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 77 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Set 1.2: A 89 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 60 SER OG : rot 81:sc= 0.992 USER MOD Set 2.2: A 69 GLN : amide:sc= -0.482 K(o=0.51,f=-2.2!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 49 GLN : amide:sc= -1.89! C(o=-1.9!,f=-7.3!) USER MOD Single : A 50 LYS NZ :NH3+ 150:sc= 1.28 (180deg=1.26) USER MOD Single : A 53 ASN : amide:sc= 0.0432 K(o=0.043,f=-3!) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.285 USER MOD Single : A 61 LYS NZ :NH3+ -162:sc= -0.88 (180deg=-1.7!) USER MOD Single : A 66 ASN : amide:sc= -0.903 K(o=-0.9,f=-2.6!) USER MOD Single : A 73 LYS NZ :NH3+ -171:sc=-0.000665 (180deg=-0.134) USER MOD Single : A 75 THR OG1 : rot 1:sc= 1.18 USER MOD Single : A 79 TYR OH : rot 107:sc= -2.2! USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 61:sc= -0.0481 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot -3:sc= 0.162 USER MOD Single : A 91 ASN : amide:sc= -0.233 X(o=-0.23,f=-0.42) USER MOD Single : A 93 LYS NZ :NH3+ -162:sc= -0.0701 (180deg=-0.416) USER MOD Single : A 96 TYR OH : rot 109:sc= 0.0875 USER MOD Single : A 101 SER OG : rot 130:sc= 0.299 USER MOD Single : A 106 MET CE :methyl -108:sc= -1.16 (180deg=-5.86!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.0214 X(o=-0.021,f=-0.013) USER MOD Single : A 111 TYR OH : rot 40:sc= 1.25 USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ -167:sc=-0.00774 (180deg=-0.146) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -3.25! C(o=-3.3!,f=-5.6!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot -140:sc= 0.549 USER MOD Single : A 129 LYS NZ :NH3+ -170:sc= 1.28 (180deg=1.18) USER MOD Single : A 133 LYS NZ :NH3+ -158:sc= 2.04 (180deg=1.2) USER MOD Single : A 134 TYR OH : rot 180:sc= -2.05! USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 ASN : amide:sc= -2.27! C(o=-2.3!,f=-12!) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.0399 USER MOD Single : A 150 LYS NZ :NH3+ 164:sc= 1.2 (180deg=0.643) USER MOD Single : A 154 LYS NZ :NH3+ -170:sc=-0.00636 (180deg=-0.119) USER MOD Single : A 156 GLN : amide:sc= -1.75! C(o=-1.8!,f=-2.5!) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 40 -26.440 -12.870 -3.810 1.00 13.12 N ATOM 2 CA SER A 40 -26.708 -12.066 -2.602 1.00 12.82 C ATOM 3 C SER A 40 -25.494 -11.205 -2.273 1.00 12.18 C ATOM 4 O SER A 40 -24.371 -11.707 -2.197 1.00 11.93 O ATOM 5 CB SER A 40 -27.045 -12.994 -1.428 1.00 13.03 C ATOM 6 OG SER A 40 -27.490 -12.264 -0.295 1.00 13.46 O ATOM 0 HA SER A 40 -27.559 -11.410 -2.784 1.00 12.82 H new ATOM 0 HB2 SER A 40 -27.817 -13.701 -1.732 1.00 13.03 H new ATOM 0 HB3 SER A 40 -26.165 -13.579 -1.162 1.00 13.03 H new ATOM 0 HG SER A 40 -27.698 -12.886 0.434 1.00 13.46 H new ATOM 13 N TYR A 41 -25.714 -9.911 -2.084 1.00 12.10 N ATOM 14 CA TYR A 41 -24.623 -8.989 -1.803 1.00 11.74 C ATOM 15 C TYR A 41 -24.864 -8.225 -0.511 1.00 11.26 C ATOM 16 O TYR A 41 -26.006 -7.999 -0.109 1.00 11.61 O ATOM 17 CB TYR A 41 -24.422 -8.018 -2.966 1.00 12.43 C ATOM 18 CG TYR A 41 -23.775 -8.655 -4.170 1.00 13.20 C ATOM 19 CD1 TYR A 41 -22.403 -8.853 -4.218 1.00 13.55 C ATOM 20 CD2 TYR A 41 -24.537 -9.062 -5.251 1.00 13.72 C ATOM 21 CE1 TYR A 41 -21.807 -9.442 -5.315 1.00 14.41 C ATOM 22 CE2 TYR A 41 -23.951 -9.654 -6.352 1.00 14.56 C ATOM 23 CZ TYR A 41 -22.585 -9.840 -6.379 1.00 14.90 C ATOM 24 OH TYR A 41 -21.995 -10.429 -7.476 1.00 15.87 O ATOM 0 H TYR A 41 -26.636 -9.477 -2.120 1.00 12.10 H new ATOM 0 HA TYR A 41 -23.715 -9.579 -1.681 1.00 11.74 H new ATOM 0 HB2 TYR A 41 -25.388 -7.606 -3.257 1.00 12.43 H new ATOM 0 HB3 TYR A 41 -23.807 -7.183 -2.631 1.00 12.43 H new ATOM 0 HD1 TYR A 41 -21.791 -8.541 -3.384 1.00 13.55 H new ATOM 0 HD2 TYR A 41 -25.607 -8.914 -5.233 1.00 13.72 H new ATOM 0 HE1 TYR A 41 -20.737 -9.590 -5.339 1.00 14.41 H new ATOM 0 HE2 TYR A 41 -24.559 -9.970 -7.187 1.00 14.56 H new ATOM 0 HH TYR A 41 -22.683 -10.652 -8.137 1.00 15.87 H new ATOM 34 N ILE A 42 -23.775 -7.842 0.136 1.00 10.66 N ATOM 35 CA ILE A 42 -23.835 -7.149 1.407 1.00 10.40 C ATOM 36 C ILE A 42 -24.105 -5.649 1.216 1.00 10.44 C ATOM 37 O ILE A 42 -25.265 -5.236 1.214 1.00 10.49 O ATOM 38 CB ILE A 42 -22.543 -7.393 2.233 1.00 9.97 C ATOM 39 CG1 ILE A 42 -22.437 -8.874 2.614 1.00 9.82 C ATOM 40 CG2 ILE A 42 -22.502 -6.521 3.485 1.00 10.25 C ATOM 41 CD1 ILE A 42 -23.596 -9.379 3.445 1.00 10.06 C ATOM 0 H ILE A 42 -22.828 -8.004 -0.207 1.00 10.66 H new ATOM 0 HA ILE A 42 -24.673 -7.559 1.971 1.00 10.40 H new ATOM 0 HB ILE A 42 -21.691 -7.118 1.611 1.00 9.97 H new ATOM 0 HG12 ILE A 42 -22.369 -9.469 1.703 1.00 9.82 H new ATOM 0 HG13 ILE A 42 -21.511 -9.031 3.167 1.00 9.82 H new ATOM 0 HG21 ILE A 42 -21.583 -6.720 4.037 1.00 10.25 H new ATOM 0 HG22 ILE A 42 -22.532 -5.470 3.198 1.00 10.25 H new ATOM 0 HG23 ILE A 42 -23.361 -6.750 4.116 1.00 10.25 H new ATOM 0 HD11 ILE A 42 -23.447 -10.434 3.674 1.00 10.06 H new ATOM 0 HD12 ILE A 42 -23.653 -8.811 4.374 1.00 10.06 H new ATOM 0 HD13 ILE A 42 -24.524 -9.256 2.887 1.00 10.06 H new ATOM 53 N ASP A 43 -23.048 -4.851 1.018 1.00 10.68 N ATOM 54 CA ASP A 43 -23.174 -3.388 0.879 1.00 11.02 C ATOM 55 C ASP A 43 -21.795 -2.733 0.934 1.00 11.08 C ATOM 56 O ASP A 43 -21.362 -2.271 1.988 1.00 11.69 O ATOM 57 CB ASP A 43 -24.051 -2.799 1.993 1.00 11.24 C ATOM 58 CG ASP A 43 -24.322 -1.320 1.807 1.00 11.95 C ATOM 59 OD1 ASP A 43 -25.049 -0.961 0.860 1.00 12.25 O ATOM 60 OD2 ASP A 43 -23.826 -0.510 2.613 1.00 12.35 O ATOM 0 H ASP A 43 -22.089 -5.193 0.950 1.00 10.68 H new ATOM 0 HA ASP A 43 -23.643 -3.186 -0.084 1.00 11.02 H new ATOM 0 HB2 ASP A 43 -24.999 -3.336 2.025 1.00 11.24 H new ATOM 0 HB3 ASP A 43 -23.563 -2.956 2.955 1.00 11.24 H new ATOM 65 N GLY A 44 -21.089 -2.746 -0.189 1.00 10.65 N ATOM 66 CA GLY A 44 -19.729 -2.213 -0.245 1.00 10.86 C ATOM 67 C GLY A 44 -18.727 -3.137 0.428 1.00 10.53 C ATOM 68 O GLY A 44 -17.551 -3.174 0.075 1.00 10.64 O ATOM 0 H GLY A 44 -21.433 -3.119 -1.074 1.00 10.65 H new ATOM 0 HA2 GLY A 44 -19.441 -2.062 -1.285 1.00 10.86 H new ATOM 0 HA3 GLY A 44 -19.702 -1.236 0.238 1.00 10.86 H new ATOM 72 N ASP A 45 -19.226 -3.903 1.379 1.00 10.35 N ATOM 73 CA ASP A 45 -18.508 -5.008 1.987 1.00 10.29 C ATOM 74 C ASP A 45 -19.000 -6.278 1.315 1.00 9.54 C ATOM 75 O ASP A 45 -19.177 -7.309 1.952 1.00 9.39 O ATOM 76 CB ASP A 45 -18.741 -5.049 3.496 1.00 10.94 C ATOM 77 CG ASP A 45 -17.692 -5.872 4.216 1.00 11.21 C ATOM 78 OD1 ASP A 45 -16.531 -5.409 4.302 1.00 11.45 O ATOM 79 OD2 ASP A 45 -18.016 -6.976 4.701 1.00 11.37 O ATOM 0 H ASP A 45 -20.163 -3.772 1.759 1.00 10.35 H new ATOM 0 HA ASP A 45 -17.433 -4.895 1.847 1.00 10.29 H new ATOM 0 HB2 ASP A 45 -18.736 -4.033 3.890 1.00 10.94 H new ATOM 0 HB3 ASP A 45 -19.728 -5.465 3.698 1.00 10.94 H new ATOM 84 N GLN A 46 -19.213 -6.124 -0.001 1.00 9.30 N ATOM 85 CA GLN A 46 -20.066 -6.952 -0.872 1.00 8.82 C ATOM 86 C GLN A 46 -20.357 -8.374 -0.401 1.00 7.96 C ATOM 87 O GLN A 46 -21.481 -8.837 -0.569 1.00 7.83 O ATOM 88 CB GLN A 46 -19.478 -6.975 -2.276 1.00 9.37 C ATOM 89 CG GLN A 46 -18.055 -7.451 -2.303 1.00 9.97 C ATOM 90 CD GLN A 46 -17.464 -7.479 -3.697 1.00 10.63 C ATOM 91 OE1 