 1.00 1.14 H new ATOM 0 HB2 GLN A 77 -1.903 -11.511 1.131 1.00 1.36 H new ATOM 0 HB3 GLN A 77 -3.192 -12.048 0.073 1.00 1.36 H new ATOM 0 HG2 GLN A 77 -2.763 -13.907 1.410 1.00 1.89 H new ATOM 0 HG3 GLN A 77 -1.934 -14.277 -0.089 1.00 1.89 H new ATOM 0 HE21 GLN A 77 -0.685 -11.891 2.205 1.00 3.19 H new ATOM 0 HE22 GLN A 77 0.683 -12.861 2.763 1.00 3.19 H new ATOM 578 N GLY A 78 -0.969 -9.443 -1.477 1.00 0.78 N ATOM 579 CA GLY A 78 -1.377 -8.118 -1.876 1.00 0.78 C ATOM 580 C GLY A 78 -0.997 -7.093 -0.840 1.00 0.72 C ATOM 581 O GLY A 78 0.141 -7.059 -0.376 1.00 0.99 O ATOM 0 H GLY A 78 0.019 -9.532 -1.241 1.00 0.78 H new ATOM 0 HA2 GLY A 78 -0.913 -7.864 -2.829 1.00 0.78 H new ATOM 0 HA3 GLY A 78 -2.456 -8.099 -2.031 1.00 0.78 H new ATOM 585 N TYR A 79 -1.945 -6.266 -0.463 1.00 0.43 N ATOM 586 CA TYR A 79 -1.719 -5.287 0.581 1.00 0.36 C ATOM 587 C TYR A 79 -3.001 -4.988 1.316 1.00 0.28 C ATOM 588 O TYR A 79 -4.081 -5.412 0.906 1.00 0.28 O ATOM 589 CB TYR A 79 -1.147 -3.982 0.024 1.00 0.40 C ATOM 590 CG TYR A 79 -1.960 -3.359 -1.087 1.00 1.14 C ATOM 591 CD1 TYR A 79 -3.188 -2.825 -0.804 1.00 1.23 C ATOM 592 CD2 TYR A 79 -1.505 -3.301 -2.397 1.00 2.36 C ATOM 593 CE1 TYR A 79 -3.967 -2.240 -1.780 1.00 1.86 C ATOM 594 CE2 TYR A 79 -2.273 -2.720 -3.389 1.00 3.09 C ATOM 595 CZ TYR A 79 -3.399 -2.241 -3.180 1.00 2.67 C ATOM 596 OH TYR A 79 -4.271 -1.601 -4.054 1.00 3.47 O ATOM 0 H TYR A 79 -2.883 -6.250 -0.863 1.00 0.43 H new ATOM 0 HA TYR A 79 -0.991 -5.719 1.268 1.00 0.36 H new ATOM 0 HB2 TYR A 79 -1.059 -3.263 0.838 1.00 0.40 H new ATOM 0 HB3 TYR A 79 -0.139 -4.171 -0.344 1.00 0.40 H new ATOM 0 HD1 TYR A 79 -3.557 -2.863 0.210 1.00 1.23 H new ATOM 0 HD2 TYR A 79 -0.539 -3.715 -2.645 1.00 2.36 H new ATOM 0 HE1 TYR A 79 -4.930 -1.805 -1.556 1.00 1.86 H new ATOM 0 HE2 TYR A 79 -1.875 -2.681 -4.392 1.00 3.09 H new ATOM 0 HH TYR A 79 -5.190 -1.880 -3.862 1.00 3.47 H new ATOM 606 N VAL A 80 -2.878 -4.249 2.393 1.00 0.29 N ATOM 607 CA VAL A 80 -4.031 -3.796 3.126 1.00 0.27 C ATOM 608 C VAL A 80 -3.957 -2.288 3.284 1.00 0.21 C ATOM 609 O VAL A 80 -2.993 -1.763 3.842 1.00 0.19 O ATOM 610 CB VAL A 80 -4.131 -4.468 4.515 1.00 0.28 C ATOM 611 CG1 VAL A 80 -5.485 -4.206 5.157 1.00 0.28 C ATOM 612 CG2 VAL A 80 -3.862 -5.962 4.411 1.00 0.40 C ATOM 0 H VAL A 80 -1.984 -3.948 2.781 1.00 0.29 H new ATOM 0 HA VAL A 80 -4.924 -4.073 2.565 1.00 0.27 H new ATOM 0 HB VAL A 80 -3.368 -4.027 5.156 1.00 0.28 H new ATOM 0 HG11 VAL A 80 -5.525 -4.691 6.132 1.00 0.28 H new ATOM 0 HG12 VAL A 80 -5.628 -3.132 5.279 1.00 0.28 H new ATOM 0 HG13 VAL A 80 -6.273 -4.607 4.520 1.00 0.28 H new ATOM 0 HG21 VAL A 80 -3.937 -6.415 5.400 1.00 0.40 H new ATOM 0 HG22 VAL A 80 -4.595 -6.418 3.746 1.00 0.40 H new ATOM 0 HG23 VAL A 80 -2.860 -6.125 4.013 1.00 0.40 H new ATOM 622 N THR A 81 -4.954 -1.592 2.772 1.00 0.22 N ATOM 623 CA THR A 81 -4.958 -0.144 2.814 1.00 0.22 C ATOM 624 C THR A 81 -5.901 0.370 3.883 1.00 0.22 C ATOM 625 O THR A 81 -7.021 -0.112 4.018 1.00 0.35 O ATOM 626 CB THR A 81 -5.388 0.459 1.465 1.00 0.32 C ATOM 627 OG1 THR A 81 -6.652 -0.083 1.069 1.00 0.36 O ATOM 628 CG2 THR A 81 -4.356 0.185 0.389 1.00 0.40 C ATOM 0 H THR A 81 -5.771 -2.006 2.323 1.00 0.22 H new ATOM 0 HA THR A 81 -3.937 0.161 3.041 1.00 0.22 H new ATOM 0 HB THR A 81 -5.475 1.538 1.590 1.00 0.32 H new ATOM 0 HG1 THR A 81 -6.510 -0.812 0.430 1.00 0.36 H new ATOM 0 HG21 THR A 81 -4.687 0.623 -0.553 1.00 0.40 H new ATOM 0 HG22 THR A 81 -3.402 0.626 0.679 1.00 0.40 H new ATOM 0 HG23 THR A 81 -4.235 -0.891 0.266 1.00 0.40 H new ATOM 636 N SER A 82 -5.446 1.346 4.637 1.00 0.19 N ATOM 637 CA SER A 82 -6.304 2.042 5.564 1.00 0.20 C ATOM 638 C SER A 82 -6.922 3.224 4.836 1.00 0.24 C ATOM 639 O SER A 82 -6.362 4.322 4.832 1.00 0.29 O ATOM 640 CB SER A 82 -5.492 2.512 6.773 1.00 0.25 C ATOM 641 OG SER A 82 -6.305 3.181 7.717 1.00 1.19 O ATOM 0 H SER A 82 -4.481 1.675 4.624 1.00 0.19 H new ATOM 0 HA SER A 82 -7.092 1.382 5.928 1.00 0.20 H new ATOM 0 HB2 SER A 82 -5.014 1.655 7.246 1.00 0.25 H new ATOM 0 HB3 SER A 82 -4.696 3.178 6.441 1.00 0.25 H new ATOM 0 HG SER A 82 -6.862 2.528 8.190 1.00 1.19 H new ATOM 647 N HIS A 83 -8.067 3.003 4.211 1.00 0.24 N ATOM 648 CA HIS A 83 -8.656 4.030 3.378 1.00 0.30 C ATOM 649 C HIS A 83 -10.098 4.307 3.786 1.00 0.29 C ATOM 650 O HIS A 83 -10.795 3.427 4.298 1.00 0.27 O ATOM 651 CB HIS A 83 -8.525 3.673 1.877 1.00 0.33 C ATOM 652 CG HIS A 83 -9.555 2.724 1.333 1.00 0.32 C ATOM 653 ND1 HIS A 83 -10.001 2.740 0.012 1.00 0.39 N ATOM 654 CD2 HIS A 83 -10.272 1.757 1.955 1.00 0.28 C ATOM 655 CE1 HIS A 83 -10.966 1.811 -0.106 1.00 0.39 C ATOM 656 NE2 HIS A 83 -11.151 1.228 1.042 1.00 0.33 N ATOM 0 H HIS A 83 -8.598 2.134 4.265 1.00 0.24 H new ATOM 0 HA HIS A 83 -8.101 4.955 3.532 1.00 0.30 H new ATOM 0 HB2 HIS A 83 -8.569 4.596 1.299 1.00 0.33 H new ATOM 0 HB3 HIS A 83 -7.538 3.241 1.712 1.00 0.33 H new ATOM 0 HD1 HIS A 83 -9.657 3.348 -0.732 1.00 0.39 H new ATOM 0 HD2 HIS A 83 -10.170 1.455 2.987 1.00 0.28 H new ATOM 0 HE1 HIS A 83 -11.505 1.584 -1.014 1.00 0.39 H new ATOM 664 N GLY A 84 -10.521 5.549 3.593 1.00 0.35 N ATOM 665 CA GLY A 84 -11.862 5.945 3.963 1.00 0.36 C ATOM 666 C GLY A 84 -12.042 5.987 5.462 1.00 0.36 C ATOM 667 O GLY A 84 -11.813 7.009 6.098 1.00 0.42 O ATOM 0 H GLY A 84 -9.954 6.292 3.184 1.00 0.35 H new ATOM 0 HA2 GLY A 84 -12.080 6.927 3.543 1.00 0.36 H new ATOM 0 HA3 GLY A 84 -12.579 5.247 3.530 1.00 0.36 H new ATOM 671 N ASP A 85 -12.459 4.866 6.013 1.00 0.33 N ATOM 672 CA ASP A 85 -12.670 4.731 7.449 1.00 0.36 C ATOM 673 C ASP A 85 -12.021 3.458 7.974 1.00 0.33 C ATOM 674 O ASP A 85 -11.636 3.372 9.141 1.00 0.38 O ATOM 675 CB ASP A 85 -14.175 4.705 7.737 1.00 0.42 C ATOM 676 CG ASP A 85 -14.510 4.255 9.148 1.00 0.89 C ATOM 677 OD1 ASP A 85 -14.632 3.032 9.373 1.00 1.59 O ATOM 678 OD2 ASP A 85 -14.628 5.121 10.046 1.00 0.85 O ATOM 0 H ASP A 85 -12.663 4.019 5.482 1.00 0.33 H new ATOM 0 HA ASP A 85 -12.211 5.581 7.954 1.00 0.36 H new ATOM 0 HB2 ASP A 85 -14.586 5.701 7.574 1.00 0.42 H new ATOM 0 HB3 ASP A 85 -14.662 4.039 7.025 1.00 0.42 H new ATOM 683 N HIS A 86 -11.857 2.490 7.091 1.00 0.29 N ATOM 684 CA HIS A 86 -11.536 1.135 7.495 1.00 0.27 C ATOM 685 C HIS A 86 -10.238 0.647 6.883 1.00 0.23 C ATOM 686 O HIS A 86 -9.580 1.357 6.124 1.00 0.21 O ATOM 687 CB HIS A 86 -12.676 0.199 7.085 1.00 0.29 C ATOM 688 CG HIS A 86 -13.058 0.301 5.633 1.00 0.27 C ATOM 689 ND1 HIS A 86 -14.342 0.604 5.191 1.00 0.30 N ATOM 690 CD2 HIS A 86 -12.309 0.097 4.510 1.00 0.26 C ATOM 691 CE1 HIS A 86 -14.335 0.566 3.846 1.00 0.30 C ATOM 692 NE2 HIS A 86 -13.144 0.253 3.414 1.00 0.28 N ATOM 0 H HIS A 86 -11.942 2.619 6.083 1.00 0.29 H new ATOM 0 HA HIS A 86 -11.411 1.134 8.578 1.00 0.27 H new ATOM 0 HB2 HIS A 86 -12.385 -0.829 7.302 1.00 0.29 H new ATOM 0 HB3 HIS A 86 -13.551 0.419 7.697 1.00 0.29 H new ATOM 0 HD1 HIS A 86 -15.146 0.817 5.782 1.00 0.30 H new ATOM 0 HD2 HIS A 86 -11.256 -0.143 4.481 1.00 0.26 H new ATOM 0 HE1 HIS A 86 -15.190 0.765 3.216 1.00 0.30 H new ATOM 700 N TYR A 87 -9.875 -0.571 7.240 1.00 0.24 N ATOM 701 CA TYR A 87 -8.770 -1.252 6.604 1.00 0.22 C ATOM 702 C TYR A 87 -9.334 -2.157 5.528 1.00 0.22 C ATOM 703 O TYR A 87 -10.262 -2.927 5.783 1.00 0.26 O ATOM 704 CB TYR A 87 -7.970 -2.072 7.620 1.00 0.25 C ATOM 705 CG TYR A 87 -7.487 -1.264 8.799 1.00 0.29 C ATOM 706 CD1 TYR A 87 -7.087 0.048 8.632 1.00 0.27 C ATOM 707 CD2 TYR A 87 -7.440 -1.806 10.076 1.00 0.38 C ATOM 708 CE1 TYR A 87 -6.654 0.804 9.692 1.00 0.32 C ATOM 709 CE2 TYR A 87 -7.003 -1.055 11.149 1.00 0.43 C ATOM 710 CZ TYR A 87 -6.612 0.251 10.951 1.00 0.40 C ATOM 711 OH TYR A 87 -6.183 1.010 12.015 1.00 0.46 O ATOM 0 H TYR A 87 -10.336 -1.110 7.973 1.00 0.24 H new ATOM 0 HA TYR A 87 -8.090 -0.520 6.169 1.00 0.22 H new ATOM 0 HB2 TYR A 87 -8.590 -2.893 7.981 1.00 0.25 H new ATOM 0 HB3 TYR A 87 -7.111 -2.518 7.119 1.00 0.25 H new ATOM 0 HD1 TYR A 87 -7.116 0.488 7.646 1.00 0.27 H new ATOM 0 HD2 TYR A 87 -7.749 -2.829 10.232 1.00 0.38 H new ATOM 0 HE1 TYR A 87 -6.348 1.828 9.539 1.00 0.32 H new ATOM 0 HE2 TYR A 87 -6.968 -1.489 12.137 1.00 0.43 H new ATOM 0 HH TYR A 87 -6.214 0.472 12.834 1.00 0.46 H new ATOM 721 N HIS A 88 -8.791 -2.063 4.336 1.00 0.21 N ATOM 722 CA HIS A 88 -9.300 -2.826 3.221 1.00 0.25 C ATOM 723 C HIS A 88 -8.187 -3.671 2.620 1.00 0.26 C ATOM 724 O HIS A 88 -7.119 -3.161 2.283 1.00 0.28 O ATOM 725 CB HIS A 88 -9.911 -1.889 2.171 1.00 0.29 C ATOM 726 CG HIS A 88 -11.007 -2.535 1.385 1.00 0.35 C ATOM 727 ND1 HIS A 88 -12.187 -1.906 1.107 1.00 0.38 N ATOM 728 CD2 HIS A 88 -11.075 -3.788 0.868 1.00 0.43 C ATOM 729 CE1 HIS A 88 -12.952 -2.745 0.458 1.00 0.47 C ATOM 730 NE2 HIS A 88 -12.319 -3.920 0.281 1.00 0.51 N ATOM 0 H HIS A 88 -7.995 -1.464 4.114 1.00 0.21 H new ATOM 0 HA HIS A 88 -10.086 -3.495 3.573 1.00 0.25 H new ATOM 0 HB2 HIS A 88 -10.301 -1.000 2.667 1.00 0.29 H new ATOM 0 HB3 HIS A 88 -9.129 -1.556 1.489 1.00 0.29 H new ATOM 0 HD2 HIS A 88 -10.302 -4.541 0.908 1.00 0.43 H new ATOM 0 HE1 HIS A 88 -13.952 -2.526 0.112 1.00 0.47 H new ATOM 0 HE2 HIS A 88 -12.686 -4.745 -0.193 1.00 0.51 H new ATOM 738 N TYR A 89 -8.433 -4.967 2.518 1.00 0.28 N ATOM 739 CA TYR A 89 -7.436 -5.905 2.026 1.00 0.31 C ATOM 740 C TYR A 89 -7.591 -6.098 0.517 1.00 0.36 C ATOM 741 O TYR A 89 -8.680 -6.412 0.038 1.00 0.44 O ATOM 742 CB TYR A 89 -7.603 -7.246 2.751 1.00 0.45 C ATOM 743 CG TYR A 89 -6.327 -8.045 2.897 1.00 0.45 C ATOM 744 CD1 TYR A 89 -5.423 -8.157 1.854 1.00 0.45 C ATOM 745 CD2 TYR A 89 -6.034 -8.700 4.086 1.00 0.59 C ATOM 746 CE1 TYR A 89 -4.267 -8.887 1.982 1.00 0.50 C ATOM 747 CE2 TYR A 89 -4.873 -9.435 4.226 1.00 0.62 C ATOM 748 CZ TYR A 89 -3.990 -9.526 3.170 1.00 0.53 C ATOM 749 OH TYR A 89 -2.829 -10.256 3.305 1.00 0.60 O ATOM 0 H TYR A 89 -9.323 -5.397 2.772 1.00 0.28 H new ATOM 0 HA TYR A 89 -6.439 -5.509 2.222 1.00 0.31 H new ATOM 0 HB2 TYR A 89 -8.015 -7.059 3.743 1.00 0.45 H new ATOM 0 HB3 TYR A 89 -8.334 -7.848 2.211 1.00 0.45 H new ATOM 0 HD1 TYR A 89 -5.632 -7.659 0.919 1.00 0.45 H new ATOM 0 HD2 TYR A 89 -6.724 -8.634 4.914 1.00 0.59 H new ATOM 0 HE1 TYR A 89 -3.578 -8.960 1.154 1.00 0.50 H new ATOM 0 HE2 TYR A 89 -4.657 -9.936 5.158 1.00 0.62 H new ATOM 0 HH TYR A 89 -2.997 -11.035 3.876 1.00 0.60 H new ATOM 759 N TYR A 90 -6.507 -5.902 -0.228 1.00 0.45 N ATOM 760 CA TYR A 90 -6.528 -6.084 -1.676 1.00 0.69 C ATOM 761 C TYR A 90 -5.594 -7.223 -2.071 1.00 0.55 C ATOM 762 O TYR A 90 -4.831 -7.720 -1.248 1.00 0.47 O ATOM 763 CB TYR A 90 -6.097 -4.821 -2.430 1.00 1.04 C ATOM 764 CG TYR A 90 -6.914 -3.569 -2.179 1.00 0.95 C ATOM 765 CD1 TYR A 90 -7.367 -3.283 -0.898 1.00 1.32 C ATOM 766 CD2 TYR A 90 -7.259 -2.700 -3.201 1.00 1.70 C ATOM 767 CE1 TYR A 90 -8.132 -2.165 -0.645 1.00 2.07 C ATOM 768 CE2 TYR A 90 -8.024 -1.582 -2.957 1.00 2.40 C ATOM 769 CZ TYR A 90 -8.362 -1.240 -1.755 1.00 2.47 C ATOM 770 OH TYR A 90 -9.222 -0.202 -1.443 1.00 3.42 O ATOM 0 H TYR A 90 -5.602 -5.617 0.147 1.00 0.45 H new ATOM 0 HA TYR A 90 -7.558 -6.313 -1.950 1.00 0.69 H new ATOM 0 HB2 TYR A 90 -5.059 -4.608 -2.173 1.00 1.04 H new ATOM 0 HB3 TYR A 90 -6.123 -5.036 -3.498 1.00 1.04 H new ATOM 0 HD1 TYR A 90 -7.115 -3.949 -0.085 1.00 1.32 H new ATOM 0 HD2 TYR A 90 -6.922 -2.903 -4.207 1.00 1.70 H new ATOM 0 HE1 TYR A 90 -8.546 -1.979 0.335 1.00 2.07 H new ATOM 0 HE2 TYR A 90 -8.350 -0.975 -3.789 1.00 2.40 H new ATOM 0 HH TYR A 90 -10.035 -0.563 -1.032 1.00 3.42 H new ATOM 780 N ASN A 91 -5.652 -7.618 -3.335 1.00 0.67 N ATOM 781 CA ASN A 91 -4.842 -8.724 -3.839 1.00 0.59 C ATOM 782 C ASN A 91 -3.923 -8.240 -4.953 1.00 0.49 C ATOM 783 O ASN A 91 -4.221 -7.251 -5.625 1.00 0.69 O ATOM 784 CB ASN A 91 -5.755 -9.826 -4.381 1.00 0.85 C ATOM 785 CG ASN A 91 -5.029 -11.114 -4.732 1.00 1.27 C ATOM 786 OD1 ASN A 91 -5.376 -11.783 -5.706 1.00 1.58 O ATOM 787 ND2 ASN A 91 -4.051 -11.493 -3.932 1.00 2.04 N ATOM 0 H ASN A 91 -6.255 -7.187 -4.036 1.00 0.67 H new ATOM 0 HA ASN A 91 -4.237 -9.116 -3.021 1.00 0.59 H new ATOM 0 HB2 ASN A 91 -6.523 -10.045 -3.639 1.00 0.85 H new ATOM 0 HB3 ASN A 91 -6.266 -9.456 -5.270 1.00 0.85 H new ATOM 0 HD21 ASN A 91 -3.555 -12.366 -4.111 1.00 2.04 H new ATOM 0 HD22 ASN A 91 -3.791 -10.913 -3.134 1.00 2.04 H new ATOM 794 N GLY A 92 -2.815 -8.939 -5.144 1.00 0.40 N ATOM 795 CA GLY A 92 -1.914 -8.634 -6.238 1.00 0.41 C ATOM 796 C GLY A 92 -0.821 -7.647 -5.871 1.00 0.33 C ATOM 797 O GLY A 92 -0.411 -7.550 -4.712 1.00 0.47 O ATOM 0 H GLY A 92 -2.521 -9.719 -4.556 1.00 0.40 H new ATOM 0 HA2 GLY A 92 -1.454 -9.559 -6.587 1.00 0.41 H new ATOM 0 HA3 GLY A 92 -2.491 -8.231 -7.070 1.00 0.41 H new ATOM 801 N LYS A 93 -0.346 -6.929 -6.876 1.00 0.40 N ATOM 802 CA LYS A 93 0.711 -5.942 -6.709 1.00 0.35 C ATOM 803 C LYS A 93 0.134 -4.593 -6.294 1.00 0.35 C ATOM 804 O LYS A 93 -1.060 -4.340 -6.446 1.00 0.47 O ATOM 805 CB LYS A 93 1.475 -5.778 -8.023 1.00 0.36 C ATOM 806 CG LYS A 93 2.169 -7.035 -8.485 1.00 0.39 C ATOM 807 CD LYS A 93 3.662 -6.925 -8.263 1.00 0.63 C ATOM 808 CE LYS A 93 4.339 -8.254 -8.459 1.00 1.42 C ATOM 809 NZ LYS A 93 4.109 -8.819 -9.817 1.00 2.03 N ATOM 0 H LYS A 93 -0.683 -7.014 -7.835 1.00 0.40 H new ATOM 0 HA LYS A 93 1.385 -6.292 -5.927 1.00 0.35 H new ATOM 0 HB2 LYS A 93 0.781 -5.452 -8.798 1.00 0.36 H new ATOM 0 HB3 LYS A 93 2.216 -4.987 -7.905 1.00 0.36 H new ATOM 0 HG2 LYS A 93 1.777 -7.895 -7.942 1.00 0.39 H new ATOM 0 HG3 LYS A 93 1.963 -7.204 -9.542 1.00 0.39 H new ATOM 0 HD2 LYS A 93 4.082 -6.194 -8.954 1.00 0.63 H new ATOM 0 HD3 LYS A 93 3.857 -6.560 -7.255 1.00 0.63 H new ATOM 0 HE2 LYS A 93 5.410 -8.140 -8.294 1.00 1.42 H new ATOM 0 HE3 LYS A 93 3.974 -8.957 -7.710 1.00 1.42 H new ATOM 0 HZ1 LYS A 93 4.740 -9.632 -9.966 1.00 2.03 H new ATOM 0 HZ2 LYS A 93 3.120 -9.128 -9.901 1.00 2.03 H new ATOM 0 HZ3 LYS A 93 4.307 -8.092 -10.534 1.00 2.03 H new ATOM 823 N VAL A 94 0.992 -3.735 -5.766 1.00 0.31 N ATOM 824 CA VAL A 94 0.616 -2.365 -5.462 1.00 0.29 C ATOM 825 C VAL A 94 0.576 -1.565 -6.759 1.00 0.28 C ATOM 826 O VAL A 94 1.538 -1.594 -7.526 1.00 0.30 O ATOM 827 CB VAL A 94 1.628 -1.713 -4.494 1.00 0.29 C ATOM 828 CG1 VAL A 94 1.154 -0.336 -4.067 1.00 0.32 C ATOM 829 CG2 VAL A 94 1.859 -2.595 -3.278 1.00 0.41 C ATOM 0 H VAL A 94 1.959 -3.966 -5.538 1.00 0.31 H new ATOM 0 HA VAL A 94 -0.363 -2.369 -4.984 1.00 0.29 H new ATOM 0 HB VAL A 94 2.575 -1.603 -5.022 1.00 0.29 H new ATOM 0 HG11 VAL A 94 1.882 0.104 -3.386 1.00 0.32 H new ATOM 0 HG12 VAL A 94 1.048 0.301 -4.945 1.00 0.32 H new ATOM 0 HG13 VAL A 94 0.191 -0.423 -3.563 1.00 0.32 H new ATOM 0 HG21 VAL A 94 2.575 -2.115 -2.611 1.00 0.41 H new ATOM 0 HG22 VAL A 94 0.916 -2.743 -2.752 1.00 0.41 H new ATOM 0 HG23 VAL A 94 2.252 -3.560 -3.598 1.00 0.41 H new ATOM 839 N PRO A 95 -0.531 -0.862 -7.044 1.00 0.27 N ATOM 840 CA PRO A 95 -0.667 -0.111 -8.284 1.00 0.28 C ATOM 841 C PRO A 95 0.245 1.094 -8.321 1.00 0.25 C ATOM 842 O PRO A 95 0.641 1.598 -7.267 1.00 0.27 O ATOM 843 CB PRO A 95 -2.121 0.335 -8.303 1.00 0.33 C ATOM 844 CG PRO A 95 -2.554 0.315 -6.885 1.00 0.33 C ATOM 845 CD PRO A 95 -1.716 -0.725 -6.184 1.00 0.30 C ATOM 0 HA PRO A 95 -0.393 -0.719 -9.146 1.00 0.28 H new ATOM 0 HB2 PRO A 95 -2.221 1.332 -8.731 1.00 0.33 H new ATOM 0 HB3 PRO A 95 -2.730 -0.335 -8.910 1.00 0.33 H new ATOM 0 HG2 PRO A 95 -2.417 1.294 -6.426 1.00 0.33 H new ATOM 0 HG3 PRO A 95 -3.614 0.072 -6.809 1.00 0.33 H new ATOM 0 HD2 PRO A 95 -1.445 -0.407 -5.177 1.00 0.30 H new ATOM 0 HD3 PRO A 95 -2.251 -1.670 -6.087 1.00 0.30 H new ATOM 853 N TYR A 96 0.568 1.552 -9.512 1.00 0.26 N ATOM 854 CA TYR A 96 1.555 2.608 -9.685 1.00 0.27 C ATOM 855 C TYR A 96 1.232 3.820 -8.797 1.00 0.26 C ATOM 856 O TYR A 96 2.114 4.376 -8.143 1.00 0.30 O ATOM 857 CB TYR A 96 1.621 3.025 -11.162 1.00 0.33 C ATOM 858 CG TYR A 96 2.952 3.627 -11.575 1.00 0.38 C ATOM 859 CD1 TYR A 96 3.491 4.699 -10.888 1.00 0.30 C ATOM 860 CD2 TYR A 96 3.666 3.120 -12.655 1.00 0.61 C ATOM 861 CE1 TYR A 96 4.698 5.252 -11.255 1.00 0.35 C ATOM 862 CE2 TYR A 96 4.879 3.668 -13.029 1.00 0.68 C ATOM 863 CZ TYR A 96 5.390 4.737 -12.322 1.00 0.51 C ATOM 864 OH TYR A 96 6.597 5.295 -12.679 1.00 0.59 O ATOM 0 H TYR A 96 0.161 1.210 -10.382 1.00 0.26 H new ATOM 0 HA TYR A 96 2.528 2.223 -9.380 1.00 0.27 H new ATOM 0 HB2 TYR A 96 1.420 2.153 -11.784 1.00 0.33 H new ATOM 0 HB3 TYR A 96 0.830 3.748 -11.360 1.00 0.33 H new ATOM 0 HD1 TYR A 96 2.955 5.111 -10.046 1.00 0.30 H new ATOM 0 HD2 TYR A 96 3.267 2.285 -13.211 1.00 0.61 H new ATOM 0 HE1 TYR A 96 5.099 6.090 -10.704 1.00 0.35 H new ATOM 0 HE2 TYR A 96 5.423 3.262 -13.869 1.00 0.68 H new ATOM 0 HH TYR A 96 6.962 4.817 -13.453 1.00 0.59 H new ATOM 874 N ASP A 97 -0.040 4.186 -8.728 1.00 0.28 N ATOM 875 CA ASP A 97 -0.436 5.423 -8.060 1.00 0.33 C ATOM 876 C ASP A 97 -0.999 5.172 -6.649 1.00 0.32 C ATOM 877 O ASP A 97 -1.701 6.014 -6.090 1.00 0.38 O ATOM 878 CB ASP A 97 -1.448 6.163 -8.927 1.00 0.43 C ATOM 879 CG ASP A 97 -1.721 7.583 -8.468 1.00 1.07 C ATOM 880 OD1 ASP A 97 -0.793 8.419 -8.504 1.00 1.82 O ATOM 881 OD2 ASP A 97 -2.874 7.877 -8.089 1.00 1.07 O ATOM 0 H ASP A 97 -0.813 3.650 -9.123 1.00 0.28 H new ATOM 0 HA ASP A 97 0.454 6.039 -7.931 1.00 0.33 H new ATOM 0 HB2 ASP A 97 -1.085 6.186 -9.954 1.00 0.43 H new ATOM 0 HB3 ASP A 97 -2.385 5.606 -8.932 1.00 0.43 H new ATOM 886 N ALA A 98 -0.694 4.013 -6.069 1.00 0.27 N ATOM 887 CA ALA A 98 -1.147 3.703 -4.709 1.00 0.27 C ATOM 888 C ALA A 98 -0.437 4.555 -3.662 1.00 0.26 C ATOM 889 O ALA A 98 0.683 5.023 -3.870 1.00 0.40 O ATOM 890 CB ALA A 98 -0.935 2.237 -4.390 1.00 0.30 C ATOM 0 H ALA A 98 -0.141 3.278 -6.511 1.00 0.27 H new ATOM 0 HA ALA A 98 -2.212 3.933 -4.674 1.00 0.27 H new ATOM 0 HB1 ALA A 98 -1.279 2.032 -3.376 1.00 0.30 H new ATOM 0 HB2 ALA A 98 -1.499 1.626 -5.095 1.00 0.30 H new ATOM 0 HB3 ALA A 98 0.125 1.997 -4.469 1.00 0.30 H new ATOM 896 N ILE A 99 -1.109 4.739 -2.533 1.00 0.18 N ATOM 897 CA ILE A 99 -0.577 5.508 -1.421 1.00 0.17 C ATOM 898 C ILE A 99 -0.079 4.564 -0.330 1.00 0.16 C ATOM 899 O ILE A 99 -0.664 3.508 -0.108 1.00 0.16 O ATOM 900 CB ILE A 99 -1.659 6.439 -0.845 1.00 0.21 C ATOM 901 CG1 ILE A 99 -2.276 7.273 -1.967 1.00 0.21 C ATOM 902 CG2 ILE A 99 -1.082 7.340 0.234 1.00 0.26 C ATOM 903 CD1 ILE A 99 -1.305 8.217 -2.638 1.00 0.29 C ATOM 0 H ILE A 99 -2.040 4.358 -2.365 1.00 0.18 H new ATOM 0 HA ILE A 99 0.253 6.115 -1.783 1.00 0.17 H new ATOM 0 HB ILE A 99 -2.437 5.827 -0.388 1.00 0.21 H new ATOM 0 HG12 ILE A 99 -2.692 6.601 -2.718 1.00 0.21 H new ATOM 0 HG13 ILE A 99 -3.107 7.851 -1.561 1.00 0.21 H new ATOM 0 HG21 ILE A 99 -1.867 7.988 0.625 1.00 0.26 H new ATOM 0 HG22 ILE A 99 -0.680 6.729 1.042 1.00 0.26 H new ATOM 0 HG23 ILE A 99 -0.285 7.951 -0.190 1.00 0.26 H new ATOM 0 HD11 ILE A 99 -1.820 8.772 -3.422 1.00 0.29 H new ATOM 0 HD12 ILE A 99 -0.908 8.915 -1.901 1.00 0.29 H new ATOM 0 HD13 ILE A 99 -0.486 7.646 -3.076 1.00 0.29 H new ATOM 915 N ILE A 100 1.007 4.929 0.331 1.00 0.17 N ATOM 916 CA ILE A 100 1.611 4.077 1.338 1.00 0.18 C ATOM 917 C ILE A 100 1.636 4.765 2.705 1.00 0.18 C ATOM 918 O ILE A 100 1.632 5.995 2.803 1.00 0.20 O ATOM 919 CB ILE A 100 3.057 3.714 0.938 1.00 0.20 C ATOM 920 CG1 ILE A 100 3.101 3.196 -0.503 1.00 0.21 C ATOM 921 CG2 ILE A 100 3.631 2.675 1.892 1.00 0.22 C ATOM 922 CD1 ILE A 100 2.423 1.857 -0.693 1.00 0.23 C ATOM 0 H ILE A 100 1.490 5.816 0.186 1.00 0.17 H new ATOM 0 HA ILE A 100 1.006 3.173 1.406 1.00 0.18 H new ATOM 0 HB ILE A 100 3.667 4.615 1.001 1.00 0.20 H new ATOM 0 HG12 ILE A 100 2.627 3.928 -1.157 1.00 0.21 H new ATOM 0 HG13 ILE A 100 4.141 3.114 -0.818 1.00 0.21 H new ATOM 0 HG21 ILE A 100 4.651 2.432 1.594 1.00 0.22 H new ATOM 0 HG22 ILE A 100 3.635 3.075 2.906 1.00 0.22 H new ATOM 0 HG23 ILE A 100 3.019 1.774 1.860 1.00 0.22 H new ATOM 0 HD11 ILE A 100 2.496 1.557 -1.738 1.00 0.23 H new ATOM 0 HD12 ILE A 100 2.911 1.110 -0.067 1.00 0.23 H new ATOM 0 HD13 ILE A 100 1.373 1.937 -0.411 1.00 0.23 H new ATOM 934 N SER A 101 1.634 3.953 3.749 1.00 0.20 N ATOM 935 CA SER A 101 1.827 4.419 5.108 1.00 0.20 C ATOM 936 C SER A 101 3.316 4.621 5.382 1.00 0.20 C ATOM 937 O SER A 101 4.164 3.899 4.847 1.00 0.23 O ATOM 938 CB SER A 101 1.250 3.389 6.082 1.00 0.22 C ATOM 939 OG SER A 101 1.573 3.700 7.429 1.00 0.89 O ATOM 0 H SER A 101 1.497 2.945 3.675 1.00 0.20 H new ATOM 0 HA SER A 101 1.314 5.371 5.242 1.00 0.20 H new ATOM 0 HB2 SER A 101 0.167 3.348 5.968 1.00 0.22 H new ATOM 0 HB3 SER A 101 1.635 2.399 5.835 1.00 0.22 H new ATOM 0 HG SER A 101 1.187 3.023 8.023 1.00 0.89 H new ATOM 945 N GLU A 102 3.622 5.594 6.236 1.00 0.20 N ATOM 946 CA GLU A 102 4.978 5.948 6.579 1.00 0.21 C ATOM 947 C GLU A 102 5.708 4.809 7.290 1.00 0.24 C ATOM 948 O GLU A 102 6.929 4.843 7.432 1.00 0.29 O ATOM 949 CB GLU A 102 4.939 7.190 7.464 1.00 0.25 C ATOM 950 CG GLU A 102 4.044 7.055 8.692 1.00 0.31 C ATOM 951 CD GLU A 102 4.580 7.798 9.897 1.00 0.94 C ATOM 952 OE1 GLU A 102 5.750 7.568 10.267 1.00 1.22 O ATOM 953 OE2 GLU A 102 3.844 8.629 10.466 1.00 1.71 O ATOM 0 H GLU A 102 2.919 6.161 6.710 1.00 0.20 H new ATOM 0 HA GLU A 102 5.532 6.148 5.662 1.00 0.21 H new ATOM 0 HB2 GLU A 102 5.953 7.421 7.791 1.00 0.25 H new ATOM 0 HB3 GLU A 102 4.595 8.036 6.869 1.00 0.25 H new ATOM 0 HG2 GLU A 102 3.049 7.431 8.453 1.00 0.31 H new ATOM 0 HG3 GLU A 102 3.935 6.000 8.941 1.00 0.31 H new ATOM 960 N GLU A 103 4.962 3.801 7.731 1.00 0.27 N ATOM 961 CA GLU A 103 5.558 2.649 8.391 1.00 0.34 C ATOM 962 C GLU A 103 6.166 1.681 7.386 1.00 0.31 C ATOM 963 O GLU A 103 7.058 0.900 7.724 1.00 0.41 O ATOM 964 CB GLU A 103 4.526 1.904 9.224 1.00 0.43 C ATOM 965 CG GLU A 103 4.085 2.638 10.468 1.00 0.67 C ATOM 966 CD GLU A 103 3.400 1.716 11.452 1.00 1.15 C ATOM 967 OE1 GLU A 103 2.218 1.383 11.236 1.00 1.42 O ATOM 968 OE2 GLU A 103 4.047 1.306 12.436 1.00 1.48 O ATOM 0 H GLU A 103 3.947 3.760 7.643 1.00 0.27 H new ATOM 0 HA GLU A 103 6.346 3.032 9.039 1.00 0.34 H new ATOM 0 HB2 GLU A 103 3.652 1.705 8.605 1.00 0.43 H new ATOM 0 HB3 GLU A 103 4.939 0.938 9.513 1.00 0.43 H new ATOM 0 HG2 GLU A 103 4.951 3.099 10.944 1.00 0.67 H new ATOM 0 HG3 GLU A 103 3.406 3.445 10.192 1.00 0.67 H new ATOM 975 N LEU A 104 5.680 1.724 6.156 1.00 0.23 N ATOM 976 CA LEU A 104 6.114 0.773 5.147 1.00 0.25 C ATOM 977 C LEU A 104 7.201 1.347 4.265 1.00 0.27 C ATOM 978 O LEU A 104 8.007 0.604 3.708 1.00 0.29 O ATOM 979 CB LEU A 104 4.945 0.330 4.279 1.00 0.27 C ATOM 980 CG LEU A 104 3.900 -0.514 4.987 1.00 0.28 C ATOM 981 CD1 LEU A 104 2.766 -0.831 4.036 1.00 0.33 C ATOM 982 CD2 LEU A 104 4.530 -1.790 5.510 1.00 0.30 C ATOM 0 H LEU A 104 4.990 2.402 5.834 1.00 0.23 H new ATOM 0 HA LEU A 104 6.518 -0.088 5.679 1.00 0.25 H new ATOM 0 HB2 LEU A 104 4.459 1.216 3.872 1.00 0.27 H new ATOM 0 HB3 LEU A 104 5.335 -0.236 3.433 1.00 0.27 H new ATOM 0 HG LEU A 104 3.500 0.045 5.833 1.00 0.28 H new ATOM 0 HD11 LEU A 104 2.019 -1.437 4.549 1.00 0.33 H new ATOM 0 HD12 LEU A 104 2.308 0.097 3.694 1.00 0.33 H new ATOM 0 HD13 LEU A 104 3.153 -1.382 3.179 1.00 0.33 H new ATOM 0 HD21 LEU A 104 3.773 -2.389 6.016 1.00 0.30 H new ATOM 0 HD22 LEU A 104 4.945 -2.358 4.678 1.00 0.30 H new ATOM 0 HD23 LEU A 104 5.325 -1.542 6.213 1.00 0.30 H new ATOM 994 N LEU A 105 7.226 2.662 4.124 1.00 0.43 N ATOM 995 CA LEU A 105 8.214 3.292 3.290 1.00 0.54 C ATOM 996 C LEU A 105 9.612 3.016 3.829 1.00 0.46 C ATOM 997 O LEU A 105 9.816 2.855 5.035 1.00 0.53 O ATOM 998 CB LEU A 105 7.900 4.790 3.112 1.00 0.88 C ATOM 999 CG LEU A 105 8.076 5.695 4.323 1.00 0.30 C ATOM 1000 CD1 LEU A 105 9.539 5.858 4.611 1.00 1.01 C ATOM 1001 CD2 LEU A 105 7.452 7.048 4.061 1.00 1.09 C ATOM 0 H LEU A 105 6.574 3.303 4.576 1.00 0.43 H new ATOM 0 HA LEU A 105 8.181 2.860 2.290 1.00 0.54 H new ATOM 0 HB2 LEU A 105 8.533 5.173 2.311 1.00 0.88 H new ATOM 0 HB3 LEU A 105 6.868 4.879 2.773 1.00 0.88 H new ATOM 0 HG LEU A 105 7.581 5.243 5.183 1.00 0.30 H new ATOM 0 HD11 LEU A 105 9.669 6.506 5.478 1.00 1.01 H new ATOM 0 HD12 LEU A 105 9.980 4.883 4.817 1.00 1.01 H new ATOM 0 HD13 LEU A 105 10.032 6.304 3.747 1.00 1.01 H new ATOM 0 HD21 LEU A 105 7.585 7.685 4.935 1.00 1.09 H new ATOM 0 HD22 LEU A 105 7.933 7.510 3.199 1.00 1.09 H new ATOM 0 HD23 LEU A 105 6.388 6.925 3.860 1.00 1.09 H new ATOM 1013 N MET A 106 10.553 2.920 2.918 1.00 0.41 N ATOM 1014 CA MET A 106 11.924 2.616 3.257 1.00 0.45 C ATOM 1015 C MET A 106 12.732 3.894 3.405 1.00 0.92 C ATOM 1016 O MET A 106 13.218 4.446 2.417 1.00 1.28 O ATOM 1017 CB MET A 106 12.550 1.728 2.176 1.00 0.27 C ATOM 1018 CG MET A 106 14.041 1.489 2.372 1.00 0.30 C ATOM 1019 SD MET A 106 14.398 0.376 3.742 1.00 1.05 S ATOM 1020 CE MET A 106 14.300 -1.201 2.901 1.00 0.50 C ATOM 0 H MET A 106 10.389 3.051 1.920 1.00 0.41 H new ATOM 0 HA MET A 106 11.934 2.083 4.208 1.00 0.45 H new ATOM 0 HB2 MET A 106 12.035 0.767 2.163 1.00 0.27 H new ATOM 0 HB3 MET A 106 12.389 2.189 1.201 1.00 0.27 H new ATOM 0 HG2 MET A 106 14.461 1.075 1.455 1.00 0.30 H new ATOM 0 HG3 MET A 106 14.537 2.444 2.547 1.00 0.30 H new ATOM 0 HE1 MET A 106 13.786 -1.921 3.537 1.00 0.50 H new ATOM 0 HE2 MET A 106 13.749 -1.082 1.968 1.00 0.50 H new ATOM 0 HE3 MET A 106 15.306 -1.561 2.685 1.00 0.50 H new ATOM 1030 N LYS A 107 12.842 4.384 4.627 1.00 1.28 N ATOM 1031 CA LYS A 107 13.786 5.440 4.910 1.00 1.66 C ATOM 1032 C LYS A 107 15.146 4.787 5.077 1.00 1.09 C ATOM 1033 O LYS A 107 15.402 4.116 6.074 1.00 1.52 O ATOM 1034 CB LYS A 107 13.375 6.205 6.169 1.00 2.68 C ATOM 1035 CG LYS A 107 14.261 7.397 6.491 1.00 3.57 C ATOM 1036 CD LYS A 107 13.679 8.218 7.630 1.00 4.57 C ATOM 1037 CE LYS A 107 12.352 8.844 7.234 1.00 5.18 C ATOM 1038 NZ LYS A 107 11.623 9.409 8.400 1.00 5.65 N ATOM 0 H LYS A 107 12.295 4.069 5.428 1.00 1.28 H new ATOM 0 HA LYS A 107 13.815 6.167 4.099 1.00 1.66 H new ATOM 0 HB2 LYS A 107 12.348 6.551 6.051 1.00 2.68 H new ATOM 0 HB3 LYS A 107 13.385 5.520 7.017 1.00 2.68 H new ATOM 0 HG2 LYS A 107 15.259 7.050 6.761 1.00 3.57 H new ATOM 0 HG3 LYS A 107 14.370 8.023 5.605 1.00 3.57 H new ATOM 0 HD2 LYS A 107 13.538 7.583 8.504 1.00 4.57 H new ATOM 0 HD3 LYS A 107 14.383 9.000 7.914 1.00 4.57 H new ATOM 0 HE2 LYS A 107 12.529 9.632 6.502 1.00 5.18 H new ATOM 0 HE3 LYS A 107 11.729 8.093 6.749 1.00 5.18 H new ATOM 0 HZ1 LYS A 107 10.725 9.824 8.080 1.00 5.65 H new ATOM 0 HZ2 LYS A 107 11.429 8.653 9.088 1.00 5.65 H new ATOM 0 HZ3 LYS A 107 12.204 10.145 8.849 1.00 5.65 H new ATOM 1052 N ASP A 108 15.994 4.973 4.084 1.00 1.16 N ATOM 1053 CA ASP A 108 17.212 4.222 3.946 1.00 1.22 C ATOM 1054 C ASP A 108 18.379 4.844 4.701 1.00 1.17 C ATOM 1055 O ASP A 108 18.872 5.912 4.340 1.00 1.12 O ATOM 1056 CB ASP A 108 17.538 4.132 2.463 1.00 1.88 C ATOM 1057 CG ASP A 108 17.587 5.491 1.778 1.00 2.55 C ATOM 1058 OD1 ASP A 108 16.521 6.131 1.625 1.00 2.80 O ATOM 1059 OD2 ASP A 108 18.689 5.931 1.388 1.00 3.03 O ATOM 0 H ASP A 108 15.848 5.660 3.345 1.00 1.16 H new ATOM 0 HA ASP A 108 17.061 3.234 4.380 1.00 1.22 H new ATOM 0 HB2 ASP A 108 18.500 3.634 2.338 1.00 1.88 H new ATOM 0 HB3 ASP A 108 16.791 3.510 1.970 1.00 1.88 H new ATOM 1064 N PRO A 109 18.829 4.200 5.784 1.00 1.79 N ATOM 1065 CA PRO A 109 20.051 4.601 6.449 1.00 2.23 C ATOM 1066 C PRO A 109 21.281 3.988 5.790 1.00 2.02 C ATOM 1067 O PRO A 109 22.234 4.689 5.459 1.00 2.25 O ATOM 1068 CB PRO A 109 19.863 4.087 7.874 1.00 3.08 C ATOM 1069 CG PRO A 109 18.919 2.930 7.767 1.00 3.14 C ATOM 1070 CD PRO A 109 18.175 3.067 6.457 1.00 2.41 C ATOM 0 HA PRO A 109 20.221 5.677 6.405 1.00 2.23 H new ATOM 0 HB2 PRO A 109 20.814 3.777 8.307 1.00 3.08 H new ATOM 0 HB3 PRO A 109 19.457 4.865 8.520 1.00 3.08 H new ATOM 0 HG2 PRO A 109 19.464 1.987 7.801 1.00 3.14 H new ATOM 0 HG3 PRO A 109 18.222 2.926 8.605 1.00 3.14 H new ATOM 0 HD2 PRO A 109 18.246 2.156 5.862 1.00 2.41 H new ATOM 0 HD3 PRO A 109 