GLN A 46 -18.169 -7.689 -4.684 1.00 11.07 O ATOM 92 NE2 GLN A 46 -16.165 -7.255 -3.791 1.00 10.92 N ATOM 0 H GLN A 46 -18.765 -5.369 -0.520 1.00 9.30 H new ATOM 0 HA GLN A 46 -21.042 -6.467 -0.844 1.00 8.82 H new ATOM 0 HB2 GLN A 46 -20.085 -7.623 -2.909 1.00 9.37 H new ATOM 0 HB3 GLN A 46 -19.529 -5.973 -2.703 1.00 9.37 H new ATOM 0 HG2 GLN A 46 -17.449 -6.802 -1.671 1.00 9.97 H new ATOM 0 HG3 GLN A 46 -18.005 -8.451 -1.873 1.00 9.97 H new ATOM 0 HE21 GLN A 46 -15.615 -7.085 -2.949 1.00 10.92 H new ATOM 0 HE22 GLN A 46 -15.713 -7.252 -4.705 1.00 10.92 H new ATOM 101 N ALA A 47 -19.394 -9.082 0.158 1.00 7.63 N ATOM 102 CA ALA A 47 -19.685 -10.406 0.689 1.00 7.10 C ATOM 103 C ALA A 47 -18.595 -10.921 1.610 1.00 6.23 C ATOM 104 O ALA A 47 -18.284 -12.112 1.610 1.00 6.37 O ATOM 105 CB ALA A 47 -19.940 -11.378 -0.440 1.00 7.70 C ATOM 0 H ALA A 47 -18.426 -8.776 0.257 1.00 7.63 H new ATOM 0 HA ALA A 47 -20.586 -10.318 1.296 1.00 7.10 H new ATOM 0 HB1 ALA A 47 -20.156 -12.364 -0.029 1.00 7.70 H new ATOM 0 HB2 ALA A 47 -20.791 -11.036 -1.029 1.00 7.70 H new ATOM 0 HB3 ALA A 47 -19.057 -11.436 -1.077 1.00 7.70 H new ATOM 111 N GLY A 48 -18.009 -10.024 2.391 1.00 5.65 N ATOM 112 CA GLY A 48 -17.058 -10.436 3.408 1.00 5.11 C ATOM 113 C GLY A 48 -15.687 -10.802 2.862 1.00 4.06 C ATOM 114 O GLY A 48 -14.677 -10.585 3.534 1.00 4.07 O ATOM 0 H GLY A 48 -18.174 -9.019 2.340 1.00 5.65 H new ATOM 0 HA2 GLY A 48 -16.945 -9.630 4.133 1.00 5.11 H new ATOM 0 HA3 GLY A 48 -17.464 -11.293 3.945 1.00 5.11 H new ATOM 118 N GLN A 49 -15.654 -11.370 1.660 1.00 3.63 N ATOM 119 CA GLN A 49 -14.407 -11.798 1.038 1.00 2.96 C ATOM 120 C GLN A 49 -13.433 -10.637 0.925 1.00 2.13 C ATOM 121 O GLN A 49 -13.808 -9.531 0.530 1.00 2.55 O ATOM 122 CB GLN A 49 -14.674 -12.407 -0.341 1.00 3.66 C ATOM 123 CG GLN A 49 -15.598 -13.618 -0.311 1.00 4.66 C ATOM 124 CD GLN A 49 -15.031 -14.791 0.477 1.00 5.45 C ATOM 125 OE1 GLN A 49 -14.266 -14.615 1.426 1.00 5.88 O ATOM 126 NE2 GLN A 49 -15.396 -16.000 0.085 1.00 6.04 N ATOM 0 H GLN A 49 -16.484 -11.545 1.094 1.00 3.63 H new ATOM 0 HA GLN A 49 -13.957 -12.561 1.673 1.00 2.96 H new ATOM 0 HB2 GLN A 49 -15.111 -11.645 -0.986 1.00 3.66 H new ATOM 0 HB3 GLN A 49 -13.724 -12.698 -0.789 1.00 3.66 H new ATOM 0 HG2 GLN A 49 -16.554 -13.326 0.124 1.00 4.66 H new ATOM 0 HG3 GLN A 49 -15.798 -13.939 -1.333 1.00 4.66 H new ATOM 0 HE21 GLN A 49 -16.031 -16.110 -0.705 1.00 6.04 H new ATOM 0 HE22 GLN A 49 -15.042 -16.823 0.573 1.00 6.04 H new ATOM 135 N LYS A 50 -12.186 -10.896 1.280 1.00 1.67 N ATOM 136 CA LYS A 50 -11.183 -9.856 1.348 1.00 1.23 C ATOM 137 C LYS A 50 -10.063 -10.118 0.360 1.00 1.14 C ATOM 138 O LYS A 50 -10.137 -11.046 -0.445 1.00 1.86 O ATOM 139 CB LYS A 50 -10.645 -9.740 2.777 1.00 1.57 C ATOM 140 CG LYS A 50 -11.683 -9.245 3.760 1.00 1.90 C ATOM 141 CD LYS A 50 -12.244 -7.896 3.332 1.00 2.73 C ATOM 142 CE LYS A 50 -13.465 -7.510 4.148 1.00 3.21 C ATOM 143 NZ LYS A 50 -14.083 -6.250 3.653 1.00 4.04 N ATOM 0 H LYS A 50 -11.846 -11.826 1.526 1.00 1.67 H new ATOM 0 HA LYS A 50 -11.644 -8.907 1.075 1.00 1.23 H new ATOM 0 HB2 LYS A 50 -10.280 -10.714 3.102 1.00 1.57 H new ATOM 0 HB3 LYS A 50 -9.792 -9.061 2.785 1.00 1.57 H new ATOM 0 HG2 LYS A 50 -12.492 -9.971 3.836 1.00 1.90 H new ATOM 0 HG3 LYS A 50 -11.238 -9.159 4.751 1.00 1.90 H new ATOM 0 HD2 LYS A 50 -11.476 -7.131 3.443 1.00 2.73 H new ATOM 0 HD3 LYS A 50 -12.509 -7.931 2.275 1.00 2.73 H new ATOM 0 HE2 LYS A 50 -14.199 -8.315 4.108 1.00 3.21 H new ATOM 0 HE3 LYS A 50 -13.181 -7.390 5.193 1.00 3.21 H new ATOM 0 HZ1 LYS A 50 -15.106 -6.269 3.838 1.00 4.04 H new ATOM 0 HZ2 LYS A 50 -13.658 -5.438 4.145 1.00 4.04 H new ATOM 0 HZ3 LYS A 50 -13.918 -6.161 2.630 1.00 4.04 H new ATOM 157 N ALA A 51 -9.045 -9.278 0.431 1.00 0.80 N ATOM 158 CA ALA A 51 -7.945 -9.288 -0.522 1.00 0.75 C ATOM 159 C ALA A 51 -8.486 -9.006 -1.915 1.00 0.83 C ATOM 160 O ALA A 51 -8.532 -9.881 -2.784 1.00 1.01 O ATOM 161 CB ALA A 51 -7.162 -10.592 -0.467 1.00 0.84 C ATOM 0 H ALA A 51 -8.956 -8.565 1.155 1.00 0.80 H new ATOM 0 HA ALA A 51 -7.239 -8.502 -0.256 1.00 0.75 H new ATOM 0 HB1 ALA A 51 -6.350 -10.560 -1.193 1.00 0.84 H new ATOM 0 HB2 ALA A 51 -6.750 -10.727 0.533 1.00 0.84 H new ATOM 0 HB3 ALA A 51 -7.825 -11.425 -0.701 1.00 0.84 H new ATOM 167 N GLU A 52 -8.930 -7.771 -2.088 1.00 0.75 N ATOM 168 CA GLU A 52 -9.522 -7.306 -3.329 1.00 0.86 C ATOM 169 C GLU A 52 -8.551 -7.428 -4.497 1.00 0.97 C ATOM 170 O GLU A 52 -7.467 -6.847 -4.486 1.00 1.04 O ATOM 171 CB GLU A 52 -9.976 -5.859 -3.149 1.00 0.83 C ATOM 172 CG GLU A 52 -8.933 -4.984 -2.486 1.00 0.91 C ATOM 173 CD GLU A 52 -9.520 -3.719 -1.914 1.00 1.63 C ATOM 174 OE1 GLU A 52 -10.370 -3.816 -1.006 1.00 1.98 O ATOM 175 OE2 GLU A 52 -9.111 -2.628 -2.362 1.00 2.04 O ATOM 0 H GLU A 52 -8.888 -7.056 -1.361 1.00 0.75 H new ATOM 0 HA GLU A 52 -10.381 -7.934 -3.566 1.00 0.86 H new ATOM 0 HB2 GLU A 52 -10.226 -5.440 -4.124 1.00 0.83 H new ATOM 0 HB3 GLU A 52 -10.887 -5.843 -2.551 1.00 0.83 H new ATOM 0 HG2 GLU A 52 -8.444 -5.546 -1.690 1.00 0.91 H new ATOM 0 HG3 GLU A 52 -8.163 -4.727 -3.214 1.00 0.91 H new ATOM 182 N ASN A 53 -8.940 -8.209 -5.492 1.00 1.07 N ATOM 183 CA ASN A 53 -8.130 -8.377 -6.688 1.00 1.20 C ATOM 184 C ASN A 53 -8.607 -7.432 -7.786 1.00 1.20 C ATOM 185 O ASN A 53 -8.118 -7.473 -8.916 1.00 1.34 O ATOM 186 CB ASN A 53 -8.170 -9.831 -7.177 1.00 1.31 C ATOM 187 CG ASN A 53 -9.508 -10.226 -7.779 1.00 1.88 C ATOM 188 OD1 ASN A 53 -10.556 -9.694 -7.412 1.00 2.59 O ATOM 189 ND2 ASN A 53 -9.482 -11.173 -8.703 1.00 2.43 N ATOM 0 H ASN A 53 -9.813 -8.737 -5.495 1.00 1.07 H new ATOM 0 HA ASN A 53 -7.097 -8.132 -6.439 1.00 1.20 H new ATOM 0 HB2 ASN A 53 -7.387 -9.979 -7.921 1.00 1.31 H new ATOM 0 HB3 ASN A 53 -7.945 -10.494 -6.342 1.00 1.31 H new ATOM 0 HD21 ASN A 53 -10.350 -11.486 -9.137 1.00 2.43 H new ATOM 0 HD22 ASN A 53 -8.594 -11.590 -8.981 1.00 2.43 H new ATOM 196 N LEU A 54 -9.584 -6.598 -7.448 1.00 1.12 N ATOM 197 CA LEU A 54 -10.067 -5.565 -8.340 1.00 1.15 C ATOM 198 C LEU A 54 -9.088 -4.396 -8.346 1.00 1.13 C ATOM 199 O LEU A 54 -8.193 -4.328 -7.501 1.00 1.13 O ATOM 200 CB LEU A 54 -11.424 -5.090 -7.836 1.00 1.18 C ATOM 201 CG LEU A 54 -12.465 -4.786 -8.898 1.00 1.18 C ATOM 202 CD1 LEU A 54 -12.959 -6.059 -9.552 1.00 1.28 C ATOM 203 CD2 LEU A 54 -13.608 -4.035 -8.265 1.00 1.81 C ATOM 0 H LEU A 54 -10.060 -6.624 -6.546 1.00 1.12 H new ATOM 0 HA LEU A 54 -10.158 -5.957 -9.353 1.00 1.15 H new ATOM 0 HB2 LEU A 54 -11.828 -5.852 -7.169 1.00 1.18 H new ATOM 0 HB3 LEU A 54 -11.272 -4.191 -7.238 1.00 1.18 H new ATOM 0 HG LEU A 54 -12.013 -4.171 -9.677 1.00 1.18 H new ATOM 0 HD11 LEU A 54 -13.704 -5.814 -10.309 1.00 1.28 H new ATOM 0 HD12 LEU A 54 -12.122 -6.576 -10.021 1.00 1.28 H new ATOM 0 HD13 LEU A 54 -13.408 -6.705 -8.798 1.00 1.28 H new ATOM 0 HD21 LEU A 54 -14.361 -3.813 -9.022 1.00 1.81 H new ATOM 0 HD22 LEU A 54 -14.053 -4.645 -7.479 1.00 1.81 H new ATOM 0 HD23 LEU A 54 -13.238 -3.104 -7.836 1.00 1.81 H new ATOM 215 N THR A 55 -9.249 -3.484 -9.288 1.00 1.16 N ATOM 216 CA THR A 55 -8.437 -2.277 -9.301 1.00 1.21 C ATOM 217 C THR A 55 -8.950 -1.307 -8.238 1.00 1.14 C ATOM 218 O THR A 55 -10.149 -1.226 -7.987 1.00 1.09 O ATOM 219 CB THR A 55 -8.455 -1.589 -10.682 1.00 1.31 C ATOM 220 OG1 THR A 55 -9.793 -1.249 -11.046 1.00 1.30 O ATOM 221 CG2 THR A 55 -7.862 -2.487 -11.753 1.00 1.40 C ATOM 0 H THR A 55 -9.927 -3.553 -10.047 1.00 1.16 H new ATOM 0 HA THR A 55 -7.408 -2.562 -9.085 1.00 1.21 H new ATOM 0 HB THR A 55 -7.850 -0.685 -10.608 1.00 1.31 H new ATOM 0 HG1 THR A 55 -9.792 -0.812 -11.923 1.00 1.30 H new ATOM 0 HG21 THR A 55 -7.889 -1.974 -12.714 1.00 1.40 H new ATOM 0 HG22 THR A 55 -6.829 -2.725 -11.498 1.00 1.40 H new ATOM 0 HG23 THR A 55 -8.441 -3.408 -11.817 1.00 1.40 H new ATOM 229 N PRO A 56 -8.022 -0.572 -7.597 1.00 1.18 N ATOM 230 CA PRO A 56 -8.298 0.244 -6.399 1.00 1.10 C ATOM 231 C PRO A 56 -9.436 1.243 -6.581 1.00 1.05 C ATOM 232 O PRO A 56 -10.125 1.586 -5.617 1.00 0.97 O ATOM 233 CB PRO A 56 -6.979 0.986 -6.145 1.00 1.21 C ATOM 234 CG PRO A 56 -6.178 0.821 -7.390 1.00 1.38 C ATOM 235 CD PRO A 56 -6.614 -0.476 -7.999 1.00 1.34 C ATOM 0 HA PRO A 56 -8.622 -0.388 -5.572 1.00 1.10 H new ATOM 0 HB2 PRO A 56 -7.157 2.040 -5.931 1.00 1.21 H new ATOM 0 HB3 PRO A 56 -6.455 0.570 -5.284 1.00 1.21 H new ATOM 0 HG2 PRO A 56 -6.350 1.650 -8.076 1.00 1.38 H new ATOM 0 HG3 PRO A 56 -5.111 0.807 -7.167 1.00 1.38 H new ATOM 0 HD2 PRO A 56 -6.503 -0.470 -9.083 1.00 1.34 H new ATOM 0 HD3 PRO A 56 -6.029 -1.315 -7.623 1.00 1.34 H new ATOM 243 N ASP A 57 -9.633 1.708 -7.807 1.00 1.13 N ATOM 244 CA ASP A 57 -10.721 2.633 -8.102 1.00 1.14 C ATOM 245 C ASP A 57 -12.019 1.861 -8.200 1.00 1.07 C ATOM 246 O ASP A 57 -13.040 2.259 -7.645 1.00 1.05 O ATOM 247 CB ASP A 57 -10.472 3.400 -9.405 1.00 1.30 C ATOM 248 CG ASP A 57 -9.373 4.432 -9.281 1.00 1.61 C ATOM 249 OD1 ASP A 57 -8.189 4.070 -9.443 1.00 2.15 O ATOM 250 OD2 ASP A 57 -9.686 5.616 -9.034 1.00 1.67 O ATOM 0 H ASP A 57 -9.056 1.462 -8.612 1.00 1.13 H new ATOM 0 HA ASP A 57 -10.779 3.363 -7.294 1.00 1.14 H new ATOM 0 HB2 ASP A 57 -10.212 2.693 -10.193 1.00 1.30 H new ATOM 0 HB3 ASP A 57 -11.394 3.894 -9.712 1.00 1.30 H new ATOM 255 N GLU A 58 -11.959 0.736 -8.895 1.00 1.09 N ATOM 256 CA GLU A 58 -13.089 -0.166 -9.010 1.00 1.05 C ATOM 257 C GLU A 58 -13.550 -0.633 -7.644 1.00 0.93 C ATOM 258 O GLU A 58 -14.739 -0.832 -7.423 1.00 0.93 O ATOM 259 CB GLU A 58 -12.711 -1.369 -9.862 1.00 1.12 C ATOM 260 CG GLU A 58 -12.788 -1.110 -11.337 1.00 1.26 C ATOM 261 CD GLU A 58 -14.204 -1.146 -11.867 1.00 1.83 C ATOM 262 OE1 GLU A 58 -15.004 -0.266 -11.482 1.00 2.17 O ATOM 263 OE2 GLU A 58 -14.525 -2.044 -12.673 1.00 2.54 O ATOM 0 H GLU A 58 -11.126 0.425 -9.394 1.00 1.09 H new ATOM 0 HA GLU A 58 -13.908 0.374 -9.486 1.00 1.05 H new ATOM 0 HB2 GLU A 58 -11.697 -1.678 -9.609 1.00 1.12 H new ATOM 0 HB3 GLU A 58 -13.370 -2.201 -9.613 1.00 1.12 H new ATOM 0 HG2 GLU A 58 -12.349 -0.136 -11.553 1.00 1.26 H new ATOM 0 HG3 GLU A 58 -12.189 -1.853 -11.863 1.00 1.26 H new ATOM 270 N VAL A 59 -12.604 -0.809 -6.734 1.00 0.86 N ATOM 271 CA VAL A 59 -12.923 -1.267 -5.391 1.00 0.75 C ATOM 272 C VAL A 59 -13.673 -0.205 -4.608 1.00 0.71 C ATOM 273 O VAL A 59 -14.844 -0.374 -4.262 1.00 0.71 O ATOM 274 CB VAL A 59 -11.658 -1.610 -4.585 1.00 0.72 C ATOM 275 CG1 VAL A 59 -12.039 -2.100 -3.199 1.00 0.63 C ATOM 276 CG2 VAL A 59 -10.803 -2.641 -5.307 1.00 0.82 C ATOM 0 H VAL A 59 -11.612 -0.642 -6.901 1.00 0.86 H new ATOM 0 HA VAL A 59 -13.538 -2.157 -5.522 1.00 0.75 H new ATOM 0 HB VAL A 59 -11.062 -0.703 -4.485 1.00 0.72 H new ATOM 0 HG11 VAL A 59 -11.136 -2.340 -2.637 1.00 0.63 H new ATOM 0 HG12 VAL A 59 -12.595 -1.321 -2.678 1.00 0.63 H new ATOM 0 HG13 VAL A 59 -12.660 -2.992 -3.286 1.00 0.63 H new ATOM 0 HG21 VAL A 59 -9.917 -2.861 -4.711 1.00 0.82 H new ATOM 0 HG22 VAL A 59 -11.379 -3.555 -5.451 1.00 0.82 H new ATOM 0 HG23 VAL A 59 -10.499 -2.247 -6.277 1.00 0.82 H new ATOM 286 N SER A 60 -12.998 0.905 -4.365 1.00 0.70 N ATOM 287 CA SER A 60 -13.491 1.898 -3.437 1.00 0.70 C ATOM 288 C SER A 60 -14.752 2.589 -3.961 1.00 0.74 C ATOM 289 O SER A 60 -15.712 2.786 -3.219 1.00 0.72 O ATOM 290 CB SER A 60 -12.403 2.918 -3.141 1.00 0.76 C ATOM 291 OG SER A 60 -11.111 2.325 -3.193 1.00 0.97 O ATOM 0 H SER A 60 -12.106 1.138 -4.800 1.00 0.70 H new ATOM 0 HA SER A 60 -13.763 1.388 -2.513 1.00 0.70 H new ATOM 0 HB2 SER A 60 -12.460 3.734 -3.862 1.00 0.76 H new ATOM 0 HB3 SER A 60 -12.567 3.352 -2.155 1.00 0.76 H new ATOM 0 HG SER A 60 -10.820 2.257 -4.126 1.00 0.97 H new ATOM 297 N LYS A 61 -14.766 2.925 -5.243 1.00 0.87 N ATOM 298 CA LYS A 61 -15.913 3.611 -5.832 1.00 0.96 C ATOM 299 C LYS A 61 -17.148 2.715 -5.817 1.00 0.94 C ATOM 300 O LYS A 61 -18.281 3.196 -5.774 1.00 1.01 O ATOM 301 CB LYS A 61 -15.603 4.048 -7.263 1.00 1.10 C ATOM 302 CG LYS A 61 -14.435 5.020 -7.365 1.00 1.17 C ATOM 303 CD LYS A 61 -14.110 5.372 -8.810 1.00 1.36 C ATOM 304 CE LYS A 61 -14.929 6.552 -9.327 1.00 2.01 C ATOM 305 NZ LYS A 61 -16.393 6.289 -9.330 1.00 2.54 N ATOM 0 H LYS A 61 -14.003 2.737 -5.893 1.00 0.87 H new ATOM 0 HA LYS A 61 -16.118 4.497 -5.231 1.00 0.96 H new ATOM 0 HB2 LYS A 61 -15.384 3.165 -7.864 1.00 1.10 H new ATOM 0 HB3 LYS A 61 -16.490 4.513 -7.692 1.00 1.10 H new ATOM 0 HG2 LYS A 61 -14.672 5.931 -6.815 1.00 1.17 H new ATOM 0 HG3 LYS A 61 -13.556 4.581 -6.892 1.00 1.17 H new ATOM 0 HD2 LYS A 61 -13.049 5.607 -8.893 1.00 1.36 H new ATOM 0 HD3 LYS A 61 -14.294 4.503 -9.442 1.00 1.36 H new ATOM 0 HE2 LYS A 61 -14.724 7.427 -8.710 1.00 2.01 H new ATOM 0 HE3 LYS A 61 -14.607 6.794 -10.340 1.00 2.01 H new ATOM 0 HZ1 LYS A 61 -16.867 6.972 -9.955 1.00 2.54 H new ATOM 0 HZ2 LYS A 61 -16.572 5.324 -9.673 1.00 2.54 H new ATOM 0 HZ3 LYS A 61 -16.765 6.387 -8.364 1.00 2.54 H new ATOM 319 N ARG A 62 -16.919 1.409 -5.839 1.00 0.88 N ATOM 320 CA ARG A 62 -17.984 0.438 -5.822 1.00 0.89 C ATOM 321 C ARG A 62 -18.523 0.247 -4.404 1.00 0.77 C ATOM 322 O ARG A 62 -19.676 -0.140 -4.213 1.00 0.82 O ATOM 323 CB ARG A 62 -17.461 -0.863 -6.425 1.00 0.93 C ATOM 324 CG ARG A 62 -17.964 -2.107 -5.756 1.00 1.21 C ATOM 325 CD ARG A 62 -17.482 -3.360 -6.467 1.00 1.21 C ATOM 326 NE ARG A 62 -17.999 -3.452 -7.833 1.00 1.85 N ATOM 327 CZ ARG A 62 -18.718 -4.477 -8.291 1.00 2.40 C ATOM 328 NH1 ARG A 62 -19.002 -5.502 -7.495 1.00 2.53 N ATOM 329 NH2 ARG A 62 -19.151 -4.474 -9.547 1.00 3.33 N ATOM 0 H ARG A 62 -15.985 1.001 -5.869 1.00 0.88 H new ATOM 0 HA ARG A 62 -18.824 0.788 -6.422 1.00 0.89 H new ATOM 0 HB2 ARG A 62 -17.737 -0.896 -7.479 1.00 0.93 H new ATOM 0 HB3 ARG A 62 -16.372 -0.857 -6.380 1.00 0.93 H new ATOM 0 HG2 ARG A 62 -17.628 -2.124 -4.719 1.00 1.21 H new ATOM 0 HG3 ARG A 62 -19.054 -2.095 -5.737 1.00 1.21 H new ATOM 0 HD2 ARG A 62 -16.392 -3.366 -6.491 1.00 1.21 H new ATOM 0 HD3 ARG A 62 -17.793 -4.239 -5.902 1.00 1.21 H new ATOM 0 HE ARG A 62 -17.797 -2.685 -8.474 1.00 1.85 H new ATOM 0 HH11 ARG A 62 -18.670 -5.506 -6.531 1.00 2.53 H new ATOM 0 HH12 ARG A 62 -19.552 -6.285 -7.848 1.00 2.53 H new ATOM 0 HH21 ARG A 62 -18.933 -3.688 -10.160 1.00 3.33 H new ATOM 0 HH22 ARG A 62 -19.701 -5.258 -9.899 1.00 3.33 H new ATOM 343 N GLU A 63 -17.694 0.541 -3.411 1.00 0.68 N ATOM 344 CA GLU A 63 -18.117 0.424 -2.022 1.00 0.63 C ATOM 345 C GLU A 63 -18.651 1.744 -1.475 1.00 0.66 C ATOM 346 O GLU A 63 -19.501 1.750 -0.584 1.00 0.73 O ATOM 347 CB GLU A 63 -16.989 -0.117 -1.145 1.00 0.59 C ATOM 348 CG GLU A 63 -15.653 0.595 -1.277 1.00 0.58 C ATOM 349 CD GLU A 63 -14.592 -0.066 -0.428 1.00 0.65 C ATOM 350 OE1 GLU A 63 -14.532 0.250 0.781 1.00 1.25 O ATOM 351 OE2 GLU A 63 -13.866 -0.916 -0.927 1.00 1.21 O ATOM 0 H GLU A 63 -16.733 0.859 -3.539 1.00 0.68 H new ATOM 0 HA GLU A 63 -18.938 -0.292 -1.997 1.00 0.63 H new ATOM 0 HB2 GLU A 63 -17.306 -0.065 -0.104 1.00 0.59 H new ATOM 0 HB3 GLU A 63 -16.843 -1.171 -1.381 1.00 0.59 H new ATOM 0 HG2 GLU A 63 -15.339 0.594 -2.321 1.00 0.58 H new ATOM 0 HG3 GLU A 63 -15.763 1.638 -0.979 1.00 0.58 H new ATOM 358 N GLY A 64 -18.155 2.856 -1.994 1.00 0.69 N ATOM 359 CA GLY A 64 -18.701 4.147 -1.616 1.00 0.74 C ATOM 360 C GLY A 64 -17.643 5.212 -1.418 1.00 0.72 C ATOM 361 O GLY A 64 -17.788 6.335 -1.904 1.00 0.86 O ATOM 0 H GLY A 64 -17.389 2.891 -2.666 1.00 0.69 H new ATOM 0 HA2 GLY A 64 -19.399 4.477 -2.385 1.00 0.74 H new ATOM 0 HA3 GLY A 64 -19.272 4.036 -0.694 1.00 0.74 H new ATOM 365 N ILE A 65 -16.580 4.865 -0.706 1.00 0.62 N ATOM 366 CA ILE A 65 -15.520 5.823 -0.408 1.00 0.67 C ATOM 367 C ILE A 65 -14.599 6.018 -1.606 1.00 0.81 C ATOM 368 O ILE A 65 -14.315 5.078 -2.338 1.00 1.76 O ATOM 369 CB ILE A 65 -14.681 5.390 0.815 1.00 0.61 C ATOM 370 CG1 ILE A 65 -14.153 3.965 0.644 1.00 0.53 C ATOM 371 CG2 ILE A 65 -15.499 5.503 2.090 1.00 0.89 C ATOM 372 CD1 ILE A 65 -13.341 3.484 1.824 1.00 0.49 C ATOM 0 H ILE A 65 -16.427 3.931 -0.324 1.00 0.62 H new ATOM 0 HA ILE A 65 -16.012 6.767 -0.176 1.00 0.67 H new ATOM 0 HB ILE A 65 -13.825 6.061 0.889 1.00 0.61 H new ATOM 0 HG12 ILE A 65 -14.994 3.289 0.491 1.00 0.53 H new ATOM 0 HG13 ILE A 65 -13.538 3.918 -0.255 1.00 0.53 H new ATOM 0 HG21 ILE A 65 -14.892 5.194 2.941 1.00 0.89 H new ATOM 0 HG22 ILE A 65 -15.817 6.536 2.228 1.00 0.89 H new ATOM 0 HG23 ILE A 65 -16.376 4.860 2.018 1.00 0.89 H new ATOM 0 HD11 ILE A 65 -12.997 2.467 1.638 1.00 0.49 H new ATOM 0 HD12 ILE A 65 -12.481 4.138 1.965 1.00 0.49 H new ATOM 0 HD13 ILE A 65 -13.959 3.500 2.722 1.00 0.49 H new ATOM 384 N ASN A 66 -14.131 7.241 -1.802 1.00 0.75 N ATOM 385 CA ASN A 66 -13.247 7.544 -2.923 1.00 0.69 C ATOM 386 C ASN A 66 -11.890 7.994 -2.411 1.00 0.61 C ATOM 387 O ASN A 66 -11.114 8.625 -3.132 1.00 0.64 O ATOM 388 CB ASN A 66 -13.841 8.626 -3.825 1.00 0.83 C ATOM 389 CG ASN A 66 -15.191 8.248 -4.401 1.00 1.38 C ATOM 390 OD1 ASN A 66 -15.282 7.620 -5.456 1.00 2.09 O ATOM 391 ND2 ASN A 66 -16.253 8.645 -3.719 1.00 2.10 N ATOM 0 H ASN A 66 -14.346 8.039 -1.204 1.00 0.75 H new ATOM 0 HA ASN A 66 -13.132 6.634 -3.512 1.00 0.69 H new ATOM 0 HB2 ASN A 66 -13.942 9.550 -3.255 1.00 0.83 H new ATOM 0 HB3 ASN A 66 -13.149 8.829 -4.642 1.00 0.83 H new ATOM 0 HD21 ASN A 66 -17.189 8.433 -4.064 1.00 2.10 H new ATOM 0 HD22 ASN A 66 -16.136 9.163 -2.848 1.00 2.10 H new ATOM 398 N ALA A 67 -11.617 7.677 -1.154 1.00 0.54 N ATOM 399 CA ALA A 67 -10.363 8.061 -0.522 1.00 0.49 C ATOM 400 C ALA A 67 -9.196 7.224 -1.036 1.00 0.44 C ATOM 401 O ALA A 67 -9.390 6.178 -1.663 1.00 0.45 O ATOM 402 CB ALA A 67 -10.480 7.928 0.984 1.00 0.47 C ATOM 0 H ALA A 67 -12.250 7.153 -0.549 1.00 0.54 H new ATOM 0 HA ALA A 67 -10.163 9.101 -0.779 1.00 0.49 H new ATOM 0 HB1 ALA A 67 -9.538 8.217 1.449 1.00 0.47 H new ATOM 0 HB2 ALA A 67 -11.277 8.577 1.346 1.00 0.47 H new ATOM 0 HB3 ALA A 67 -10.709 6.894 1.241 1.00 0.47 H new ATOM 408 N GLU A 68 -7.985 7.695 -0.754 1.00 0.44 N ATOM 409 CA GLU A 68 -6.767 7.027 -1.196 1.00 0.42 C ATOM 410 C GLU A 68 -6.592 5.693 -0.482 1.00 0.34 C ATOM 411 O GLU A 68 -6.741 5.614 0.738 1.00 0.35 O ATOM 412 CB GLU A 68 -5.546 7.902 -0.907 1.00 0.50 C ATOM 413 CG GLU A 68 -5.603 9.292 -1.519 1.00 0.78 C ATOM 414 CD GLU A 68 -4.394 10.130 -1.148 1.00 1.79 C ATOM 415 OE1 GLU A 68 -4.242 10.481 0.042 1.00 2.59 O ATOM 416 OE2 GLU A 68 -3.585 10.441 -2.046 1.00 2.28 O ATOM 0 H GLU A 68 -7.821 8.546 -0.216 1.00 0.44 H new ATOM 0 HA GLU A 68 -6.854 6.855 -2.269 1.00 0.42 H new ATOM 0 HB2 GLU A 68 -5.433 7.999 0.173 1.00 0.50 H new ATOM 0 HB3 GLU A 68 -4.656 7.393 -1.276 1.00 0.50 H new ATOM 0 HG2 GLU A 68 -5.666 9.207 -2.604 1.00 0.78 H new ATOM 0 HG3 GLU A 68 -6.510 9.797 -1.186 1.00 0.78 H new ATOM 423 N GLN A 69 -6.271 4.651 -1.237 1.00 0.31 N ATOM 424 CA GLN A 69 -5.982 3.352 -0.650 1.00 0.24 C ATOM 425 C GLN A 69 -4.575 3.338 -0.079 1.00 0.21 C ATOM 426 O GLN A 69 -3.610 3.052 -0.786 1.00 0.27 O ATOM 427 CB GLN A 69 -6.140 2.225 -1.670 1.00 0.29 C ATOM 428 CG GLN A 69 -7.576 1.982 -2.095 1.00 0.43 C ATOM 429 CD GLN A 69 -7.786 0.583 -2.638 1.00 0.80 C ATOM 430 OE1 GLN A 69 -6.879 -0.010 -3.222 1.00 1.64 O ATOM 431 NE2 GLN A 69 -8.978 0.047 -2.435 1.00 0.76 N ATOM 0 H GLN A 69 -6.205 4.681 -2.254 1.00 0.31 H new ATOM 0 HA GLN A 69 -6.702 3.183 0.151 1.00 0.24 H new ATOM 0 HB2 GLN A 69 -5.544 2.460 -2.552 1.00 0.29 H new ATOM 0 HB3 GLN A 69 -5.735 1.305 -1.247 1.00 0.29 H new ATOM 0 HG2 GLN A 69 -8.237 2.142 -1.243 1.00 0.43 H new ATOM 0 HG3 GLN A 69 -7.856 2.711 -2.856 1.00 0.43 H new ATOM 0 HE21 GLN A 69 -9.699 0.577 -1.946 1.00 0.76 H new ATOM 0 HE22 GLN A 69 -9.176 -0.897 -2.768 1.00 0.76 H new ATOM 440 N ILE A 70 -4.470 3.662 1.199 1.00 0.19 N ATOM 441 CA ILE A 70 -3.184 3.738 1.872 1.00 0.17 C ATOM 442 C ILE A 70 -2.748 2.364 2.366 1.00 0.14 C ATOM 443 O ILE A 70 -3.214 1.900 3.401 1.00 0.14 O ATOM 444 CB ILE A 70 -3.249 4.696 3.074 1.00 0.21 C ATOM 445 CG1 ILE A 70 -3.850 6.035 2.655 1.00 0.27 C ATOM 446 CG2 ILE A 70 -1.863 4.898 3.666 1.00 0.21 C ATOM 447 CD1 ILE A 70 -4.073 6.975 3.814 1.00 0.36 C ATOM 0 H ILE A 70 -5.268 3.878 1.796 1.00 0.19 H new ATOM 0 HA ILE A 70 -2.461 4.112 1.147 1.00 0.17 H new ATOM 0 HB ILE A 70 -3.890 4.253 3.836 1.00 0.21 H new ATOM 0 HG12 ILE A 70 -3.189 6.512 1.931 1.00 0.27 H new ATOM 0 HG13 ILE A 70 -4.800 5.858 2.151 1.00 0.27 H new ATOM 0 HG21 ILE A 70 -1.926 5.578 4.515 1.00 0.21 H new ATOM 0 HG22 ILE A 70 -1.466 3.939 3.998 1.00 0.21 H new ATOM 0 HG23 ILE A 70 -1.203 5.322 2.910 1.00 0.21 H new ATOM 0 HD11 ILE A 70 -4.502 7.908 3.448 1.00 0.36 H new ATOM 0 HD12 ILE A 70 -4.757 6.516 4.528 1.00 0.36 H new ATOM 0 HD13 ILE A 70 -3.121 7.181 4.304 1.00 0.36 H new ATOM 459 N VAL A 71 -1.869 1.711 1.627 1.00 0.15 N ATOM 460 CA VAL A 71 -1.358 0.411 2.037 1.00 0.15 C ATOM 461 C VAL A 71 -0.540 0.555 3.323 1.00 0.14 C ATOM 462 O VAL A 71 0.554 1.120 3.319 1.00 0.17 O ATOM 463 CB VAL A 71 -0.491 -0.240 0.933 1.00 0.18 C ATOM 464 CG1 VAL A 71 -0.015 -1.621 1.357 1.00 0.19 C ATOM 465 CG2 VAL A 71 -1.246 -0.327 -0.384 1.00 0.20 C ATOM 0 H VAL A 71 -1.494 2.056 0.743 1.00 0.15 H new ATOM 0 HA VAL A 71 -2.213 -0.241 2.215 1.00 0.15 H new ATOM 0 HB VAL A 71 0.380 0.398 0.785 1.00 0.18 H new ATOM 0 HG11 VAL A 71 0.592 -2.056 0.563 1.00 0.19 H new ATOM 0 HG12 VAL A 71 0.581 -1.537 2.265 1.00 0.19 H new ATOM 0 HG13 VAL A 71 -0.877 -2.261 1.547 1.00 0.19 H new ATOM 0 HG21 VAL A 71 -0.609 -0.789 -1.139 1.00 0.20 H new ATOM 0 HG22 VAL A 71 -2.144 -0.929 -0.249 1.00 0.20 H new ATOM 0 HG23 VAL A 71 -1.526 0.675 -0.710 1.00 0.20 H new ATOM 475 N ILE A 72 -1.097 0.069 4.428 1.00 0.14 N ATOM 476 CA ILE A 72 -0.451 0.169 5.734 1.00 0.17 C ATOM 477 C ILE A 72 0.367 -1.070 6.034 1.00 0.22 C ATOM 478 O ILE A 72 1.301 -1.039 