17.115 3.259 6.620 1.00 2.41 H new ATOM 1078 N ASN A 110 21.251 2.681 5.599 1.00 1.75 N ATOM 1079 CA ASN A 110 22.314 1.982 4.899 1.00 1.67 C ATOM 1080 C ASN A 110 21.802 1.447 3.567 1.00 1.25 C ATOM 1081 O ASN A 110 22.577 1.088 2.683 1.00 1.26 O ATOM 1082 CB ASN A 110 22.851 0.840 5.774 1.00 1.96 C ATOM 1083 CG ASN A 110 23.923 0.011 5.089 1.00 2.05 C ATOM 1084 OD1 ASN A 110 25.108 0.346 5.129 1.00 2.18 O ATOM 1085 ND2 ASN A 110 23.519 -1.093 4.479 1.00 2.57 N ATOM 0 H ASN A 110 20.495 2.078 5.922 1.00 1.75 H new ATOM 0 HA ASN A 110 23.129 2.678 4.697 1.00 1.67 H new ATOM 0 HB2 ASN A 110 23.258 1.258 6.695 1.00 1.96 H new ATOM 0 HB3 ASN A 110 22.024 0.189 6.057 1.00 1.96 H new ATOM 0 HD21 ASN A 110 24.198 -1.700 4.020 1.00 2.57 H new ATOM 0 HD22 ASN A 110 22.528 -1.336 4.468 1.00 2.57 H new ATOM 1092 N TYR A 111 20.484 1.428 3.419 1.00 0.95 N ATOM 1093 CA TYR A 111 19.863 0.712 2.306 1.00 0.70 C ATOM 1094 C TYR A 111 19.864 1.534 1.029 1.00 0.60 C ATOM 1095 O TYR A 111 19.789 2.760 1.054 1.00 0.80 O ATOM 1096 CB TYR A 111 18.422 0.294 2.638 1.00 0.70 C ATOM 1097 CG TYR A 111 17.819 -0.631 1.601 1.00 0.76 C ATOM 1098 CD1 TYR A 111 18.233 -1.954 1.500 1.00 0.94 C ATOM 1099 CD2 TYR A 111 16.843 -0.182 0.720 1.00 0.89 C ATOM 1100 CE1 TYR A 111 17.696 -2.800 0.548 1.00 1.18 C ATOM 1101 CE2 TYR A 111 16.303 -1.025 -0.235 1.00 1.12 C ATOM 1102 CZ TYR A 111 16.733 -2.330 -0.316 1.00 1.23 C ATOM 1103 OH TYR A 111 16.212 -3.157 -1.283 1.00 1.57 O ATOM 0 H TYR A 111 19.828 1.894 4.046 1.00 0.95 H new ATOM 0 HA TYR A 111 20.466 -0.182 2.145 1.00 0.70 H new ATOM 0 HB2 TYR A 111 18.408 -0.200 3.609 1.00 0.70 H new ATOM 0 HB3 TYR A 111 17.802 1.186 2.725 1.00 0.70 H new ATOM 0 HD1 TYR A 111 18.987 -2.327 2.177 1.00 0.94 H new ATOM 0 HD2 TYR A 111 16.501 0.840 0.782 1.00 0.89 H new ATOM 0 HE1 TYR A 111 18.030 -3.825 0.482 1.00 1.18 H new ATOM 0 HE2 TYR A 111 15.547 -0.660 -0.914 1.00 1.12 H new ATOM 0 HH TYR A 111 16.444 -4.087 -1.078 1.00 1.57 H new ATOM 1113 N GLN A 112 19.979 0.834 -0.082 1.00 0.53 N ATOM 1114 CA GLN A 112 19.796 1.409 -1.393 1.00 0.55 C ATOM 1115 C GLN A 112 18.882 0.501 -2.195 1.00 0.45 C ATOM 1116 O GLN A 112 18.862 -0.707 -1.968 1.00 0.47 O ATOM 1117 CB GLN A 112 21.143 1.566 -2.076 1.00 0.70 C ATOM 1118 CG GLN A 112 22.051 2.573 -1.399 1.00 1.30 C ATOM 1119 CD GLN A 112 23.381 2.738 -2.105 1.00 1.42 C ATOM 1120 OE1 GLN A 112 23.882 1.810 -2.742 1.00 1.64 O ATOM 1121 NE2 GLN A 112 23.968 3.917 -1.986 1.00 2.05 N ATOM 0 H GLN A 112 20.205 -0.161 -0.096 1.00 0.53 H new ATOM 0 HA GLN A 112 19.341 2.396 -1.316 1.00 0.55 H new ATOM 0 HB2 GLN A 112 21.643 0.598 -2.102 1.00 0.70 H new ATOM 0 HB3 GLN A 112 20.984 1.870 -3.110 1.00 0.70 H new ATOM 0 HG2 GLN A 112 21.546 3.538 -1.356 1.00 1.30 H new ATOM 0 HG3 GLN A 112 22.228 2.260 -0.370 1.00 1.30 H new ATOM 0 HE21 GLN A 112 23.518 4.659 -1.449 1.00 2.05 H new ATOM 0 HE22 GLN A 112 24.870 4.085 -2.431 1.00 2.05 H new ATOM 1130 N LEU A 113 18.120 1.083 -3.108 1.00 0.40 N ATOM 1131 CA LEU A 113 17.080 0.359 -3.818 1.00 0.33 C ATOM 1132 C LEU A 113 17.645 -0.822 -4.606 1.00 0.36 C ATOM 1133 O LEU A 113 18.248 -0.651 -5.667 1.00 0.43 O ATOM 1134 CB LEU A 113 16.341 1.316 -4.746 1.00 0.32 C ATOM 1135 CG LEU A 113 15.260 0.672 -5.608 1.00 0.30 C ATOM 1136 CD1 LEU A 113 14.118 0.179 -4.735 1.00 0.25 C ATOM 1137 CD2 LEU A 113 14.761 1.651 -6.655 1.00 0.35 C ATOM 0 H LEU A 113 18.205 2.064 -3.376 1.00 0.40 H new ATOM 0 HA LEU A 113 16.386 -0.049 -3.084 1.00 0.33 H new ATOM 0 HB2 LEU A 113 15.884 2.102 -4.144 1.00 0.32 H new ATOM 0 HB3 LEU A 113 17.068 1.797 -5.401 1.00 0.32 H new ATOM 0 HG LEU A 113 15.689 -0.185 -6.127 1.00 0.30 H new ATOM 0 HD11 LEU A 113 13.352 -0.279 -5.362 1.00 0.25 H new ATOM 0 HD12 LEU A 113 14.494 -0.558 -4.025 1.00 0.25 H new ATOM 0 HD13 LEU A 113 13.687 1.019 -4.191 1.00 0.25 H new ATOM 0 HD21 LEU A 113 13.990 1.174 -7.261 1.00 0.35 H new ATOM 0 HD22 LEU A 113 14.344 2.529 -6.162 1.00 0.35 H new ATOM 0 HD23 LEU A 113 15.590 1.953 -7.295 1.00 0.35 H new ATOM 1149 N LYS A 114 17.426 -2.022 -4.083 1.00 0.40 N ATOM 1150 CA LYS A 114 17.927 -3.235 -4.706 1.00 0.47 C ATOM 1151 C LYS A 114 16.987 -3.738 -5.775 1.00 0.37 C ATOM 1152 O LYS A 114 15.806 -3.963 -5.520 1.00 0.33 O ATOM 1153 CB LYS A 114 18.137 -4.324 -3.688 1.00 0.63 C ATOM 1154 CG LYS A 114 19.578 -4.458 -3.271 1.00 0.90 C ATOM 1155 CD LYS A 114 20.530 -4.342 -4.455 1.00 1.14 C ATOM 1156 CE LYS A 114 21.987 -4.335 -4.013 1.00 1.51 C ATOM 1157 NZ LYS A 114 22.359 -3.077 -3.310 1.00 2.09 N ATOM 0 H LYS A 114 16.901 -2.179 -3.223 1.00 0.40 H new ATOM 0 HA LYS A 114 18.882 -2.979 -5.164 1.00 0.47 H new ATOM 0 HB2 LYS A 114 17.526 -4.117 -2.809 1.00 0.63 H new ATOM 0 HB3 LYS A 114 17.792 -5.272 -4.100 1.00 0.63 H new ATOM 0 HG2 LYS A 114 19.816 -3.687 -2.538 1.00 0.90 H new ATOM 0 HG3 LYS A 114 19.725 -5.420 -2.781 1.00 0.90 H new ATOM 0 HD2 LYS A 114 20.362 -5.174 -5.139 1.00 1.14 H new ATOM 0 HD3 LYS A 114 20.314 -3.427 -5.007 1.00 1.14 H new ATOM 0 HE2 LYS A 114 22.168 -5.184 -3.354 1.00 1.51 H new ATOM 0 HE3 LYS A 114 22.629 -4.465 -4.884 1.00 1.51 H new ATOM 0 HZ1 LYS A 114 23.388 -3.052 -3.164 1.00 2.09 H new ATOM 0 HZ2 LYS A 114 22.071 -2.260 -3.885 1.00 2.09 H new ATOM 0 HZ3 LYS A 114 21.878 -3.039 -2.389 1.00 2.09 H new ATOM 1171 N ASP A 115 17.532 -3.949 -6.961 1.00 0.40 N ATOM 1172 CA ASP A 115 16.755 -4.425 -8.094 1.00 0.41 C ATOM 1173 C ASP A 115 16.237 -5.831 -7.836 1.00 0.38 C ATOM 1174 O ASP A 115 15.207 -6.232 -8.371 1.00 0.42 O ATOM 1175 CB ASP A 115 17.596 -4.397 -9.372 1.00 0.53 C ATOM 1176 CG ASP A 115 18.052 -2.996 -9.730 1.00 1.12 C ATOM 1177 OD1 ASP A 115 19.088 -2.547 -9.197 1.00 1.88 O ATOM 1178 OD2 ASP A 115 17.378 -2.339 -10.557 1.00 1.11 O ATOM 0 H ASP A 115 18.520 -3.796 -7.166 1.00 0.40 H new ATOM 0 HA ASP A 115 15.901 -3.760 -8.225 1.00 0.41 H new ATOM 0 HB2 ASP A 115 18.468 -5.039 -9.245 1.00 0.53 H new ATOM 0 HB3 ASP A 115 17.014 -4.809 -10.196 1.00 0.53 H new ATOM 1183 N SER A 116 16.949 -6.570 -6.997 1.00 0.38 N ATOM 1184 CA SER A 116 16.552 -7.924 -6.656 1.00 0.44 C ATOM 1185 C SER A 116 15.416 -7.915 -5.635 1.00 0.40 C ATOM 1186 O SER A 116 14.600 -8.838 -5.598 1.00 0.51 O ATOM 1187 CB SER A 116 17.752 -8.707 -6.110 1.00 0.54 C ATOM 1188 OG SER A 116 17.429 -10.075 -5.915 1.00 0.92 O ATOM 0 H SER A 116 17.804 -6.252 -6.541 1.00 0.38 H new ATOM 0 HA SER A 116 16.194 -8.415 -7.561 1.00 0.44 H new ATOM 0 HB2 SER A 116 18.589 -8.624 -6.803 1.00 0.54 H new ATOM 0 HB3 SER A 116 18.075 -8.269 -5.166 1.00 0.54 H new ATOM 0 HG SER A 116 18.213 -10.550 -5.568 1.00 0.92 H new ATOM 1194 N ASP A 117 15.348 -6.862 -4.823 1.00 0.28 N ATOM 1195 CA ASP A 117 14.332 -6.790 -3.771 1.00 0.28 C ATOM 1196 C ASP A 117 13.034 -6.225 -4.325 1.00 0.22 C ATOM 1197 O ASP A 117 11.955 -6.453 -3.782 1.00 0.24 O ATOM 1198 CB ASP A 117 14.807 -5.932 -2.595 1.00 0.34 C ATOM 1199 CG ASP A 117 15.987 -6.533 -1.853 1.00 1.08 C ATOM 1200 OD1 ASP A 117 16.187 -7.762 -1.947 1.00 1.90 O ATOM 1201 OD2 ASP A 117 16.726 -5.784 -1.178 1.00 1.04 O ATOM 0 H ASP A 117 15.973 -6.057 -4.870 1.00 0.28 H new ATOM 0 HA ASP A 117 14.160 -7.804 -3.409 1.00 0.28 H new ATOM 0 HB2 ASP A 117 15.083 -4.944 -2.963 1.00 0.34 H new ATOM 0 HB3 ASP A 117 13.981 -5.793 -1.898 1.00 0.34 H new ATOM 1206 N ILE A 118 13.157 -5.482 -5.412 1.00 0.23 N ATOM 1207 CA ILE A 118 12.016 -4.872 -6.077 1.00 0.22 C ATOM 1208 C ILE A 118 11.042 -5.920 -6.594 1.00 0.26 C ATOM 1209 O ILE A 118 11.393 -6.750 -7.433 1.00 0.34 O ATOM 1210 CB ILE A 118 12.490 -3.997 -7.253 1.00 0.26 C ATOM 1211 CG1 ILE A 118 13.302 -2.816 -6.727 1.00 0.26 C ATOM 1212 CG2 ILE A 118 11.310 -3.510 -8.084 1.00 0.31 C ATOM 1213 CD1 ILE A 118 14.128 -2.128 -7.788 1.00 0.32 C ATOM 0 H ILE A 118 14.052 -5.284 -5.860 1.00 0.23 H new ATOM 0 HA ILE A 118 11.501 -4.256 -5.340 1.00 0.22 H new ATOM 0 HB ILE A 118 13.124 -4.602 -7.901 1.00 0.26 H new ATOM 0 HG12 ILE A 118 12.623 -2.090 -6.280 1.00 0.26 H new ATOM 0 HG13 ILE A 118 13.963 -3.165 -5.934 1.00 0.26 H new ATOM 0 HG21 ILE A 118 11.674 -2.895 -8.907 1.00 0.31 H new ATOM 0 HG22 ILE A 118 10.768 -4.367 -8.484 1.00 0.31 H new ATOM 0 HG23 ILE A 118 10.643 -2.919 -7.457 1.00 0.31 H new ATOM 0 HD11 ILE A 118 14.677 -1.300 -7.341 1.00 0.32 H new ATOM 0 HD12 ILE A 118 14.832 -2.840 -8.219 1.00 0.32 H new ATOM 0 HD13 ILE A 118 13.471 -1.748 -8.570 1.00 0.32 H new ATOM 1225 N VAL A 119 9.827 -5.892 -6.069 1.00 0.24 N ATOM 1226 CA VAL A 119 8.766 -6.731 -6.580 1.00 0.31 C ATOM 1227 C VAL A 119 7.929 -5.933 -7.580 1.00 0.27 C ATOM 1228 O VAL A 119 7.416 -6.477 -8.561 1.00 0.31 O ATOM 1229 CB VAL A 119 7.857 -7.259 -5.448 1.00 0.36 C ATOM 1230 CG1 VAL A 119 6.887 -8.284 -5.998 1.00 0.47 C ATOM 1231 CG2 VAL A 119 8.678 -7.849 -4.308 1.00 0.38 C ATOM 0 H VAL A 119 9.556 -5.295 -5.288 1.00 0.24 H new ATOM 0 HA VAL A 119 9.221 -7.592 -7.069 1.00 0.31 H new ATOM 0 HB VAL A 119 7.291 -6.420 -5.044 1.00 0.36 H new ATOM 0 HG11 VAL A 119 6.250 -8.651 -5.193 1.00 0.47 H new ATOM 0 HG12 VAL A 119 6.269 -7.823 -6.768 1.00 0.47 H new ATOM 0 HG13 VAL A 119 7.443 -9.117 -6.429 1.00 0.47 H new ATOM 0 HG21 VAL A 119 8.009 -8.212 -3.528 1.00 0.38 H new ATOM 0 HG22 VAL A 119 9.280 -8.677 -4.683 1.00 0.38 H new