6.836 1.00 0.29 O ATOM 479 CB ILE A 72 -1.477 0.340 6.866 1.00 0.18 C ATOM 480 CG1 ILE A 72 -2.608 -0.679 6.695 1.00 0.19 C ATOM 481 CG2 ILE A 72 -2.010 1.761 6.891 1.00 0.19 C ATOM 482 CD1 ILE A 72 -3.543 -0.766 7.873 1.00 0.21 C ATOM 0 H ILE A 72 -2.002 -0.402 4.445 1.00 0.14 H new ATOM 0 HA ILE A 72 0.194 1.047 5.689 1.00 0.17 H new ATOM 0 HB ILE A 72 -0.991 0.156 7.824 1.00 0.18 H new ATOM 0 HG12 ILE A 72 -3.184 -0.420 5.806 1.00 0.19 H new ATOM 0 HG13 ILE A 72 -2.172 -1.662 6.517 1.00 0.19 H new ATOM 0 HG21 ILE A 72 -2.735 1.864 7.699 1.00 0.19 H new ATOM 0 HG22 ILE A 72 -1.186 2.456 7.053 1.00 0.19 H new ATOM 0 HG23 ILE A 72 -2.492 1.985 5.940 1.00 0.19 H new ATOM 0 HD11 ILE A 72 -4.314 -1.509 7.671 1.00 0.21 H new ATOM 0 HD12 ILE A 72 -2.983 -1.056 8.762 1.00 0.21 H new ATOM 0 HD13 ILE A 72 -4.010 0.205 8.040 1.00 0.21 H new ATOM 494 N LYS A 73 -0.005 -2.164 5.407 1.00 0.21 N ATOM 495 CA LYS A 73 0.689 -3.416 5.604 1.00 0.26 C ATOM 496 C LYS A 73 0.902 -4.110 4.277 1.00 0.24 C ATOM 497 O LYS A 73 0.011 -4.137 3.433 1.00 0.25 O ATOM 498 CB LYS A 73 -0.094 -4.323 6.552 1.00 0.35 C ATOM 499 CG LYS A 73 0.494 -5.720 6.655 1.00 0.41 C ATOM 500 CD LYS A 73 -0.251 -6.583 7.651 1.00 0.59 C ATOM 501 CE LYS A 73 -0.232 -5.986 9.053 1.00 1.22 C ATOM 502 NZ LYS A 73 1.151 -5.812 9.572 1.00 1.94 N ATOM 0 H LYS A 73 -0.787 -2.211 4.754 1.00 0.21 H new ATOM 0 HA LYS A 73 1.660 -3.204 6.052 1.00 0.26 H new ATOM 0 HB2 LYS A 73 -0.117 -3.870 7.543 1.00 0.35 H new ATOM 0 HB3 LYS A 73 -1.126 -4.393 6.209 1.00 0.35 H new ATOM 0 HG2 LYS A 73 0.469 -6.196 5.675 1.00 0.41 H new ATOM 0 HG3 LYS A 73 1.541 -5.651 6.949 1.00 0.41 H new ATOM 0 HD2 LYS A 73 -1.283 -6.705 7.323 1.00 0.59 H new ATOM 0 HD3 LYS A 73 0.196 -7.577 7.674 1.00 0.59 H new ATOM 0 HE2 LYS A 73 -0.738 -5.021 9.042 1.00 1.22 H new ATOM 0 HE3 LYS A 73 -0.793 -6.632 9.728 1.00 1.22 H new ATOM 0 HZ1 LYS A 73 1.114 -5.549 10.578 1.00 1.94 H new ATOM 0 HZ2 LYS A 73 1.676 -6.703 9.466 1.00 1.94 H new ATOM 0 HZ3 LYS A 73 1.631 -5.062 9.035 1.00 1.94 H new ATOM 516 N ILE A 74 2.081 -4.674 4.110 1.00 0.28 N ATOM 517 CA ILE A 74 2.441 -5.356 2.883 1.00 0.31 C ATOM 518 C ILE A 74 2.924 -6.758 3.212 1.00 0.38 C ATOM 519 O ILE A 74 3.709 -6.937 4.141 1.00 0.41 O ATOM 520 CB ILE A 74 3.593 -4.662 2.134 1.00 0.35 C ATOM 521 CG1 ILE A 74 3.583 -3.148 2.302 1.00 0.38 C ATOM 522 CG2 ILE A 74 3.525 -5.004 0.662 1.00 0.40 C ATOM 523 CD1 ILE A 74 4.850 -2.503 1.780 1.00 0.44 C ATOM 0 H ILE A 74 2.815 -4.673 4.819 1.00 0.28 H new ATOM 0 HA ILE A 74 1.550 -5.354 2.255 1.00 0.31 H new ATOM 0 HB ILE A 74 4.521 -5.030 2.571 1.00 0.35 H new ATOM 0 HG12 ILE A 74 2.723 -2.732 1.777 1.00 0.38 H new ATOM 0 HG13 ILE A 74 3.461 -2.903 3.357 1.00 0.38 H new ATOM 0 HG21 ILE A 74 4.342 -4.511 0.136 1.00 0.40 H new ATOM 0 HG22 ILE A 74 3.611 -6.083 0.535 1.00 0.40 H new ATOM 0 HG23 ILE A 74 2.573 -4.665 0.253 1.00 0.40 H new ATOM 0 HD11 ILE A 74 4.794 -1.424 1.922 1.00 0.44 H new ATOM 0 HD12 ILE A 74 5.709 -2.897 2.323 1.00 0.44 H new ATOM 0 HD13 ILE A 74 4.960 -2.724 0.718 1.00 0.44 H new ATOM 535 N THR A 75 2.468 -7.746 2.469 1.00 0.45 N ATOM 536 CA THR A 75 2.975 -9.099 2.621 1.00 0.54 C ATOM 537 C THR A 75 3.116 -9.754 1.254 1.00 0.60 C ATOM 538 O THR A 75 2.845 -9.127 0.227 1.00 0.71 O ATOM 539 CB THR A 75 2.069 -9.971 3.528 1.00 0.69 C ATOM 540 OG1 THR A 75 0.733 -10.009 3.013 1.00 0.79 O ATOM 541 CG2 THR A 75 2.039 -9.450 4.960 1.00 0.72 C ATOM 0 H THR A 75 1.748 -7.640 1.754 1.00 0.45 H new ATOM 0 HA THR A 75 3.949 -9.028 3.105 1.00 0.54 H new ATOM 0 HB THR A 75 2.491 -10.976 3.534 1.00 0.69 H new ATOM 0 HG1 THR A 75 0.686 -9.483 2.187 1.00 0.79 H new ATOM 0 HG21 THR A 75 1.394 -10.087 5.565 1.00 0.72 H new ATOM 0 HG22 THR A 75 3.048 -9.460 5.372 1.00 0.72 H new ATOM 0 HG23 THR A 75 1.653 -8.430 4.968 1.00 0.72 H new ATOM 549 N ASP A 76 3.534 -11.006 1.238 1.00 0.70 N ATOM 550 CA ASP A 76 3.664 -11.745 -0.008 1.00 0.82 C ATOM 551 C ASP A 76 2.302 -12.311 -0.397 1.00 0.90 C ATOM 552 O ASP A 76 2.026 -12.595 -1.561 1.00 1.08 O ATOM 553 CB ASP A 76 4.689 -12.869 0.155 1.00 1.00 C ATOM 554 CG ASP A 76 5.198 -13.399 -1.167 1.00 1.46 C ATOM 555 OD1 ASP A 76 4.528 -14.261 -1.773 1.00 2.15 O ATOM 556 OD2 ASP A 76 6.287 -12.969 -1.599 1.00 2.01 O ATOM 0 H ASP A 76 3.790 -11.534 2.072 1.00 0.70 H new ATOM 0 HA ASP A 76 4.012 -11.079 -0.797 1.00 0.82 H new ATOM 0 HB2 ASP A 76 5.531 -12.503 0.742 1.00 1.00 H new ATOM 0 HB3 ASP A 76 4.238 -13.686 0.719 1.00 1.00 H new ATOM 561 N GLN A 77 1.448 -12.443 0.610 1.00 0.94 N ATOM 562 CA GLN A 77 0.095 -12.966 0.441 1.00 1.14 C ATOM 563 C GLN A 77 -0.850 -11.883 -0.091 1.00 1.11 C ATOM 564 O GLN A 77 -1.911 -12.176 -0.650 1.00 1.49 O ATOM 565 CB GLN A 77 -0.395 -13.487 1.795 1.00 1.36 C ATOM 566 CG GLN A 77 -1.822 -14.002 1.798 1.00 1.89 C ATOM 567 CD GLN A 77 -2.254 -14.466 3.173 1.00 2.52 C ATOM 568 OE1 GLN A 77 -1.438 -14.935 3.967 1.00 2.98 O ATOM 569 NE2 GLN A 77 -3.533 -14.333 3.473 1.00 3.19 N ATOM 0 H GLN A 77 1.674 -12.190 1.572 1.00 0.94 H new ATOM 0 HA GLN A 77 0.106 -13.776 -0.289 1.00 1.14 H new ATOM 0 HB2 GLN A 77 0.267 -14.289 2.121 1.00 1.36 H new ATOM 0 HB3 GLN A 77 -0.311 -12.686 2.529 1.00 1.36 H new ATOM 0 HG2 GLN A 77 -2.492 -13.215 1.454 1.00 1.89 H new ATOM 0 HG3 GLN A 77 -1.911 -14.828 1.092 1.00 1.89 H new ATOM 0 HE21 GLN A 77 -4.179 -13.940 2.789 1.00 3.19 H new ATOM 0 HE22 GLN A 77 -3.875 -14.623 4.389 1.00 3.19 H new ATOM 578 N GLY A 78 -0.442 -10.635 0.079 1.00 0.78 N ATOM 579 CA GLY A 78 -1.261 -9.503 -0.309 1.00 0.78 C ATOM 580 C GLY A 78 -0.923 -8.297 0.536 1.00 0.72 C ATOM 581 O GLY A 78 0.098 -8.298 1.217 1.00 0.99 O ATOM 0 H GLY A 78 0.458 -10.382 0.486 1.00 0.78 H new ATOM 0 HA2 GLY A 78 -1.101 -9.274 -1.363 1.00 0.78 H new ATOM 0 HA3 GLY A 78 -2.316 -9.752 -0.194 1.00 0.78 H new ATOM 585 N TYR A 79 -1.744 -7.264 0.506 1.00 0.43 N ATOM 586 CA TYR A 79 -1.498 -6.107 1.356 1.00 0.36 C ATOM 587 C TYR A 79 -2.799 -5.607 1.958 1.00 0.28 C ATOM 588 O TYR A 79 -3.879 -5.977 1.514 1.00 0.28 O ATOM 589 CB TYR A 79 -0.809 -4.968 0.611 1.00 0.40 C ATOM 590 CG TYR A 79 -0.179 -5.346 -0.701 1.00 1.14 C ATOM 591 CD1 TYR A 79 1.008 -6.056 -0.764 1.00 2.36 C ATOM 592 CD2 TYR A 79 -0.771 -4.956 -1.874 1.00 1.23 C ATOM 593 CE1 TYR A 79 1.586 -6.370 -1.974 1.00 3.09 C ATOM 594 CE2 TYR A 79 -0.206 -5.256 -3.094 1.00 1.86 C ATOM 595 CZ TYR A 79 0.980 -5.965 -3.138 1.00 2.67 C ATOM 596 OH TYR A 79 1.568 -6.256 -4.345 1.00 3.47 O ATOM 0 H TYR A 79 -2.573 -7.198 -0.085 1.00 0.43 H new ATOM 0 HA TYR A 79 -0.825 -6.437 2.147 1.00 0.36 H new ATOM 0 HB2 TYR A 79 -1.540 -4.180 0.430 1.00 0.40 H new ATOM 0 HB3 TYR A 79 -0.039 -4.547 1.257 1.00 0.40 H new ATOM 0 HD1 TYR A 79 1.489 -6.369 0.151 1.00 2.36 H new ATOM 0 HD2 TYR A 79 -1.698 -4.403 -1.841 1.00 1.23 H new ATOM 0 HE1 TYR A 79 2.509 -6.930 -2.007 1.00 3.09 H new ATOM 0 HE2 TYR A 79 -0.686 -4.940 -4.009 1.00 1.86 H new ATOM 0 HH TYR A 79 1.064 -6.969 -4.791 1.00 3.47 H new ATOM 606 N VAL A 80 -2.695 -4.772 2.972 1.00 0.29 N ATOM 607 CA VAL A 80 -3.874 -4.221 3.614 1.00 0.27 C ATOM 608 C VAL A 80 -3.845 -2.703 3.513 1.00 0.21 C ATOM 609 O VAL A 80 -2.849 -2.071 3.871 1.00 0.19 O ATOM 610 CB VAL A 80 -3.971 -4.644 5.097 1.00 0.28 C ATOM 611 CG1 VAL A 80 -5.373 -4.403 5.630 1.00 0.28 C ATOM 612 CG2 VAL A 80 -3.579 -6.106 5.271 1.00 0.40 C ATOM 0 H VAL A 80 -1.809 -4.460 3.369 1.00 0.29 H new ATOM 0 HA VAL A 80 -4.751 -4.614 3.100 1.00 0.27 H new ATOM 0 HB VAL A 80 -3.273 -4.034 5.670 1.00 0.28 H new ATOM 0 HG11 VAL A 80 -5.422 -4.707 6.676 1.00 0.28 H new ATOM 0 HG12 VAL A 80 -5.616 -3.344 5.548 1.00 0.28 H new ATOM 0 HG13 VAL A 80 -6.088 -4.985 5.049 1.00 0.28 H new ATOM 0 HG21 VAL A 80 -3.655 -6.380 6.323 1.00 0.40 H new ATOM 0 HG22 VAL A 80 -4.248 -6.734 4.683 1.00 0.40 H new ATOM 0 HG23 VAL A 80 -2.553 -6.251 4.932 1.00 0.40 H new ATOM 622 N THR A 81 -4.921 -2.124 3.009 1.00 0.22 N ATOM 623 CA THR A 81 -4.982 -0.692 2.794 1.00 0.22 C ATOM 624 C THR A 81 -5.906 -0.034 3.813 1.00 0.22 C ATOM 625 O THR A 81 -6.979 -0.541 4.106 1.00 0.35 O ATOM 626 CB THR A 81 -5.485 -0.369 1.367 1.00 0.32 C ATOM 627 OG1 THR A 81 -6.740 -1.018 1.136 1.00 0.36 O ATOM 628 CG2 THR A 81 -4.481 -0.817 0.311 1.00 0.40 C ATOM 0 H THR A 81 -5.767 -2.627 2.741 1.00 0.22 H new ATOM 0 HA THR A 81 -3.973 -0.297 2.914 1.00 0.22 H new ATOM 0 HB THR A 81 -5.606 0.712 1.290 1.00 0.32 H new ATOM 0 HG1 THR A 81 -7.055 -0.809 0.232 1.00 0.36 H new ATOM 0 HG21 THR A 81 -4.864 -0.576 -0.681 1.00 0.40 H new ATOM 0 HG22 THR A 81 -3.533 -0.303 0.469 1.00 0.40 H new ATOM 0 HG23 THR A 81 -4.327 -1.893 0.389 1.00 0.40 H new ATOM 636 N SER A 82 -5.478 1.078 4.377 1.00 0.19 N ATOM 637 CA SER A 82 -6.333 1.858 5.245 1.00 0.20 C ATOM 638 C SER A 82 -6.920 3.003 4.441 1.00 0.24 C ATOM 639 O SER A 82 -6.325 4.078 4.344 1.00 0.29 O ATOM 640 CB SER A 82 -5.537 2.389 6.438 1.00 0.25 C ATOM 641 OG SER A 82 -4.480 3.231 6.014 1.00 1.19 O ATOM 0 H SER A 82 -4.541 1.461 4.249 1.00 0.19 H new ATOM 0 HA SER A 82 -7.137 1.233 5.633 1.00 0.20 H new ATOM 0 HB2 SER A 82 -6.200 2.941 7.104 1.00 0.25 H new ATOM 0 HB3 SER A 82 -5.133 1.554 7.010 1.00 0.25 H new ATOM 0 HG SER A 82 -4.848 4.000 5.530 1.00 1.19 H new ATOM 647 N HIS A 83 -8.071 2.775 3.841 1.00 0.24 N ATOM 648 CA HIS A 83 -8.622 3.760 2.940 1.00 0.30 C ATOM 649 C HIS A 83 -10.003 4.219 3.391 1.00 0.29 C ATOM 650 O HIS A 83 -10.757 3.465 4.013 1.00 0.27 O ATOM 651 CB HIS A 83 -8.620 3.232 1.490 1.00 0.33 C ATOM 652 CG HIS A 83 -9.704 2.259 1.151 1.00 0.32 C ATOM 653 ND1 HIS A 83 -10.191 2.061 -0.139 1.00 0.39 N ATOM 654 CD2 HIS A 83 -10.447 1.464 1.955 1.00 0.28 C ATOM 655 CE1 HIS A 83 -11.200 1.179 -0.062 1.00 0.39 C ATOM 656 NE2 HIS A 83 -11.376 0.826 1.175 1.00 0.33 N ATOM 0 H HIS A 83 -8.632 1.932 3.959 1.00 0.24 H new ATOM 0 HA HIS A 83 -7.983 4.643 2.964 1.00 0.30 H new ATOM 0 HB2 HIS A 83 -8.697 4.083 0.813 1.00 0.33 H new ATOM 0 HB3 HIS A 83 -7.658 2.757 1.297 1.00 0.33 H new ATOM 0 HD1 HIS A 83 -9.844 2.506 -0.989 1.00 0.39 H new ATOM 0 HD2 HIS A 83 -10.329 1.352 3.023 1.00 0.28 H new ATOM 0 HE1 HIS A 83 -11.777 0.818 -0.901 1.00 0.39 H new ATOM 664 N GLY A 84 -10.305 5.478 3.111 1.00 0.35 N ATOM 665 CA GLY A 84 -11.601 6.025 3.449 1.00 0.36 C ATOM 666 C GLY A 84 -11.755 6.249 4.933 1.00 0.36 C ATOM 667 O GLY A 84 -11.500 7.341 5.432 1.00 0.42 O ATOM 0 H GLY A 84 -9.671 6.133 2.653 1.00 0.35 H new ATOM 0 HA2 GLY A 84 -11.743 6.970 2.924 1.00 0.36 H new ATOM 0 HA3 GLY A 84 -12.381 5.347 3.103 1.00 0.36 H new ATOM 671 N ASP A 85 -12.184 5.210 5.626 1.00 0.33 N ATOM 672 CA ASP A 85 -12.379 5.259 7.068 1.00 0.36 C ATOM 673 C ASP A 85 -11.771 4.035 7.749 1.00 0.33 C ATOM 674 O ASP A 85 -11.486 4.050 8.949 1.00 0.38 O ATOM 675 CB ASP A 85 -13.881 5.344 7.372 1.00 0.42 C ATOM 676 CG ASP A 85 -14.225 5.022 8.816 1.00 0.89 C ATOM 677 OD1 ASP A 85 -14.161 5.939 9.665 1.00 0.85 O ATOM 678 OD2 ASP A 85 -14.542 3.852 9.116 1.00 1.59 O ATOM 0 H ASP A 85 -12.408 4.307 5.207 1.00 0.33 H new ATOM 0 HA ASP A 85 -11.874 6.142 7.460 1.00 0.36 H new ATOM 0 HB2 ASP A 85 -14.235 6.348 7.137 1.00 0.42 H new ATOM 0 HB3 ASP A 85 -14.416 4.656 6.717 1.00 0.42 H new ATOM 683 N HIS A 86 -11.529 2.989 6.972 1.00 0.29 N ATOM 684 CA HIS A 86 -11.277 1.670 7.534 1.00 0.27 C ATOM 685 C HIS A 86 -10.086 0.978 6.896 1.00 0.23 C ATOM 686 O HIS A 86 -9.449 1.508 5.988 1.00 0.21 O ATOM 687 CB HIS A 86 -12.523 0.801 7.352 1.00 0.29 C ATOM 688 CG HIS A 86 -13.005 0.726 5.931 1.00 0.27 C ATOM 689 ND1 HIS A 86 -14.281 1.099 5.521 1.00 0.30 N ATOM 690 CD2 HIS A 86 -12.366 0.278 4.814 1.00 0.26 C ATOM 691 CE1 HIS A 86 -14.376 0.862 4.200 1.00 0.30 C ATOM 692 NE2 HIS A 86 -13.255 0.362 3.759 1.00 0.28 N ATOM 0 H HIS A 86 -11.502 3.028 5.953 1.00 0.29 H new ATOM 0 HA HIS A 86 -11.045 1.804 8.591 1.00 0.27 H new ATOM 0 HB2 HIS A 86 -12.307 -0.207 7.707 1.00 0.29 H new ATOM 0 HB3 HIS A 86 -13.324 1.194 7.978 1.00 0.29 H new ATOM 0 HD1 HIS A 86 -15.014 1.484 6.116 1.00 0.30 H new ATOM 0 HD2 HIS A 86 -11.348 -0.079 4.762 1.00 0.26 H new ATOM 0 HE1 HIS A 86 -15.250 1.057 3.595 1.00 0.30 H new ATOM 700 N TYR A 87 -9.799 -0.216 7.394 1.00 0.24 N ATOM 701 CA TYR A 87 -8.782 -1.066 6.806 1.00 0.22 C ATOM 702 C TYR A 87 -9.447 -2.044 5.857 1.00 0.22 C ATOM 703 O TYR A 87 -10.410 -2.719 6.225 1.00 0.26 O ATOM 704 CB TYR A 87 -8.023 -1.839 7.892 1.00 0.25 C ATOM 705 CG TYR A 87 -7.406 -0.961 8.953 1.00 0.29 C ATOM 706 CD1 TYR A 87 -6.864 0.264 8.619 1.00 0.27 C ATOM 707 CD2 TYR A 87 -7.367 -1.355 10.285 1.00 0.38 C ATOM 708 CE1 TYR A 87 -6.300 1.080 9.569 1.00 0.32 C ATOM 709 CE2 TYR A 87 -6.800 -0.542 11.251 1.00 0.43 C ATOM 710 CZ TYR A 87 -6.268 0.677 10.885 1.00 0.40 C ATOM 711 OH TYR A 87 -5.703 1.496 11.837 1.00 0.46 O ATOM 0 H TYR A 87 -10.262 -0.617 8.210 1.00 0.24 H new ATOM 0 HA TYR A 87 -8.068 -0.443 6.266 1.00 0.22 H new ATOM 0 HB2 TYR A 87 -8.707 -2.541 8.369 1.00 0.25 H new ATOM 0 HB3 TYR A 87 -7.237 -2.429 7.421 1.00 0.25 H new ATOM 0 HD1 TYR A 87 -6.884 0.588 7.589 1.00 0.27 H new ATOM 0 HD2 TYR A 87 -7.785 -2.309 10.570 1.00 0.38 H new ATOM 0 HE1 TYR A 87 -5.883 2.035 9.285 1.00 0.32 H new ATOM 0 HE2 TYR A 87 -6.774 -0.859 12.283 1.00 0.43 H new ATOM 0 HH TYR A 87 -5.762 1.066 12.715 1.00 0.46 H new ATOM 721 N HIS A 88 -8.939 -2.133 4.651 1.00 0.21 N ATOM 722 CA HIS A 88 -9.507 -3.015 3.660 1.00 0.25 C ATOM 723 C HIS A 88 -8.408 -3.913 3.103 1.00 0.26 C ATOM 724 O HIS A 88 -7.293 -3.462 2.850 1.00 0.28 O ATOM 725 CB HIS A 88 -10.196 -2.204 2.553 1.00 0.29 C ATOM 726 CG HIS A 88 -11.435 -2.866 2.038 1.00 0.35 C ATOM 727 ND1 HIS A 88 -12.602 -2.190 1.783 1.00 0.38 N ATOM 728 CD2 HIS A 88 -11.655 -4.176 1.760 1.00 0.43 C ATOM 729 CE1 HIS A 88 -13.490 -3.055 1.374 1.00 0.47 C ATOM 730 NE2 HIS A 88 -12.968 -4.292 1.340 1.00 0.51 N ATOM 0 H HIS A 88 -8.129 -1.602 4.331 1.00 0.21 H new ATOM 0 HA HIS A 88 -10.269 -3.645 4.118 1.00 0.25 H new ATOM 0 HB2 HIS A 88 -10.450 -1.216 2.937 1.00 0.29 H new ATOM 0 HB3 HIS A 88 -9.498 -2.056 1.729 1.00 0.29 H new ATOM 0 HD2 HIS A 88 -10.938 -4.979 1.850 1.00 0.43 H new ATOM 0 HE1 HIS A 88 -14.506 -2.810 1.100 1.00 0.47 H new ATOM 0 HE2 HIS A 88 -13.446 -5.149 1.060 1.00 0.51 H new ATOM 738 N TYR A 89 -8.711 -5.190 2.953 1.00 0.28 N ATOM 739 CA TYR A 89 -7.709 -6.162 2.547 1.00 0.31 C ATOM 740 C TYR A 89 -7.627 -6.224 1.025 1.00 0.36 C ATOM 741 O TYR A 89 -8.641 -6.391 0.351 1.00 0.44 O ATOM 742 CB TYR A 89 -8.057 -7.536 3.124 1.00 0.45 C ATOM 743 CG TYR A 89 -6.872 -8.456 3.311 1.00 0.45 C ATOM 744 CD1 TYR A 89 -5.671 -8.227 2.656 1.00 0.45 C ATOM 745 CD2 TYR A 89 -6.956 -9.556 4.150 1.00 0.59 C ATOM 746 CE1 TYR A 89 -4.593 -9.060 2.828 1.00 0.50 C ATOM 747 CE2 TYR A 89 -5.879 -10.399 4.329 1.00 0.62 C ATOM 748 CZ TYR A 89 -4.698 -10.148 3.666 1.00 0.53 C ATOM 749 OH TYR A 89 -3.625 -10.991 3.842 1.00 0.60 O ATOM 0 H TYR A 89 -9.641 -5.579 3.106 1.00 0.28 H new ATOM 0 HA TYR A 89 -6.736 -5.858 2.932 1.00 0.31 H new ATOM 0 HB2 TYR A 89 -8.549 -7.398 4.087 1.00 0.45 H new ATOM 0 HB3 TYR A 89 -8.777 -8.021 2.465 1.00 0.45 H new ATOM 0 HD1 TYR A 89 -5.582 -7.376 1.997 1.00 0.45 H new ATOM 0 HD2 TYR A 89 -7.880 -9.756 4.672 1.00 0.59 H new ATOM 0 HE1 TYR A 89 -3.667 -8.863 2.308 1.00 0.50 H new ATOM 0 HE2 TYR A 89 -5.961 -11.252 4.986 1.00 0.62 H new ATOM 0 HH TYR A 89 -3.870 -11.706 4.466 1.00 0.60 H new ATOM 759 N TYR A 90 -6.412 -6.127 0.498 1.00 0.45 N ATOM 760 CA TYR A 90 -6.197 -5.983 -0.934 1.00 0.69 C ATOM 761 C TYR A 90 -5.195 -7.012 -1.459 1.00 0.55 C ATOM 762 O TYR A 90 -4.254 -7.400 -0.768 1.00 0.47 O ATOM 763 CB TYR A 90 -5.740 -4.545 -1.192 1.00 1.04 C ATOM 764 CG TYR A 90 -5.297 -4.200 -2.599 1.00 0.95 C ATOM 765 CD1 TYR A 90 -4.015 -4.492 -3.053 1.00 1.70 C ATOM 766 CD2 TYR A 90 -6.158 -3.536 -3.456 1.00 1.32 C ATOM 767 CE1 TYR A 90 -3.614 -4.133 -4.327 1.00 2.40 C ATOM 768 CE2 TYR A 90 -5.769 -3.180 -4.727 1.00 2.07 C ATOM 769 CZ TYR A 90 -4.496 -3.477 -5.159 1.00 2.47 C ATOM 770 OH TYR A 90 -4.103 -3.115 -6.427 1.00 3.42 O ATOM 0 H TYR A 90 -5.554 -6.146 1.049 1.00 0.45 H new ATOM 0 HA TYR A 90 -7.123 -6.175 -1.476 1.00 0.69 H new ATOM 0 HB2 TYR A 90 -6.558 -3.877 -0.922 1.00 1.04 H new ATOM 0 HB3 TYR A 90 -4.914 -4.327 -0.515 1.00 1.04 H new ATOM 0 HD1 TYR A 90 -3.323 -5.006 -2.402 1.00 1.70 H new ATOM 0 HD2 TYR A 90 -7.155 -3.292 -3.120 1.00 1.32 H new ATOM 0 HE1 TYR A 90 -2.616 -4.365 -4.668 1.00 2.40 H new ATOM 0 HE2 TYR A 90 -6.459 -2.670 -5.383 1.00 2.07 H new ATOM 0 HH TYR A 90 -3.161 -3.352 -6.558 1.00 3.42 H new ATOM 780 N ASN A 91 -5.423 -7.465 -2.678 1.00 0.67 N ATOM 781 CA ASN A 91 -4.590 -8.490 -3.297 1.00 0.59 C ATOM 782 C ASN A 91 -4.067 -8.001 -4.640 1.00 0.49 C ATOM 783 O ASN A 91 -4.625 -7.073 -5.224 1.00 0.69 O ATOM 784 CB ASN A 91 -5.407 -9.769 -3.488 1.00 0.85 C ATOM 785 CG ASN A 91 -4.574 -10.955 -3.941 1.00 1.27 C ATOM 786 OD1 ASN A 91 -4.424 -11.202 -5.137 1.00 1.58 O ATOM 787 ND2 ASN A 91 -4.029 -11.698 -2.991 1.00 2.04 N ATOM 0 H ASN A 91 -6.187 -7.137 -3.269 1.00 0.67 H new ATOM 0 HA ASN A 91 -3.741 -8.700 -2.647 1.00 0.59 H new ATOM 0 HB2 ASN A 91 -5.901 -10.019 -2.549 1.00 0.85 H new ATOM 0 HB3 ASN A 91 -6.191 -9.584 -4.222 1.00 0.85 H new ATOM 0 HD21 ASN A 91 -3.461 -12.508 -3.240 1.00 2.04 H new ATOM 0 HD22 ASN A 91 -4.177 -11.461 -2.010 1.00 2.04 H new ATOM 794 N GLY A 92 -2.998 -8.616 -5.124 1.00 0.40 N ATOM 795 CA GLY A 92 -2.442 -8.232 -6.403 1.00 0.41 C ATOM 796 C GLY A 92 -1.127 -7.511 -6.250 1.00 0.33 C ATOM 797 O GLY A 92 -0.281 -7.916 -5.455 1.00 0.47 O ATOM 0 H GLY A 92 -2.506 -9.375 -4.653 1.00 0.40 H new ATOM 0 HA2 GLY A 92 -2.300 -9.120 -7.018 1.00 0.41 H new ATOM 0 HA3 GLY A 92 -3.149 -7.590 -6.928 1.00 0.41 H new ATOM 801 N LYS A 93 -0.956 -6.457 -7.028 1.00 0.40 N ATOM 802 CA LYS A 93 0.219 -5.601 -6.938 1.00 0.35 C ATOM 803 C LYS A 93 -0.202 -4.168 -6.653 1.00 0.35 C ATOM 804 O LYS A 93 -1.176 -3.679 -7.228 1.00 0.47 O ATOM 805 CB LYS A 93 1.013 -5.655 -8.244 1.00 0.36 C ATOM 806 CG LYS A 93 1.670 -6.998 -8.501 1.00 0.39 C ATOM 807 CD LYS A 93 3.162 -6.971 -8.182 1.00 0.63 C ATOM 808 CE LYS A 93 3.954 -6.192 -9.207 1.00 1.42 C ATOM 809 NZ LYS A 93 3.844 -6.763 -10.573 1.00 2.03 N ATOM 0 H LYS A 93 -1.626 -6.168 -7.741 1.00 0.40 H new ATOM 0 HA LYS A 93 0.850 -5.958 -6.124 1.00 0.35 H new ATOM 0 HB2 LYS A 93 0.347 -5.421 -9.074 1.00 0.36 H new ATOM 0 HB3 LYS A 93 1.781 -4.882 -8.224 1.00 0.36 H new ATOM 0 HG2 LYS A 93 1.183 -7.762 -7.896 1.00 0.39 H new ATOM 0 HG3 LYS A 93 1.527 -7.279 -9.544 1.00 0.39 H new ATOM 0 HD2 LYS A 93 3.313 -6.529 -7.197 1.00 0.63 H new ATOM 0 HD3 LYS A 93 3.540 -7.992 -8.134 1.00 0.63 H new ATOM 0 HE2 LYS A 93 3.606 -5.159 -9.221 1.00 1.42 H new ATOM 0 HE3 LYS A 93 5.003 -6.171 -8.910 1.00 1.42 H new ATOM 0 HZ1 LYS A 93 4.619 -6.400 -11.164 1.00 2.03 H new ATOM 0 HZ2 LYS A 93 3.904 -7.800 -10.522 1.00 2.03 H new ATOM 0 HZ3 LYS A 93 2.932 -6.490 -10.991 1.00 2.03 H new ATOM 823 N VAL A 94 0.518 -3.511 -5.748 1.00 0.31 N ATOM 824 CA VAL A 94 0.278 -2.104 -5.461 1.00 0.29 C ATOM 825 C VAL A 94 0.418 -1.297 -6.745 1.00 0.28 C ATOM 826 O VAL A 94 1.450 -1.357 -7.401 1.00 0.30 O ATOM 827 CB VAL A 94 1.269 -1.544 -4.413 1.00 0.29 C ATOM 828 CG1 VAL A 94 0.916 -0.109 -4.070 1.00 0.32 C ATOM 829 CG2 VAL A 94 1.292 -2.397 -3.155 1.00 0.41 C ATOM 0 H VAL A 94 1.271 -3.931 -5.203 1.00 0.31 H new ATOM 0 HA VAL A 94 -0.730 -2.020 -5.054 1.00 0.29 H new ATOM 0 HB VAL A 94 2.267 -1.571 -4.851 1.00 0.29 H new ATOM 0 HG11 VAL A 94 1.621 0.273 -3.332 1.00 0.32 H new ATOM 0 HG12 VAL A 94 0.966 0.503 -4.970 1.00 0.32 H new ATOM 0 HG13 VAL A 94 -0.094 -0.070 -3.661 1.00 0.32 H new ATOM 0 HG21 VAL A 94 1.999 -1.974 -2.441 1.00 0.41 H new ATOM 0 HG22 VAL A 94 0.297 -2.418 -2.711 1.00 0.41 H new ATOM 0 HG23 VAL A 94 1.597 -3.412 -3.409 1.00 0.41 H new ATOM 839 N PRO A 95 -0.617 -0.549 -7.135 1.00 0.27 N ATOM 840 CA PRO A 95 -0.589 0.209 -8.376 1.00 0.28 C ATOM 841 C PRO A 95 0.349 1.398 -8.302 1.00 0.25 C ATOM 842 O PRO A 95 0.661 1.875 -7.210 1.00 0.27 O ATOM 843 CB PRO A 95 -2.025 0.676 -8.568 1.00 0.33 C ATOM 844 CG PRO A 95 -2.643 0.636 -7.218 1.00 0.33 C ATOM 845 CD PRO A 95 -1.879 -0.378 -6.402 1.00 0.30 C ATOM 0 HA PRO A 95 -0.222 -0.399 -9.203 1.00 0.28 H new ATOM 0 HB2 PRO A 95 -2.057 1.683 -8.984 1.00 0.33 H new ATOM 0 HB3 PRO A 95 -2.559 0.027 -9.263 1.00 0.33 H new ATOM 0 HG2 PRO A 95 -2.601 1.618 -6.747 1.00 0.33 H new ATOM 0 HG3 PRO A 95 -3.695 0.360 -7.286 1.00 0.33 H new ATOM 0 HD2 PRO A 95 -1.705 -0.023 -5.386 1.00 0.30 H new ATOM 0 HD3 PRO A 95 -2.424 -1.318 -6.322 1.00 0.30 H new ATOM 853 N TYR A 96 0.794 1.867 -9.453 1.00 0.26 N ATOM 854 CA TYR A 96 1.750 2.965 -9.524 1.00 0.27 C ATOM 855 C TYR A 96 1.283 4.147 -8.669 1.00 0.26 C ATOM 856 O TYR A 96 2.047 4.693 -7.871 1.00 0.30 O ATOM 857 CB TYR A 96 1.917 3.401 -10.985 1.00 0.33 C ATOM 858 CG TYR A 96 3.218 4.118 -11.292 1.00 0.38 C ATOM 859 CD1 TYR A 96 3.723 5.089 -10.442 1.00 0.30 C ATOM 860 CD2 TYR A 96 3.936 3.821 -12.442 1.00 0.61 C ATOM 861 CE1 TYR A 96 4.904 5.742 -10.724 1.00 0.35 C ATOM 862 CE2 TYR A 96 5.121 4.470 -12.733 1.00 0.68 C ATOM 863 CZ TYR A 96 5.601 5.430 -11.870 1.00 0.51 C ATOM 864 OH TYR A 96 6.780 6.079 -12.154 1.00 0.59 O ATOM 0 H TYR A 96 0.507 1.503 -10.362 1.00 0.26 H new ATOM 0 HA TYR A 96 2.709 2.624 -9.135 1.00 0.27 H new ATOM 0 HB2 TYR A 96 1.845 2.520 -11.623 1.00 0.33 H new ATOM 0 HB3 TYR A 96 1.087 4.055 -11.251 1.00 0.33 H new ATOM 0 HD1 TYR A 96 3.181 5.339 -9.542 1.00 0.30 H new ATOM 0 HD2 TYR A 96 3.562 3.069 -13.122 1.00 0.61 H new ATOM 0 HE1 TYR A 96 5.281 6.496 -10.049 1.00 0.35 H new ATOM 0 HE2 TYR A 96 5.667 4.226 -13.632 1.00 0.68 H new ATOM 0 HH TYR A 