ATOM 0 HG23 VAL A 119 9.333 -7.081 -3.896 1.00 0.38 H new ATOM 1241 N ASN A 120 7.811 -4.632 -7.325 1.00 0.25 N ATOM 1242 CA ASN A 120 7.054 -3.732 -8.198 1.00 0.24 C ATOM 1243 C ASN A 120 7.454 -2.276 -7.948 1.00 0.23 C ATOM 1244 O ASN A 120 8.091 -1.959 -6.945 1.00 0.26 O ATOM 1245 CB ASN A 120 5.550 -3.927 -7.962 1.00 0.31 C ATOM 1246 CG ASN A 120 4.671 -3.084 -8.865 1.00 0.54 C ATOM 1247 OD1 ASN A 120 4.382 -3.461 -9.996 1.00 1.17 O ATOM 1248 ND2 ASN A 120 4.215 -1.954 -8.354 1.00 0.36 N ATOM 0 H ASN A 120 8.232 -4.174 -6.517 1.00 0.25 H new ATOM 0 HA ASN A 120 7.283 -3.971 -9.237 1.00 0.24 H new ATOM 0 HB2 ASN A 120 5.303 -4.978 -8.109 1.00 0.31 H new ATOM 0 HB3 ASN A 120 5.321 -3.688 -6.923 1.00 0.31 H new ATOM 0 HD21 ASN A 120 3.597 -1.358 -8.905 1.00 0.36 H new ATOM 0 HD22 ASN A 120 4.480 -1.678 -7.409 1.00 0.36 H new ATOM 1255 N GLU A 121 7.081 -1.405 -8.869 1.00 0.24 N ATOM 1256 CA GLU A 121 7.381 0.016 -8.766 1.00 0.25 C ATOM 1257 C GLU A 121 6.100 0.834 -8.718 1.00 0.25 C ATOM 1258 O GLU A 121 5.154 0.573 -9.460 1.00 0.32 O ATOM 1259 CB GLU A 121 8.236 0.477 -9.953 1.00 0.31 C ATOM 1260 CG GLU A 121 8.291 1.997 -10.124 1.00 0.35 C ATOM 1261 CD GLU A 121 8.997 2.428 -11.390 1.00 0.71 C ATOM 1262 OE1 GLU A 121 8.751 1.822 -12.452 1.00 1.17 O ATOM 1263 OE2 GLU A 121 9.811 3.371 -11.330 1.00 1.24 O ATOM 0 H GLU A 121 6.562 -1.660 -9.709 1.00 0.24 H new ATOM 0 HA GLU A 121 7.939 0.172 -7.843 1.00 0.25 H new ATOM 0 HB2 GLU A 121 9.250 0.098 -9.826 1.00 0.31 H new ATOM 0 HB3 GLU A 121 7.842 0.032 -10.867 1.00 0.31 H new ATOM 0 HG2 GLU A 121 7.275 2.393 -10.129 1.00 0.35 H new ATOM 0 HG3 GLU A 121 8.799 2.435 -9.265 1.00 0.35 H new ATOM 1270 N ILE A 122 6.080 1.817 -7.839 1.00 0.21 N ATOM 1271 CA ILE A 122 4.981 2.756 -7.769 1.00 0.23 C ATOM 1272 C ILE A 122 5.510 4.154 -8.058 1.00 0.26 C ATOM 1273 O ILE A 122 6.685 4.315 -8.391 1.00 0.25 O ATOM 1274 CB ILE A 122 4.243 2.702 -6.413 1.00 0.26 C ATOM 1275 CG1 ILE A 122 5.187 3.010 -5.253 1.00 0.27 C ATOM 1276 CG2 ILE A 122 3.605 1.333 -6.230 1.00 0.27 C ATOM 1277 CD1 ILE A 122 4.554 2.824 -3.894 1.00 0.31 C ATOM 0 H ILE A 122 6.821 1.986 -7.158 1.00 0.21 H new ATOM 0 HA ILE A 122 4.241 2.480 -8.521 1.00 0.23 H new ATOM 0 HB ILE A 122 3.465 3.465 -6.415 1.00 0.26 H new ATOM 0 HG12 ILE A 122 6.063 2.366 -5.328 1.00 0.27 H new ATOM 0 HG13 ILE A 122 5.538 4.038 -5.344 1.00 0.27 H new ATOM 0 HG21 ILE A 122 3.085 1.299 -5.272 1.00 0.27 H new ATOM 0 HG22 ILE A 122 2.893 1.153 -7.036 1.00 0.27 H new ATOM 0 HG23 ILE A 122 4.379 0.565 -6.251 1.00 0.27 H new ATOM 0 HD11 ILE A 122 5.282 3.060 -3.118 1.00 0.31 H new ATOM 0 HD12 ILE A 122 3.694 3.487 -3.799 1.00 0.31 H new ATOM 0 HD13 ILE A 122 4.228 1.790 -3.783 1.00 0.31 H new ATOM 1289 N LYS A 123 4.656 5.151 -7.981 1.00 0.30 N ATOM 1290 CA LYS A 123 5.048 6.499 -8.341 1.00 0.34 C ATOM 1291 C LYS A 123 6.000 7.068 -7.312 1.00 0.36 C ATOM 1292 O LYS A 123 5.635 7.289 -6.168 1.00 0.42 O ATOM 1293 CB LYS A 123 3.808 7.373 -8.481 1.00 0.39 C ATOM 1294 CG LYS A 123 4.073 8.681 -9.178 1.00 0.48 C ATOM 1295 CD LYS A 123 2.785 9.429 -9.449 1.00 0.75 C ATOM 1296 CE LYS A 123 1.903 8.674 -10.427 1.00 1.35 C ATOM 1297 NZ LYS A 123 0.583 9.328 -10.601 1.00 2.15 N ATOM 0 H LYS A 123 3.688 5.056 -7.673 1.00 0.30 H new ATOM 0 HA LYS A 123 5.569 6.477 -9.298 1.00 0.34 H new ATOM 0 HB2 LYS A 123 3.046 6.823 -9.034 1.00 0.39 H new ATOM 0 HB3 LYS A 123 3.401 7.574 -7.490 1.00 0.39 H new ATOM 0 HG2 LYS A 123 4.731 9.296 -8.564 1.00 0.48 H new ATOM 0 HG3 LYS A 123 4.594 8.496 -10.118 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.247 9.581 -8.513 1.00 0.75 H new ATOM 0 HD3 LYS A 123 3.013 10.417 -9.850 1.00 0.75 H new ATOM 0 HE2 LYS A 123 2.405 8.608 -11.392 1.00 1.35 H new ATOM 0 HE3 LYS A 123 1.758 7.654 -10.072 1.00 1.35 H new ATOM 0 HZ1 LYS A 123 0.114 8.944 -11.446 1.00 2.15 H new ATOM 0 HZ2 LYS A 123 -0.007 9.147 -9.764 1.00 2.15 H new ATOM 0 HZ3 LYS A 123 0.716 10.353 -10.715 1.00 2.15 H new ATOM 1311 N GLY A 124 7.228 7.277 -7.729 1.00 0.37 N ATOM 1312 CA GLY A 124 8.229 7.820 -6.841 1.00 0.42 C ATOM 1313 C GLY A 124 8.815 6.776 -5.915 1.00 0.38 C ATOM 1314 O GLY A 124 9.999 6.820 -5.591 1.00 0.42 O ATOM 0 H GLY A 124 7.556 7.080 -8.674 1.00 0.37 H new ATOM 0 HA2 GLY A 124 9.029 8.267 -7.431 1.00 0.42 H new ATOM 0 HA3 GLY A 124 7.787 8.620 -6.247 1.00 0.42 H new ATOM 1318 N GLY A 125 7.988 5.846 -5.468 1.00 0.34 N ATOM 1319 CA GLY A 125 8.480 4.804 -4.590 1.00 0.31 C ATOM 1320 C GLY A 125 8.536 3.437 -5.240 1.00 0.25 C ATOM 1321 O GLY A 125 7.995 3.222 -6.318 1.00 0.29 O ATOM 0 H GLY A 125 6.995 5.792 -5.693 1.00 0.34 H new ATOM 0 HA2 GLY A 125 9.478 5.073 -4.244 1.00 0.31 H new ATOM 0 HA3 GLY A 125 7.841 4.752 -3.709 1.00 0.31 H new ATOM 1325 N TYR A 126 9.213 2.511 -4.583 1.00 0.19 N ATOM 1326 CA TYR A 126 9.255 1.137 -5.028 1.00 0.16 C ATOM 1327 C TYR A 126 8.722 0.230 -3.951 1.00 0.16 C ATOM 1328 O TYR A 126 9.251 0.203 -2.843 1.00 0.17 O ATOM 1329 CB TYR A 126 10.685 0.725 -5.361 1.00 0.15 C ATOM 1330 CG TYR A 126 11.061 0.971 -6.792 1.00 0.18 C ATOM 1331 CD1 TYR A 126 11.159 2.254 -7.288 1.00 0.24 C ATOM 1332 CD2 TYR A 126 11.291 -0.088 -7.650 1.00 0.21 C ATOM 1333 CE1 TYR A 126 11.481 2.483 -8.607 1.00 0.29 C ATOM 1334 CE2 TYR A 126 11.622 0.125 -8.969 1.00 0.27 C ATOM 1335 CZ TYR A 126 11.716 1.411 -9.446 1.00 0.30 C ATOM 1336 OH TYR A 126 12.036 1.619 -10.766 1.00 0.38 O ATOM 0 H TYR A 126 9.745 2.693 -3.732 1.00 0.19 H new ATOM 0 HA TYR A 126 8.639 1.050 -5.923 1.00 0.16 H new ATOM 0 HB2 TYR A 126 11.372 1.271 -4.714 1.00 0.15 H new ATOM 0 HB3 TYR A 126 10.811 -0.334 -5.138 1.00 0.15 H new ATOM 0 HD1 TYR A 126 10.980 3.093 -6.631 1.00 0.24 H new ATOM 0 HD2 TYR A 126 11.210 -1.099 -7.279 1.00 0.21 H new ATOM 0 HE1 TYR A 126 11.549 3.493 -8.983 1.00 0.29 H new ATOM 0 HE2 TYR A 126 11.807 -0.713 -9.625 1.00 0.27 H new ATOM 0 HH TYR A 126 11.515 2.373 -11.114 1.00 0.38 H new ATOM 1346 N VAL A 127 7.686 -0.515 -4.264 1.00 0.18 N ATOM 1347 CA VAL A 127 7.210 -1.514 -3.339 1.00 0.20 C ATOM 1348 C VAL A 127 8.115 -2.735 -3.454 1.00 0.17 C ATOM 1349 O VAL A 127 8.133 -3.444 -4.465 1.00 0.20 O ATOM 1350 CB VAL A 127 5.719 -1.862 -3.565 1.00 0.29 C ATOM 1351 CG1 VAL A 127 5.430 -2.196 -5.018 1.00 0.55 C ATOM 1352 CG2 VAL A 127 5.297 -2.998 -2.654 1.00 0.60 C ATOM 0 H VAL A 127 7.165 -0.449 -5.138 1.00 0.18 H new ATOM 0 HA VAL A 127 7.257 -1.122 -2.323 1.00 0.20 H new ATOM 0 HB VAL A 127 5.132 -0.978 -3.316 1.00 0.29 H new ATOM 0 HG11 VAL A 127 4.373 -2.434 -5.133 1.00 0.55 H new ATOM 0 HG12 VAL A 127 5.679 -1.340 -5.645 1.00 0.55 H new ATOM 0 HG13 VAL A 127 6.030 -3.054 -5.320 1.00 0.55 H new ATOM 0 HG21 VAL A 127 4.246 -3.231 -2.825 1.00 0.60 H new ATOM 0 HG22 VAL A 127 5.903 -3.879 -2.866 1.00 0.60 H new ATOM 0 HG23 VAL A 127 5.438 -2.702 -1.614 1.00 0.60 H new ATOM 1362 N ILE A 128 8.882 -2.952 -2.409 1.00 0.14 N ATOM 1363 CA ILE A 128 9.996 -3.873 -2.454 1.00 0.12 C ATOM 1364 C ILE A 128 9.918 -4.874 -1.325 1.00 0.13 C ATOM 1365 O ILE A 128 9.321 -4.606 -0.291 1.00 0.16 O ATOM 1366 CB ILE A 128 11.340 -3.110 -2.362 1.00 0.13 C ATOM 1367 CG1 ILE A 128 11.385 -2.228 -1.100 1.00 0.16 C ATOM 1368 CG2 ILE A 128 11.546 -2.262 -3.607 1.00 0.16 C ATOM 1369 CD1 ILE A 128 12.649 -1.405 -0.970 1.00 0.19 C ATOM 0 H ILE A 128 8.752 -2.496 -1.506 1.00 0.14 H new ATOM 0 HA ILE A 128 9.944 -4.403 -3.405 1.00 0.12 H new ATOM 0 HB ILE A 128 12.146 -3.841 -2.294 1.00 0.13 H new ATOM 0 HG12 ILE A 128 10.526 -1.557 -1.107 1.00 0.16 H new ATOM 0 HG13 ILE A 128 11.286 -2.864 -0.221 1.00 0.16 H new ATOM 0 HG21 ILE A 128 12.494 -1.730 -3.532 1.00 0.16 H new ATOM 0 HG22 ILE A 128 11.560 -2.905 -4.487 1.00 0.16 H new ATOM 0 HG23 ILE A 128 10.732 -1.543 -3.696 1.00 0.16 H new ATOM 0 HD11 ILE A 128 12.604 -0.812 -0.057 1.00 0.19 H new ATOM 0 HD12 ILE A 128 13.513 -2.069 -0.930 1.00 0.19 H new ATOM 0 HD13 ILE A 128 12.741 -0.741 -1.830 1.00 0.19 H new ATOM 1381 N LYS A 129 10.511 -6.028 -1.528 1.00 0.15 N ATOM 1382 CA LYS A 129 10.621 -7.005 -0.466 1.00 0.18 C ATOM 1383 C LYS A 129 12.086 -7.262 -0.166 1.00 0.19 C ATOM 1384 O LYS A 129 12.775 -7.964 -0.909 1.00 0.20 O ATOM 1385 CB LYS A 129 9.911 -8.310 -0.836 1.00 0.22 C ATOM 1386 CG LYS A 129 9.919 -9.328 0.294 1.00 0.28 C ATOM 1387 CD LYS A 129 9.081 -10.553 -0.028 1.00 0.40 C ATOM 1388 CE LYS A 129 9.083 -11.523 1.140 1.00 0.51 C ATOM 1389 NZ LYS A 129 8.216 -12.705 0.899 1.00 0.76 N ATOM 0 H LYS A 129 10.924 -6.314 -2.416 1.00 0.15 H new ATOM 0 HA LYS A 129 10.134 -6.608 0.424 1.00 0.18 H new ATOM 0 HB2 LYS A 129 8.880 -8.091 -1.114 1.00 0.22 H new ATOM 0 HB3 LYS A 129 10.392 -8.744 -1.713 1.00 0.22 H new ATOM 0 HG2 LYS A 129 10.945 -9.635 0.496 1.00 0.28 H new ATOM 0 HG3 LYS A 129 9.541 -8.861 1.204 1.00 0.28 H new ATOM 0 HD2 LYS A 129 8.059 -10.251 -0.256 1.00 0.40 H new ATOM 0 HD3 LYS A 129 9.474 -11.045 -0.918 1.00 0.40 H new ATOM 0 HE2 LYS A 129 10.103 -11.857 1.329 1.00 0.51 H new ATOM 0 HE3 LYS A 129 8.745 -11.006 2.038 1.00 0.51 H new ATOM 0 HZ1 LYS A 129 8.252 -13.336 1.725 1.00 0.76 H new ATOM 0 HZ2 LYS A 129 7.236 -12.391 0.745 1.00 0.76 H new ATOM 0 HZ3 LYS A 129 8.552 -13.216 0.058 1.00 0.76 H new ATOM 1403 N VAL A 130 12.551 -6.698 0.935 1.00 0.21 N ATOM 1404 CA VAL A 130 13.935 -6.808 1.328 1.00 0.24 C ATOM 1405 C VAL A 130 14.022 -7.474 2.693 1.00 0.29 C ATOM 1406 O VAL A 130 13.221 -7.183 3.586 1.00 0.29 O ATOM 1407 CB VAL A 130 14.640 -5.418 1.345 1.00 0.24 C ATOM 1408 CG1 VAL A 130 13.843 -4.401 0.547 1.00 0.26 C ATOM 1409 CG2 VAL A 130 14.877 -4.889 2.753 1.00 0.26 C ATOM 0 H VAL A 130 11.976 -6.153 1.578 1.00 0.21 H new ATOM 0 HA VAL A 130 14.455 -7.421 0.592 1.00 0.24 H new ATOM 0 HB VAL A 130 15.616 -5.567 0.884 1.00 0.24 H new ATOM 0 HG11 VAL A 130 14.353 -3.438 0.572 1.00 0.26 H new ATOM 0 HG12 VAL A 130 13.754 -4.738 -0.486 1.00 0.26 H new ATOM 0 HG13 VAL A 130 12.849 -4.296 0.981 1.00 0.26 H new ATOM 0 HG21 VAL A 130 15.371 -3.919 2.699 1.00 0.26 H new ATOM 0 HG22 VAL A 130 13.922 -4.782 3.267 1.00 0.26 H new ATOM 0 HG23 VAL A 130 15.508 -5.587 3.302 1.00 0.26 H new ATOM 1419 N ASP A 131 14.949 -8.414 2.822 1.00 0.36 N ATOM 1420 CA ASP A 131 15.230 -9.061 4.101 1.00 0.44 C ATOM 1421 C ASP A 131 13.994 -9.799 4.628 1.00 0.43 C ATOM 1422 O ASP A 131 13.827 -9.994 5.830 1.00 0.50 O ATOM 1423 CB ASP A 131 15.727 -8.005 5.100 1.00 0.48 C ATOM 1424 CG ASP A 131 16.329 -8.592 6.366 1.00 0.59 C ATOM 1425 OD1 ASP A 131 17.456 -9.123 6.296 1.00 0.74 O ATOM 1426 OD2 ASP A 131 15.703 -8.485 7.442 1.00 0.59 O ATOM 0 H ASP A 131 15.525 -8.749 2.050 1.00 0.36 H new ATOM 0 HA ASP A 131 16.010 -9.810 3.964 1.00 0.44 H new ATOM 0 HB2 ASP A 131 16.473 -7.379 4.611 1.00 0.48 H new ATOM 0 HB3 ASP A 131 14.895 -7.356 5.372 1.00 0.48 H new ATOM 1431 N GLY A 132 13.125 -10.204 3.709 1.00 0.39 N ATOM 1432 CA GLY A 132 11.939 -10.956 4.074 1.00 0.40 C ATOM 1433 C GLY A 132 10.755 -10.067 4.404 1.00 0.40 C ATOM 1434 O GLY A 132 9.699 -10.554 4.809 1.00 0.59 O ATOM 0 H GLY A 132 13.222 -10.023 2.710 1.00 0.39 H new ATOM 0 HA2 GLY A 132 11.670 -11.621 3.254 1.00 0.40 H new ATOM 0 HA3 GLY A 132 12.165 -11.586 4.934 1.00 0.40 H new ATOM 1438 N LYS A 133 10.922 -8.765 4.223 1.00 0.30 N ATOM 1439 CA LYS A 133 9.881 -7.806 4.567 1.00 0.29 C ATOM 1440 C LYS A 133 9.608 -6.855 3.419 1.00 0.26 C ATOM 1441 O LYS A 133 10.485 -6.567 2.611 1.00 0.33 O ATOM 1442 CB LYS A 133 10.287 -7.019 5.812 1.00 0.33 C ATOM 1443 CG LYS A 133 10.245 -7.843 7.082 1.00 0.40 C ATOM 1444 CD LYS A 133 11.253 -7.354 8.103 1.00 0.80 C ATOM 1445 CE LYS A 133 12.670 -7.565 7.607 1.00 0.62 C ATOM 1446 NZ LYS A 133 13.684 -7.062 8.567 1.00 1.15 N ATOM 0 H LYS A 133 11.770 -8.347 3.839 1.00 0.30 H new ATOM 0 HA LYS A 133 8.965 -8.360 4.772 1.00 0.29 H new ATOM 0 HB2 LYS A 133 11.295 -6.629 5.674 1.00 0.33 H new ATOM 0 HB3 LYS A 133 9.625 -6.160 5.922 1.00 0.33 H new ATOM 0 HG2 LYS A 133 9.244 -7.800 7.510 1.00 0.40 H new ATOM 0 HG3 LYS A 133 10.446 -8.888 6.844 1.00 0.40 H new ATOM 0 HD2 LYS A 133 11.088 -6.296 8.305 1.00 0.80 H new ATOM 0 HD3 LYS A 133 11.110 -7.885 9.044 1.00 0.80 H new ATOM 0 HE2 LYS A 133 12.836 -8.628 7.430 1.00 0.62 H new ATOM 0 HE3 LYS A 133 12.797 -7.059 6.650 1.00 0.62 H new ATOM 0 HZ1 LYS A 133 14.634 -7.333 8.242 1.00 1.15 H new ATOM 0 HZ2 LYS A 133 13.621 -6.026 8.627 1.00 1.15 H new ATOM 0 HZ3 LYS A 133 13.508 -7.474 9.505 1.00 1.15 H new ATOM 1460 N TYR A 134 8.382 -6.379 3.356 1.00 0.25 N ATOM 1461 CA TYR A 134 7.969 -5.466 2.305 1.00 0.23 C ATOM 1462 C TYR A 134 8.133 -4.018 2.736 1.00 0.22 C ATOM 1463 O TYR A 134 7.776 -3.639 3.851 1.00 0.26 O ATOM 1464 CB TYR A 134 6.520 -5.722 1.919 1.00 0.28 C ATOM 1465 CG TYR A 134 6.352 -6.328 0.552 1.00 0.46 C ATOM 1466 CD1 TYR A 134 6.222 -5.530 -0.575 1.00 0.64 C ATOM 1467 CD2 TYR A 134 6.315 -7.695 0.392 1.00 0.63 C ATOM 1468 CE1 TYR A 134 6.050 -6.089 -1.825 1.00 0.88 C ATOM 1469 CE2 TYR A 134 6.140 -8.263 -0.858 1.00 0.86 C ATOM 1470 CZ TYR A 134 6.008 -7.456 -1.957 1.00 0.91 C ATOM 1471 OH TYR A 134 5.813 -8.017 -3.193 1.00 1.22 O ATOM 0 H TYR A 134 7.647 -6.610 4.025 1.00 0.25 H new ATOM 0 HA TYR A 134 8.610 -5.644 1.442 1.00 0.23 H new ATOM 0 HB2 TYR A 134 6.069 -6.385 2.658 1.00 0.28 H new ATOM 0 HB3 TYR A 134 5.972 -4.781 1.958 1.00 0.28 H new ATOM 0 HD1 TYR A 134 6.256 -4.455 -0.473 1.00 0.64 H new ATOM 0 HD2 TYR A 134 6.424 -8.334 1.256 1.00 0.63 H new ATOM 0 HE1 TYR A 134 5.949 -5.456 -2.694 1.00 0.88 H new ATOM 0 HE2 TYR A 134 6.108 -9.337 -0.966 1.00 0.86 H new ATOM 0 HH TYR A 134 5.473 -7.337 -3.811 1.00 1.22 H new ATOM 1481 N TYR A 135 8.676 -3.219 1.839 1.00 0.19 N ATOM 1482 CA TYR A 135 8.876 -1.806 2.079 1.00 0.20 C ATOM 1483 C TYR A 135 8.492 -1.025 0.846 1.00 0.19 C ATOM 1484 O TYR A 135 8.205 -1.600 -0.201 1.00 0.21 O ATOM 1485 CB TYR A 135 10.341 -1.505 2.414 1.00 0.19 C ATOM 1486 CG TYR A 135 10.886 -2.289 3.564 1.00 0.21 C ATOM 1487 CD1 TYR A 135 11.494 -3.509 3.354 1.00 0.22 C ATOM 1488 CD2 TYR A 135 10.805 -1.804 4.856 1.00 0.28 C ATOM 1489 CE1 TYR A 135 12.003 -4.232 4.391 1.00 0.26 C ATOM 1490 CE2 TYR A 135 11.316 -2.523 5.910 1.00 0.32 C ATOM 1491 CZ TYR A 135 11.917 -3.742 5.676 1.00 0.31 C ATOM 1492 OH TYR A 135 12.426 -4.469 6.726 1.00 0.37 O ATOM 0 H TYR A 135 8.991 -3.533 0.921 1.00 0.19 H new ATOM 0 HA TYR A 135 8.253 -1.515 2.925 1.00 0.20 H new ATOM 0 HB2 TYR A 135 10.951 -1.705 1.533 1.00 0.19 H new ATOM 0 HB3 TYR A 135 10.439 -0.442 2.636 1.00 0.19 H new ATOM 0 HD1 TYR A 135 11.568 -3.898 2.349 1.00 0.22 H new ATOM 0 HD2 TYR A 135 10.335 -0.849 5.039 1.00 0.28 H new ATOM 0 HE1 TYR A 135 12.473 -5.187 4.206 1.00 0.26 H new ATOM 0 HE2 TYR A 135 11.247 -2.136 6.916 1.00 0.32 H new ATOM 0 HH TYR A 135 12.283 -3.979 7.563 1.00 0.37 H new ATOM 1502 N VAL A 136 8.478 0.281 0.976 1.00 0.21 N ATOM 1503 CA VAL A 136 8.271 1.152 -0.155 1.00 0.22 C ATOM 1504 C VAL A 136 9.386 2.179 -0.217 1.00 0.23 C ATOM 1505 O VAL A 136 9.432 3.118 0.571 1.00 0.31 O ATOM 1506 CB VAL A 136 6.893 1.840 -0.093 1.00 0.25 C ATOM 1507 CG1 VAL A 136 6.770 2.903 -1.178 1.00 0.26 C ATOM 1508 CG2 VAL A 136 5.789 0.802 -0.235 1.00 0.26 C ATOM 0 H VAL A 136 8.609 0.766 1.863 1.00 0.21 H new ATOM 0 HA VAL A 136 8.289 0.550 -1.063 1.00 0.22 H new ATOM 0 HB VAL A 136 6.792 2.333 0.874 1.00 0.25 H new ATOM 0 HG11 VAL A 136 5.790 3.375 -1.115 1.00 0.26 H new ATOM 0 HG12 VAL A 136 7.545 3.656 -1.039 1.00 0.26 H new ATOM 0 HG13 VAL A 136 6.887 2.439 -2.157 1.00 0.26 H new ATOM 0 HG21 VAL A 136 4.818 1.295 -0.190 1.00 0.26 H new ATOM 0 HG22 VAL A 136 5.892 0.290 -1.192 1.00 0.26 H new ATOM 0 HG23 VAL A 136 5.865 0.077 0.575 1.00 0.26 H new ATOM 1518 N TYR A 137 10.275 2.001 -1.171 1.00 0.20 N ATOM 1519 CA TYR A 137 11.439 2.854 -1.303 1.00 0.24 C ATOM 1520 C TYR A 137 11.041 4.167 -1.907 1.00 0.27 C ATOM 1521 O TYR A 137 10.741 4.255 -3.087 1.00 0.46 O ATOM 1522 CB TYR A 137 12.493 2.184 -2.184 1.00 0.35 C ATOM 1523 CG TYR A 137 13.461 3.176 -2.772 1.00 0.50 C ATOM 1524 CD1 TYR A 137 14.331 3.856 -1.958 1.00 0.59 C ATOM 1525 CD2 TYR A 137 13.474 3.456 -4.130 1.00 0.63 C ATOM 1526 CE1 TYR A 137 15.197 4.791 -2.466 1.00 0.76 C ATOM 1527 CE2 TYR A 137 14.345 4.388 -4.653 1.00 0.78 C ATOM 1528 CZ TYR A 137 15.204 5.056 -3.814 1.00 0.77 C ATOM 1529 OH TYR A 137 16.069 5.996 -4.322 1.00 1.01 O ATOM 0 H TYR A 137 10.213 1.265 -1.874 1.00 0.20 H new ATOM 0 HA TYR A 137 11.862 3.023 -0.313 1.00 0.24 H new ATOM 0 HB2 TYR A 137 13.042 1.449 -1.595 1.00 0.35 H new ATOM 0 HB3 TYR A 137 11.998 1.641 -2.989 1.00 0.35 H new ATOM 0 HD1 TYR A 137 14.334 3.652 -0.898 1.00 0.59 H new ATOM 0 HD2 TYR A 137 12.792 2.937 -4.787 1.00 0.63 H new ATOM 0 HE1 TYR A 137 15.872 5.318 -1.808 1.00 0.76 H new ATOM 0 HE2 TYR A 137 14.352 4.591 -5.714 1.00 0.78 H new ATOM 0 HH TYR A 137 16.121 5.901 -5.296 1.00 1.01 H new ATOM 1539 N LEU A 138 11.030 5.183 -1.081 1.00 0.29 N ATOM 1540 CA LEU A 138 10.635 6.481 -1.525 1.00 0.38 C ATOM 1541 C LEU A 138 11.824 7.274 -2.019 1.00 0.44 C ATOM 1542 O LEU A 138 12.834 7.404 -1.328 1.00 0.50 O ATOM 1543 CB LEU A 138 9.945 7.205 -0.396 1.00 0.48 C ATOM 1544 CG LEU A 138 8.746 8.017 -0.837 1.00 0.64 C ATOM 1545 CD1 LEU A 138 7.800 7.145 -1.651 1.00 0.72 C ATOM 1546 CD2 LEU A 138 8.038 8.609 0.364 1.00 0.72 C ATOM 0 H LEU A 138 11.292 5.128 -0.097 1.00 0.29 H new ATOM 0 HA LEU A 138 9.944 6.372 -2.361 1.00 0.38 H new ATOM 0 HB2 LEU A 138 9.625 6.477 0.349 1.00 0.48 H new ATOM 0 HB3 LEU A 138 10.661 7.866 0.091 1.00 0.48 H new ATOM 0 HG LEU A 138 9.086 8.840 -1.466 1.00 0.64 H new ATOM 0 HD11 LEU A 138 6.940 7.736 -1.965 1.00 0.72 H new ATOM 0 HD12 LEU A 138 8.320 6.766 -2.531 1.00 0.72 H new ATOM 0 HD13 LEU A 138 7.462 6.307 -1.041 1.00 0.72 H new ATOM 0 HD21 LEU A 138 7.178 9.190 0.030 1.00 0.72 H new ATOM 0 HD22 LEU A 138 7.701 7.806 1.020 1.00 0.72 H new ATOM 0 HD23 LEU A 138 8.725 9.258 0.908 1.00 0.72 H new ATOM 1558 N LYS A 139 11.694 7.786 -3.225 1.00 0.46 N ATOM 1559 CA LYS A 139 12.717 8.625 -3.813 1.00 0.54 C ATOM 1560 C LYS A 139 12.509 10.075 -3.394 1.00 0.64 C ATOM 1561 O LYS A 139 13.411 10.903 -3.512 1.00 0.74 O ATOM 1562 CB LYS A 139 12.687 8.513 -5.335 1.00 0.56 C ATOM 1563 CG LYS A 139 13.014 7.122 -5.853 1.00 0.50 C ATOM 1564 CD LYS A 139 12.782 7.014 -7.353 1.00 0.59 C ATOM 1565 CE LYS A 139 13.615 8.017 -8.136 1.00 1.51 C ATOM 1566 NZ LYS A 139 15.073 7.774 -7.986 1.00 2.31 N ATOM 0 H LYS A 139 10.881 7.634 -3.822 1.00 0.46 H new ATOM 0 HA LYS A 139 13.690 8.288 -3.457 1.00 0.54 H new ATOM 0 HB2 LYS A 139 11.698 8.801 -5.692 1.00 0.56 H new ATOM 0 HB3 LYS A 139 13.397 9.224 -5.757 1.00 0.56 H new ATOM 0 HG2 LYS A 139 14.053 6.884 -5.627 1.00 0.50 H new ATOM 0 HG3 LYS A 139 12.399 6.386 -5.335 1.00 0.50 H new ATOM 0 HD2 LYS A 139 13.025 6.005 -7.685 1.00 0.59 H new ATOM 0 HD3 LYS A 139 11.726 7.175 -7.568 1.00 0.59 H new ATOM 0 HE2 LYS A 139 13.346 7.965 -9.191 1.00 1.51 H new ATOM 0 HE3 LYS A 139 13.380 9.026 -7.797 1.00 1.51 H new ATOM 0 HZ1 LYS A 139 15.598 8.415 -8.615 1.00 2.31 H new ATOM 0 HZ2 LYS A 139 15.354 7.949 -7.000 1.00 2.31 H new ATOM 0 HZ3 LYS A 139 15.288 6.788 -8.238 1.00 2.31 H new ATOM 1580 N ASP A 140 11.314 10.374 -2.894 1.00 0.66 N ATOM 1581 CA ASP A 140 10.975 11.722 -2.477 1.00 0.78 C ATOM 1582 C ASP A 140 10.209 11.674 -1.163 1.00 0.77 C ATOM 1583 O ASP A 140 9.033 12.030 -1.087 1.00 0.88 O ATOM 1584 CB ASP A 140 10.150 12.418 -3.560 1.00 1.00 C ATOM 1585 CG ASP A 140 9.935 13.890 -3.277 1.00 1.24 C ATOM 1586 OD1 ASP A 140 10.916 14.662 -3.348 1.00 1.57 O ATOM 1587 OD2 ASP A 140 8.787 14.289 -3.010 1.00 1.58 O ATOM 0 H ASP A 140 10.564 9.694 -2.769 1.00 0.66 H new ATOM 0 HA ASP A 140 11.891 12.294 -2.327 1.00 0.78 H new ATOM 0 HB2 ASP A 140 10.652 12.307 -4.521 1.00 1.00 H new ATOM 0 HB3 ASP A 140 9.182 11.924 -3.647 1.00 1.00 H new ATOM 1592 N ALA A 141 10.889 11.212 -0.128 1.00 0.73 N ATOM 1593 CA ALA A 141 10.292 11.090 1.192 1.00 0.79 C ATOM 1594 C ALA A 141 10.028 12.461 1.799 1.00 0.97 C ATOM 1595 O ALA A 141 9.094 12.639 2.584 1.00 1.12 O ATOM 1596 CB ALA A 141 11.199 10.276 2.097 1.00 0.86 C ATOM 0 H ALA A 141 11.863 10.913 -0.177 1.00 0.73 H new ATOM 0 HA ALA A 141 9.336 10.577 1.092 1.00 0.79 H new ATOM 0 HB1 ALA A 141 10.745 10.189 3.084 1.00 0.86 H new ATOM 0 HB2 ALA A 141 11.339 9.282 1.673 1.00 0.86 H new ATOM 0 HB3 ALA A 141 12.166 10.772 2.185 1.00 0.86 H new ATOM 1602 N ALA A 142 10.844 13.429 1.405 1.00 1.02 N ATOM 1603 CA ALA A 142 10.794 14.762 1.986 1.00 1.26 C ATOM 1604 C ALA A 142 9.516 15.509 1.619 1.00 1.37 C ATOM 1605 O ALA A 142 8.888 16.130 2.473 1.00 1.60 O ATOM 1606 CB ALA A 142 12.007 15.567 1.554 1.00 1.38 C ATOM 0 H ALA A 142 11.553 13.314 0.681 1.00 1.02 H new ATOM 0 HA ALA A 142 10.800 14.640 3.069 1.00 1.26 H new ATOM 0 HB1 ALA A 142 11.959 16.563 1.995 1.00 1.38 H new ATOM 0 HB2 ALA A 142 12.915 15.065 1.889 1.00 1.38 H new ATOM 0 HB3 ALA A 142 12.019 15.652 0.467 1.00 1.38 H new ATOM 1612 N HIS A 143 9.127 15.443 0.352 1.00 1.30 N ATOM 1613 CA HIS A 143 8.000 16.239 -0.132 1.00 1.50 C ATOM 1614 C HIS A 143 6.761 15.371 -0.297 1.00 1.25 C ATOM 1615 O HIS A 143 5.807 15.760 -0.974 1.00 1.33 O ATOM 1616 CB HIS A 143 8.332 16.900 -1.471 1.00 1.74 C ATOM 1617 CG HIS A 143 9.679 17.553 -1.521 1.00 2.20 C ATOM 1618 ND1 HIS A 143 10.745 17.015 -2.208 1.00 2.83 N ATOM 1619 CD2 HIS A 143 10.131 18.704 -0.975 1.00 2.47 C ATOM 1620 CE1 HIS A 143 11.791 17.807 -2.083 1.00 3.41 C ATOM 1621 NE2 HIS A 143 11.447 18.840 -1.339 1.00 3.11 N ATOM 0 H HIS A 143 9.568 14.854 -0.355 1.00 1.30 H new ATOM 0 HA HIS A 143 7.803 17.014 0.609 1.00 1.50 H new ATOM 0 HB2 HIS A 143 8.277 16.147 -2.257 1.00 1.74 H new ATOM 0 HB3 HIS A 143 7.571 17.648 -1.692 1.00 1.74 H new ATOM 0 HD1 HIS A 143 10.727 16.140 -2.732 1.00 2.83 H new ATOM 0 HD2 HIS A 143 9.562 19.390 -0.365 1.00 2.47 H new ATOM 0 HE1 HIS A 143 12.766 17.638 -2.517 1.00 3.41 H new ATOM 1630 N ALA A 144 6.797 14.201 0.339 1.00 0.99 N ATOM 1631 CA ALA A 144 5.731 13.211 0.257 1.00 0.77 C ATOM 1632 C ALA A 144 5.596 12.631 -1.132 1.00 0.76 C ATOM 1633 O ALA A 144 5.267 13.318 -2.099 1.00 1.13 O ATOM 1634 CB ALA A 144 4.405 13.779 0.718 1.00 0.88 C ATOM 0 H ALA A 144 7.576 13.913 0.931 1.00 0.99 H new ATOM 0 HA ALA A 144 6.013 12.402 0.931 1.00 0.77 H new ATOM 0 HB1 ALA A 144 3.635 13.012 0.643 1.00 0.88 H new ATOM 0 HB2 ALA A 144 4.490 14.107 1.754 1.00 0.88 H new ATOM 0 HB3 ALA A 144 4.135 14.628 0.090 1.00 0.88 H new ATOM 1640 N ASP A 145 5.840 11.347 -1.204 1.00 0.59 N ATOM 1641 CA ASP A 145 5.709 10.601 -2.430 1.00 0.87 C ATOM 1642 C ASP A 145 4.724 9.482 -2.212 1.00 0.66 C ATOM 1643 O ASP A 145 5.098 8.312 -2.195 1.00 0.75 O ATOM 1644 CB ASP A 145 7.064 10.073 -2.888 1.00 1.23 C ATOM 1645 CG ASP A 145 7.282 10.232 -4.375 1.00 1.79 C ATOM 1646 OD1 ASP A 145 6.343 10.660 -5.083 1.00 1.99 O ATOM 1647 OD2 ASP A 145 8.405 9.963 -4.840 1.00 2.20 O ATOM 0 H ASP A 145 6.138 10.785 -0.406 1.00 0.59 H new ATOM 0 HA ASP A 145 5.338 11.252 -3.222 1.00 0.87 H new ATOM 0 HB2 ASP A 145 7.854 10.598 -2.351 1.00 1.23 H new ATOM 0 HB3 ASP A 145 7.146 9.019 -2.624 1.00 1.23 H new ATOM 1652 N ASN A 146 3.472 9.883 -1.957 1.00 0.48 N ATOM 1653 CA ASN A 146 2.352 8.968 -1.758 1.00 0.32 C ATOM 1654 C ASN A 146 2.342 8.469 -0.328 1.00 0.25 C ATOM 1655 O ASN A 146 2.042 7.308 -0.077 1.00 0.37 O ATOM 1656 CB ASN A 146 2.469 7.756 -2.663 1.00 0.38 C ATOM 1657 CG ASN A 146 2.692 8.043 -4.122 1.00 0.76 C ATOM 1658 OD1 ASN A 146 2.167 8.999 -4.699 1.00 1.69 O ATOM 1659 ND2 ASN A 146 3.515 7.199 -4.712 1.00 0.65 N ATOM 0 H ASN A 146 3.210 10.866 -1.883 1.00 0.48 H new ATOM 0 HA ASN A 146 1.438 9.515 -1.989 1.00 0.32 H new ATOM 0 HB2 ASN A 146 3.292 7.138 -2.305 1.00 0.38 H new ATOM 0 HB3 ASN A 146 1.559 7.164 -2.564 1.00 0.38 H new ATOM 0 HD21 ASN A 146 3.748 7.319 -5.698 1.00 0.65 H new ATOM 0 HD22 ASN A 146 3.919 6.426 -4.183 1.00 0.65 H new ATOM 1666 N ILE A 147 2.671 9.332 0.614 1.00 0.30 N ATOM 1667 CA ILE A 147 2.761 8.914 2.001 1.00 0.34 C ATOM 1668 C ILE A 147 1.884 9.763 2.894 1.00 0.38 C ATOM 1669 O ILE A 147 2.028 10.985 2.960 1.00 0.46 O ATOM 1670 CB ILE A 147 4.205 8.963 2.537 1.00 0.42 C ATOM 1671 CG1 ILE A 147 5.119 8.079 1.686 1.00 0.46 C ATOM 1672 CG2 ILE A 147 4.245 8.531 4.003 1.00 0.49 C ATOM 1673 CD1 ILE A 147 4.749 6.609 1.699 1.00 0.50 C ATOM 0 H ILE A 147 2.879 10.317 0.448 1.00 0.30 H new ATOM 0 HA ILE A 147 2.415 7.881 2.021 1.00 0.34 H new ATOM 0 HB ILE A 147 4.566 9.990 2.474 1.00 0.42 H new ATOM 0 HG12 ILE A 147 5.098 8.438 0.657 1.00 0.46 H new ATOM 0 HG13 ILE A 147 6.144 8.187 2.041 1.00 0.46 H new ATOM 0 HG21 ILE A 147 5.272 8.571 4.366 1.00 0.49 H new ATOM 0 HG22 ILE A 147 3.624 9.201 4.597 1.00 0.49 H new ATOM 0 HG23 ILE A 147 3.868 7.512 4.092 1.00 0.49 H new ATOM 0 HD11 ILE A 147 5.446 6.053 1.072 1.00 0.50 H new ATOM 0 HD12 ILE A 147 4.798 6.230 2.720 1.00 0.50 H new ATOM 0 HD13 ILE A 147 3.737 6.485 1.315 1.00 0.50 H new ATOM 1685 N ARG A 148 0.971 9.104 3.570 1.00 0.36 N ATOM 1686 CA ARG A 148 0.186 9.738 4.606 1.00 0.38 C ATOM 1687 C ARG A 148 0.680 9.172 5.928 1.00 0.36 C ATOM 1688 O ARG A 148 0.667 7.956 6.124 1.00 0.39 O ATOM 1689 CB ARG A 148 -1.311 9.462 4.412 1.00 0.45 C ATOM 1690 CG ARG A 148 -1.784 9.521 2.958 1.00 0.62 C ATOM 1691 CD ARG A 148 -1.337 10.785 2.224 1.00 0.83 C ATOM 1692 NE ARG A 148 -1.895 12.007 2.796 1.00 0.98 N ATOM 1693 CZ ARG A 148 -2.666 12.868 2.124 1.00 1.03 C ATOM 1694 NH1 ARG A 148 -2.970 12.649 0.852 1.00 1.40 N ATOM 1695 NH2 ARG A 148 -3.116 13.963 2.722 1.00 1.78 N ATOM 0 H ARG A 148 0.752 8.119 3.419 1.00 0.36 H new ATOM 0 HA ARG A 148 0.304 10.821 4.577 1.00 0.38 H new ATOM 0 HB2 ARG A 148 -1.541 8.476 4.816 1.00 0.45 H new ATOM 0 HB3 ARG A 148 -1.880 10.186 4.995 1.00 0.45 H new ATOM 0 HG2 ARG A 148 -1.407 8.648 2.425 1.00 0.62 H new ATOM 0 HG3 ARG A 148 -2.872 9.462 2.935 1.00 0.62 H new ATOM 0 HD2 ARG A 148 -0.249 10.845 2.245 1.00 0.83 H new ATOM 0 HD3 ARG A 148 -1.632 10.713 1.177 1.00 0.83 H new ATOM 0 HE ARG A 148 -1.683 12.217 3.771 1.00 0.98 H new ATOM 0 HH11 ARG A 148 -2.615 11.818 0.379 1.00 1.40 H new ATOM 0 HH12 ARG A 148 -3.559 13.311 0.347 1.00 1.40 H new ATOM 0 HH21 ARG A 148 -2.874 14.149 3.695 1.00 1.78 H new ATOM 0 HH22 ARG A 148 -3.704 14.619 2.209 1.00 1.78 H new ATOM 1709 N THR A 149 1.151 10.039 6.815 1.00 0.33 N ATOM 1710 CA THR A 149 1.747 9.589 8.066 1.00 0.31 C ATOM 1711 C THR A 149 0.721 8.882 8.924 1.00 0.28 C ATOM 1712 O THR A 149 -0.460 9.080 8.722 1.00 0.29 O ATOM 1713 CB THR A 149 2.343 10.764 8.861 1.00 0.34 C ATOM 1714 OG1 THR A 149 1.420 11.861 8.889 1.00 0.37 O ATOM 1715 CG2 THR A 149 3.658 11.211 8.246 1.00 0.40 C ATOM 0 H THR A 149 1.132 11.051 6.693 1.00 0.33 H new ATOM 0 HA THR A 149 2.548 8.896 7.808 1.00 0.31 H new ATOM 0 HB THR A 149 2.530 10.429 9.881 1.00 0.34 H new ATOM 0 HG1 THR A 149 1.808 12.602 9.399 1.00 0.37 H new ATOM 0 HG21 THR A 149 4.065 12.043 8.821 1.00 0.40 H new ATOM 0 HG22 THR A 149 4.365 10.382 8.257 1.00 0.40 H new ATOM 0 HG23 THR A 149 3.489 11.530 7.217 1.00 0.40 H new ATOM 1723 N LYS A 150 1.155 8.072 9.881 1.00 0.31 N ATOM 1724 CA LYS A 150 0.214 7.402 10.778 1.00 0.34 C ATOM 1725 C LYS A 150 -0.643 8.433 11.479 1.00 0.31 C ATOM 1726 O LYS A 150 -1.812 8.197 11.796 1.00 0.39 O ATOM 1727 CB LYS A 150 0.941 6.547 11.808 1.00 0.41 C ATOM 1728 CG LYS A 150 1.432 5.228 11.251 1.00 0.63 C ATOM 1729 CD LYS A 150 0.966 4.067 12.110 1.00 1.48 C ATOM 1730 CE LYS A 150 -0.551 3.963 12.150 1.00 2.24 C ATOM 1731 NZ LYS A 150 -1.014 2.929 13.113 1.00 3.02 N ATOM 0 H LYS A 150 2.138 7.863 10.057 1.00 0.31 H new ATOM 0 HA LYS A 150 -0.416 6.744 10.180 1.00 0.34 H new ATOM 0 HB2 LYS A 150 1.790 7.107 12.200 1.00 0.41 H new ATOM 0 HB3 LYS A 150 0.272 6.353 12.646 1.00 0.41 H new ATOM 0 HG2 LYS A 150 1.066 5.101 10.232 1.00 0.63 H new ATOM 0 HG3 LYS A 150 2.521 5.233 11.200 1.00 0.63 H new ATOM 0 HD2 LYS A 150 1.383 3.138 11.722 1.00 1.48 H new ATOM 0 HD3 LYS A 150 1.348 4.189 13.123 1.00 1.48 H new ATOM 0 HE2 LYS A 150 -0.973 4.929 12.425 1.00 2.24 H new ATOM 0 HE3 LYS A 150 -0.924 3.724 11.154 1.00 2.24 H new ATOM 0 HZ1 LYS A 150 -2.053 2.891 13.109 1.00 3.02 H new ATOM 0 HZ2 LYS A 150 -0.633 2.002 12.837 1.00 3.02 H new ATOM 0 HZ3 LYS A 150 -0.680 3.170 14.068 1.00 3.02 H new ATOM 1745 N GLU A 151 -0.047 9.591 11.684 1.00 0.29 N ATOM 1746 CA GLU A 151 -0.741 10.709 12.293 1.00 0.34 C ATOM 1747 C GLU A 151 -1.813 11.241 11.356 1.00 0.36 C ATOM 1748 O GLU A 151 -2.930 11.548 11.779 1.00 0.48 O ATOM 1749 CB GLU A 151 0.247 11.822 12.634 1.00 0.44 C ATOM 1750 CG GLU A 151 1.435 11.354 13.448 1.00 0.56 C ATOM 1751 CD GLU A 151 2.501 12.417 13.577 1.00 1.01 C ATOM 1752 OE1 GLU A 151 3.357 12.519 12.674 1.00 1.36 O ATOM 1753 OE2 GLU A 151 2.490 13.152 14.585 1.00 1.19 O ATOM 0 H GLU A 151 0.924 9.783 11.436 1.00 0.29 H new ATOM 0 HA GLU A 151 -1.215 10.361 13.211 1.00 0.34 H new ATOM 0 HB2 GLU A 151 0.607 12.272 11.709 1.00 0.44 H new ATOM 0 HB3 GLU A 151 -0.276 12.603 13.186 1.00 0.44 H new ATOM 0 HG2 GLU A 151 1.097 11.060 14.442 1.00 0.56 H new ATOM 0 HG3 GLU A 151 1.865 10.467 12.982 1.00 0.56 H new ATOM 1760 N GLU A 152 -1.473 11.335 10.081 1.00 0.34 N ATOM 1761 CA GLU A 152 -2.412 11.803 9.085 1.00 0.40 C ATOM 1762 C GLU A 152 -3.371 10.691 8.676 1.00 0.40 C ATOM 1763 O GLU A 152 -4.476 10.970 8.239 1.00 0.50 O ATOM 1764 CB GLU A 152 -1.678 12.356 7.865 1.00 0.44 C ATOM 1765 CG GLU A 152 -2.603 12.720 6.716 1.00 0.54 C ATOM 1766 CD GLU A 152 -1.894 13.451 5.604 1.00 0.67 C ATOM 1767 OE1 GLU A 152 -0.887 12.927 5.090 1.00 0.83 O ATOM 1768 OE2 GLU A 152 -2.352 14.547 5.223 1.00 0.76 O ATOM 0 H GLU A 152 -0.552 11.092 9.715 1.00 0.34 H new ATOM 0 HA GLU A 152 -2.996 12.610 9.527 1.00 0.40 H new ATOM 0 HB2 GLU A 152 -1.113 13.240 8.160 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.955 11.617 7.519 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -3.055 11.812 6.317 1.00 0.54 H new ATOM 0 HG3 GLU A 152 -3.416 13.341 7.093 1.00 0.54 H new ATOM 1775 N ILE A 153 -2.953 9.436 8.822 1.00 0.34 N ATOM 1776 CA ILE A 153 -3.822 8.304 8.536 1.00 0.35 C ATOM 1777 C ILE A 153 -5.137 8.464 9.266 1.00 0.39 C ATOM 1778 O ILE A 153 -6.189 8.454 8.645 1.00 0.43 O ATOM 1779 CB ILE A 153 -3.183 6.946 8.918 1.00 0.35 C ATOM 1780 CG1 ILE A 153 -2.010 6.635 7.985 1.00 0.39 C ATOM 1781 CG2 ILE A 153 -4.219 5.824 8.867 1.00 0.43 C ATOM 1782 CD1 ILE A 153 -1.342 5.306 8.262 1.00 0.47 C ATOM 0 H ILE A 153 -2.017 9.180 9.137 1.00 0.34 H new ATOM 0 HA ILE A 153 -3.985 8.296 7.458 1.00 0.35 H new ATOM 0 HB ILE A 153 -2.810 7.016 9.940 1.00 0.35 H new ATOM 0 HG12 ILE A 153 -2.366 6.644 6.955 1.00 0.39 H new ATOM 0 HG13 ILE A 153 -1.268 7.429 8.073 1.00 0.39 H new ATOM 0 HG21 ILE A 153 -3.747 4.880 9.139 1.00 0.43 H new ATOM 0 HG22 ILE A 153 -5.026 6.041 9.567 1.00 0.43 H new ATOM 0 HG23 ILE A 153 -4.625 5.749 7.858 1.00 0.43 H new ATOM 0 HD11 ILE A 153 -0.521 5.158 7.560 1.00 0.47 H new ATOM 0 HD12 ILE A 153 -0.954 5.299 9.281 1.00 0.47 H new ATOM 0 HD13 ILE A 153 -2.069 4.502 8.145 1.00 0.47 H new ATOM 1794 N LYS A 154 -5.073 8.673 10.577 1.00 0.42 N ATOM 1795 CA LYS A 154 -6.289 8.818 11.376 1.00 0.50 C ATOM 1796 C LYS A 154 -7.088 10.050 10.928 1.00 0.56 C ATOM 1797 O LYS A 154 -8.306 10.107 11.092 1.00 0.64 O ATOM 1798 CB LYS A 154 -5.928 8.921 12.860 1.00 0.57 C ATOM 1799 CG LYS A 154 -7.128 9.047 13.787 1.00 1.42 C ATOM 1800 CD LYS A 154 -6.696 9.296 15.224 1.00 1.77 C ATOM 1801 CE LYS A 154 -7.885 9.581 16.127 1.00 2.57 C ATOM 1802 NZ LYS A 154 -8.709 10.712 15.619 1.00 3.43 N ATOM 0 H LYS A 154 -4.204 8.745 11.106 1.00 0.42 H new ATOM 0 HA LYS A 154 -6.914 7.938 11.226 1.00 0.50 H new ATOM 0 HB2 LYS A 154 -5.354 8.039 13.145 1.00 0.57 H new ATOM 0 HB3 LYS A 154 -5.279 9.784 13.005 1.00 0.57 H new ATOM 0 HG2 LYS A 154 -7.765 9.865 13.450 1.00 1.42 H new ATOM 0 HG3 LYS A 154 -7.725 8.136 13.738 1.00 1.42 H new ATOM 0 HD2 LYS A 154 -6.156 8.426 15.597 1.00 1.77 H new ATOM 0 HD3 LYS A 154 -6.005 10.138 15.256 1.00 1.77 H new ATOM 0 HE2 LYS A 154 -8.504 8.687 16.205 1.00 2.57 H new ATOM 0 HE3 LYS A 154 -7.531 9.812 17.132 1.00 2.57 H new ATOM 0 HZ1 LYS A 154 -9.287 11.096 16.394 1.00 3.43 H new ATOM 0 HZ2 LYS A 154 -8.085 11.458 15.250 1.00 3.43 H new ATOM 0 HZ3 LYS A 154 -9.332 10.373 14.858 1.00 3.43 H new ATOM 1816 N ARG A 155 -6.394 11.030 10.355 1.00 0.54 N ATOM 1817 CA ARG A 155 -7.042 12.216 9.795 1.00 0.63 C ATOM 1818 C ARG A 155 -7.713 11.871 8.474 1.00 0.66 C ATOM 1819 O ARG A 155 -8.815 12.327 8.176 1.00 0.80 O ATOM 1820 CB ARG A 155 -6.027 13.323 9.560 1.00 0.65 C ATOM 1821 CG ARG A 155 -5.237 13.697 10.798 1.00 1.21 C ATOM 1822 CD ARG A 155 -4.365 14.911 10.545 1.00 1.31 C ATOM 1823 NE ARG A 155 -3.467 15.188 11.666 1.00 2.28 N ATOM 1824 CZ ARG A 155 -2.625 16.220 11.708 1.00 2.71 C ATOM 1825 NH1 ARG A 155 -2.599 17.106 10.716 1.00 2.34 N ATOM 1826 NH2 ARG A 155 -1.818 16.370 12.751 1.00 3.70 N ATOM 0 H ARG A 155 -5.378 11.027 10.265 1.00 0.54 H new ATOM 0 HA ARG A 155 -7.789 12.561 10.509 1.00 0.63 H new ATOM 0 HB2 ARG A 155 -5.335 13.009 8.779 1.00 0.65 H new ATOM 0 HB3 ARG A 155 -6.546 14.207 9.190 1.00 0.65 H new ATOM 0 HG2 ARG A 155 -5.921 13.903 11.621 1.00 1.21 H new ATOM 0 HG3 ARG A 155 -4.615 12.856 11.103 1.00 1.21 H new ATOM 0 HD2 ARG A 155 -3.777 14.752 9.641 1.00 1.31 H new ATOM 0 HD3 ARG A 155 -4.998 15.780 10.365 1.00 1.31 H new ATOM 0 HE ARG A 155 -3.487 14.553 12.464 1.00 2.28 H new ATOM 0 HH11 ARG A 155 -3.225 16.997 9.918 1.00 2.34 H new ATOM 0 HH12 ARG A 155 -1.953 17.894 10.753 1.00 2.34 H new ATOM 0 HH21 ARG A 155 -1.844 15.697 13.517 1.00 3.70 H new ATOM 0 HH22 ARG A 155 -1.172 17.159 12.787 1.00 3.70 H new ATOM 1840 N GLN A 156 -7.023 11.052 7.698 1.00 0.58 N ATOM 1841 CA GLN A 156 -7.494 10.606 6.399 1.00 0.70 C ATOM 1842 C GLN A 156 -8.663 9.632 6.556 1.00 0.67 C ATOM 1843 O GLN A 156 -9.442 9.414 5.625 1.00 0.80 O ATOM 1844 CB GLN A 156 -6.334 9.953 5.645 1.00 0.77 C ATOM 1845 CG GLN A 156 -5.255 10.951 5.243 1.00 0.85 C ATOM 1846 CD GLN A 156 -5.657 11.775 4.037 1.00 1.05 C ATOM 1847 OE1 GLN A 156 -6.213 12.863 4.171 1.00 1.88 O ATOM 1848 NE2 GLN A 156 -5.395 11.255 2.849 1.00 0.92 N ATOM 0 H GLN A 156 -6.111 10.675 7.955 1.00 0.58 H new ATOM 0 HA GLN A 156 -7.854 11.462 5.828 1.00 0.70 H new ATOM 0 HB2 GLN A 156 -5.891 9.178 6.270 1.00 0.77 H new ATOM 0 HB3 GLN A 156 -6.718 9.461 4.752 1.00 0.77 H new ATOM 0 HG2 GLN A 156 -5.047 11.615 6.082 1.00 0.85 H new ATOM 0 HG3 GLN A 156 -4.331 10.416 5.023 1.00 0.85 H new ATOM 0 HE21 GLN A 156 -4.932 10.349 2.780 1.00 0.92 H new ATOM 0 HE22 GLN A 156 -5.656 11.760 2.002 1.00 0.92 H new ATOM 1857 N LYS A 157 -8.778 9.061 7.752 1.00 0.55 N ATOM 1858 CA LYS A 157 -9.848 8.124 8.081 1.00 0.54 C ATOM 1859 C LYS A 157 -11.132 8.862 8.441 1.00 0.62 C ATOM 1860 O LYS A 157 -12.171 8.247 8.687 1.00 0.67 O ATOM 1861 CB LYS A 157 -9.418 7.230 9.232 1.00 0.50 C ATOM 1862 CG LYS A 157 -8.156 6.453 8.929 1.00 0.81 C ATOM 1863 CD LYS A 157 -8.435 4.981 8.786 1.00 1.02 C ATOM 1864 CE LYS A 157 -8.498 4.355 10.151 1.00 0.68 C ATOM 1865 NZ LYS A 157 -9.099 3.001 10.131 1.00 0.90 N ATOM 0 H LYS A 157 -8.131 9.235 8.521 1.00 0.55 H new ATOM 0 HA LYS A 157 -10.046 7.509 7.203 1.00 0.54 H new ATOM 0 HB2 LYS A 157 -9.259 7.841 10.121 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -10.222 6.532 9.464 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -7.707 6.830 8.010 1.00 0.81 H new ATOM 0 HG3 LYS A 157 -7.430 6.611 9.727 1.00 0.81 H new ATOM 0 HD2 LYS A 157 -9.376 4.827 8.258 1.00 1.02 H new ATOM 0 HD3 LYS A 157 -7.654 4.507 8.191 1.00 1.02 H new ATOM 0 HE2 LYS A 157 -7.492 4.295 10.566 1.00 0.68 H new ATOM 0 HE3 LYS A 157 -9.079 4.996 10.814 1.00 0.68 H new ATOM 0 HZ1 LYS A 157 -9.414 2.747 11.089 1.00 0.90 H new ATOM 0 HZ2 LYS A 157 -9.914 2.992 9.485 1.00 0.90 H new ATOM 0 HZ3 LYS A 157 -8.392 2.312 9.805 1.00 0.90 H new ATOM 1879 N GLN A 158 -11.052 10.180 8.475 1.00 0.74 N ATOM 1880 CA GLN A 158 -12.193 11.008 8.778 1.00 0.91 C ATOM 1881 C GLN A 158 -12.913 11.398 7.494 1.00 1.15 C ATOM 1882 O GLN A 158 -14.013 10.869 7.243 1.00 1.78 O ATOM 1883 CB GLN A 158 -11.727 12.240 9.541 1.00 1.18 C ATOM 1884 CG GLN A 158 -10.978 11.892 10.817 1.00 1.48 C ATOM 1885 CD GLN A 158 -10.425 13.104 11.534 1.00 1.88 C ATOM 1886 OE1 GLN A 158 -10.986 14.196 11.461 1.00 2.12 O ATOM 1887 NE2 GLN A 158 -9.317 12.923 12.235 1.00 2.52 N ATOM 0 H GLN A 158 -10.194 10.700 8.293 1.00 0.74 H new ATOM 0 HA GLN A 158 -12.897 10.455 9.400 1.00 0.91 H new ATOM 0 HB2 GLN A 158 -11.082 12.838 8.898 1.00 1.18 H new ATOM 0 HB3 GLN A 158 -12.591 12.857 9.788 1.00 1.18 H new ATOM 0 HG2 GLN A 158 -11.648 11.355 11.489 1.00 1.48 H new ATOM 0 HG3 GLN A 158 -10.158 11.215 10.576 1.00 1.48 H new ATOM 0 HE21 GLN A 158 -8.881 12.002 12.271 1.00 2.52 H new ATOM 0 HE22 GLN A 158 -8.899 13.705 12.739 1.00 2.52 H new ATOM 1896 N GLU A 159 -12.363 12.205 6.717 1.00 1.48 N TER 1897 GLU A 159 HETATM 1898 ZN ZN A1159 -12.660 0.006 1.483 1.00 0.33 ZN