96 7.531 5.461 -12.032 1.00 0.59 H new ATOM 874 N ASP A 97 0.015 4.504 -8.807 1.00 0.28 N ATOM 875 CA ASP A 97 -0.517 5.690 -8.151 1.00 0.33 C ATOM 876 C ASP A 97 -1.204 5.367 -6.825 1.00 0.32 C ATOM 877 O ASP A 97 -2.001 6.163 -6.327 1.00 0.38 O ATOM 878 CB ASP A 97 -1.487 6.427 -9.079 1.00 0.43 C ATOM 879 CG ASP A 97 -2.625 5.549 -9.555 1.00 1.07 C ATOM 880 OD1 ASP A 97 -2.387 4.694 -10.432 1.00 1.82 O ATOM 881 OD2 ASP A 97 -3.760 5.719 -9.068 1.00 1.07 O ATOM 0 H ASP A 97 -0.665 3.990 -9.367 1.00 0.28 H new ATOM 0 HA ASP A 97 0.333 6.335 -7.928 1.00 0.33 H new ATOM 0 HB2 ASP A 97 -1.896 7.292 -8.557 1.00 0.43 H new ATOM 0 HB3 ASP A 97 -0.940 6.805 -9.943 1.00 0.43 H new ATOM 886 N ALA A 98 -0.894 4.212 -6.244 1.00 0.27 N ATOM 887 CA ALA A 98 -1.410 3.872 -4.921 1.00 0.27 C ATOM 888 C ALA A 98 -0.752 4.736 -3.857 1.00 0.26 C ATOM 889 O ALA A 98 0.191 5.472 -4.147 1.00 0.40 O ATOM 890 CB ALA A 98 -1.174 2.411 -4.602 1.00 0.30 C ATOM 0 H ALA A 98 -0.294 3.501 -6.663 1.00 0.27 H new ATOM 0 HA ALA A 98 -2.484 4.059 -4.926 1.00 0.27 H new ATOM 0 HB1 ALA A 98 -1.568 2.187 -3.611 1.00 0.30 H new ATOM 0 HB2 ALA A 98 -1.679 1.791 -5.343 1.00 0.30 H new ATOM 0 HB3 ALA A 98 -0.104 2.202 -4.623 1.00 0.30 H new ATOM 896 N ILE A 99 -1.274 4.664 -2.642 1.00 0.18 N ATOM 897 CA ILE A 99 -0.722 5.394 -1.515 1.00 0.17 C ATOM 898 C ILE A 99 -0.245 4.419 -0.434 1.00 0.16 C ATOM 899 O ILE A 99 -0.861 3.377 -0.221 1.00 0.16 O ATOM 900 CB ILE A 99 -1.793 6.328 -0.931 1.00 0.21 C ATOM 901 CG1 ILE A 99 -2.410 7.163 -2.051 1.00 0.21 C ATOM 902 CG2 ILE A 99 -1.214 7.224 0.150 1.00 0.26 C ATOM 903 CD1 ILE A 99 -1.422 8.034 -2.798 1.00 0.29 C ATOM 0 H ILE A 99 -2.091 4.098 -2.411 1.00 0.18 H new ATOM 0 HA ILE A 99 0.128 5.984 -1.858 1.00 0.17 H new ATOM 0 HB ILE A 99 -2.570 5.719 -0.468 1.00 0.21 H new ATOM 0 HG12 ILE A 99 -2.896 6.494 -2.761 1.00 0.21 H new ATOM 0 HG13 ILE A 99 -3.188 7.798 -1.628 1.00 0.21 H new ATOM 0 HG21 ILE A 99 -1.997 7.873 0.543 1.00 0.26 H new ATOM 0 HG22 ILE A 99 -0.814 6.609 0.956 1.00 0.26 H new ATOM 0 HG23 ILE A 99 -0.415 7.834 -0.272 1.00 0.26 H new ATOM 0 HD11 ILE A 99 -1.944 8.592 -3.575 1.00 0.29 H new ATOM 0 HD12 ILE A 99 -0.953 8.731 -2.103 1.00 0.29 H new ATOM 0 HD13 ILE A 99 -0.656 7.407 -3.254 1.00 0.29 H new ATOM 915 N ILE A 100 0.857 4.744 0.228 1.00 0.17 N ATOM 916 CA ILE A 100 1.416 3.888 1.265 1.00 0.18 C ATOM 917 C ILE A 100 1.475 4.618 2.608 1.00 0.18 C ATOM 918 O ILE A 100 1.547 5.848 2.659 1.00 0.20 O ATOM 919 CB ILE A 100 2.843 3.437 0.889 1.00 0.20 C ATOM 920 CG1 ILE A 100 2.865 2.802 -0.506 1.00 0.21 C ATOM 921 CG2 ILE A 100 3.385 2.463 1.928 1.00 0.22 C ATOM 922 CD1 ILE A 100 2.242 1.424 -0.568 1.00 0.23 C ATOM 0 H ILE A 100 1.385 5.601 0.063 1.00 0.17 H new ATOM 0 HA ILE A 100 0.764 3.019 1.353 1.00 0.18 H new ATOM 0 HB ILE A 100 3.485 4.318 0.871 1.00 0.20 H new ATOM 0 HG12 ILE A 100 2.340 3.458 -1.200 1.00 0.21 H new ATOM 0 HG13 ILE A 100 3.898 2.738 -0.848 1.00 0.21 H new ATOM 0 HG21 ILE A 100 4.392 2.155 1.647 1.00 0.22 H new ATOM 0 HG22 ILE A 100 3.413 2.949 2.903 1.00 0.22 H new ATOM 0 HG23 ILE A 100 2.738 1.587 1.978 1.00 0.22 H new ATOM 0 HD11 ILE A 100 2.298 1.045 -1.589 1.00 0.23 H new ATOM 0 HD12 ILE A 100 2.781 0.751 0.099 1.00 0.23 H new ATOM 0 HD13 ILE A 100 1.198 1.482 -0.259 1.00 0.23 H new ATOM 934 N SER A 101 1.427 3.851 3.691 1.00 0.20 N ATOM 935 CA SER A 101 1.631 4.383 5.027 1.00 0.20 C ATOM 936 C SER A 101 3.112 4.621 5.278 1.00 0.20 C ATOM 937 O SER A 101 3.968 3.868 4.806 1.00 0.23 O ATOM 938 CB SER A 101 1.094 3.411 6.075 1.00 0.22 C ATOM 939 OG SER A 101 1.494 3.787 7.384 1.00 0.89 O ATOM 0 H SER A 101 1.246 2.847 3.665 1.00 0.20 H new ATOM 0 HA SER A 101 1.093 5.328 5.103 1.00 0.20 H new ATOM 0 HB2 SER A 101 0.006 3.380 6.020 1.00 0.22 H new ATOM 0 HB3 SER A 101 1.453 2.405 5.858 1.00 0.22 H new ATOM 0 HG SER A 101 0.711 3.801 7.974 1.00 0.89 H new ATOM 945 N GLU A 102 3.397 5.657 6.052 1.00 0.20 N ATOM 946 CA GLU A 102 4.762 6.025 6.388 1.00 0.21 C ATOM 947 C GLU A 102 5.418 4.955 7.263 1.00 0.24 C ATOM 948 O GLU A 102 6.634 4.941 7.437 1.00 0.29 O ATOM 949 CB GLU A 102 4.769 7.375 7.101 1.00 0.25 C ATOM 950 CG GLU A 102 4.244 7.316 8.524 1.00 0.31 C ATOM 951 CD GLU A 102 5.250 7.816 9.531 1.00 0.94 C ATOM 952 OE1 GLU A 102 6.172 7.052 9.875 1.00 1.22 O ATOM 953 OE2 GLU A 102 5.134 8.972 9.971 1.00 1.71 O ATOM 0 H GLU A 102 2.689 6.265 6.464 1.00 0.20 H new ATOM 0 HA GLU A 102 5.339 6.103 5.467 1.00 0.21 H new ATOM 0 HB2 GLU A 102 5.787 7.763 7.115 1.00 0.25 H new ATOM 0 HB3 GLU A 102 4.166 8.081 6.530 1.00 0.25 H new ATOM 0 HG2 GLU A 102 3.334 7.912 8.597 1.00 0.31 H new ATOM 0 HG3 GLU A 102 3.973 6.288 8.766 1.00 0.31 H new ATOM 960 N GLU A 103 4.594 4.054 7.795 1.00 0.27 N ATOM 961 CA GLU A 103 5.063 2.956 8.633 1.00 0.34 C ATOM 962 C GLU A 103 5.961 1.995 7.858 1.00 0.31 C ATOM 963 O GLU A 103 6.729 1.232 8.445 1.00 0.41 O ATOM 964 CB GLU A 103 3.866 2.185 9.169 1.00 0.43 C ATOM 965 CG GLU A 103 3.008 2.974 10.128 1.00 0.67 C ATOM 966 CD GLU A 103 1.702 2.279 10.447 1.00 1.15 C ATOM 967 OE1 GLU A 103 0.850 2.174 9.540 1.00 1.42 O ATOM 968 OE2 GLU A 103 1.519 1.841 11.601 1.00 1.48 O ATOM 0 H GLU A 103 3.584 4.066 7.656 1.00 0.27 H new ATOM 0 HA GLU A 103 5.645 3.385 9.449 1.00 0.34 H new ATOM 0 HB2 GLU A 103 3.251 1.860 8.330 1.00 0.43 H new ATOM 0 HB3 GLU A 103 4.221 1.285 9.671 1.00 0.43 H new ATOM 0 HG2 GLU A 103 3.562 3.141 11.052 1.00 0.67 H new ATOM 0 HG3 GLU A 103 2.799 3.954 9.700 1.00 0.67 H new ATOM 975 N LEU A 104 5.844 2.028 6.543 1.00 0.23 N ATOM 976 CA LEU A 104 6.533 1.068 5.689 1.00 0.25 C ATOM 977 C LEU A 104 7.681 1.708 4.917 1.00 0.27 C ATOM 978 O LEU A 104 8.314 1.058 4.083 1.00 0.29 O ATOM 979 CB LEU A 104 5.531 0.453 4.718 1.00 0.27 C ATOM 980 CG LEU A 104 4.352 -0.249 5.382 1.00 0.28 C ATOM 981 CD1 LEU A 104 3.290 -0.590 4.356 1.00 0.33 C ATOM 982 CD2 LEU A 104 4.826 -1.502 6.095 1.00 0.30 C ATOM 0 H LEU A 104 5.277 2.710 6.039 1.00 0.23 H new ATOM 0 HA LEU A 104 6.964 0.296 6.327 1.00 0.25 H new ATOM 0 HB2 LEU A 104 5.149 1.238 4.065 1.00 0.27 H new ATOM 0 HB3 LEU A 104 6.053 -0.263 4.083 1.00 0.27 H new ATOM 0 HG LEU A 104 3.912 0.425 6.117 1.00 0.28 H new ATOM 0 HD11 LEU A 104 2.456 -1.091 4.848 1.00 0.33 H new ATOM 0 HD12 LEU A 104 2.935 0.325 3.882 1.00 0.33 H new ATOM 0 HD13 LEU A 104 3.714 -1.250 3.599 1.00 0.33 H new ATOM 0 HD21 LEU A 104 3.976 -1.996 6.566 1.00 0.30 H new ATOM 0 HD22 LEU A 104 5.286 -2.179 5.375 1.00 0.30 H new ATOM 0 HD23 LEU A 104 5.557 -1.232 6.857 1.00 0.30 H new ATOM 994 N LEU A 105 7.935 2.981 5.180 1.00 0.43 N ATOM 995 CA LEU A 105 8.984 3.711 4.517 1.00 0.54 C ATOM 996 C LEU A 105 10.346 3.083 4.711 1.00 0.46 C ATOM 997 O LEU A 105 10.723 2.684 5.811 1.00 0.53 O ATOM 998 CB LEU A 105 9.006 5.130 5.048 1.00 0.88 C ATOM 999 CG LEU A 105 7.948 6.064 4.484 1.00 0.30 C ATOM 1000 CD1 LEU A 105 8.573 6.901 3.408 1.00 1.01 C ATOM 1001 CD2 LEU A 105 6.788 5.293 3.901 1.00 1.09 C ATOM 0 H LEU A 105 7.413 3.531 5.863 1.00 0.43 H new ATOM 0 HA LEU A 105 8.772 3.695 3.448 1.00 0.54 H new ATOM 0 HB2 LEU A 105 8.892 5.094 6.131 1.00 0.88 H new ATOM 0 HB3 LEU A 105 9.987 5.559 4.845 1.00 0.88 H new ATOM 0 HG LEU A 105 7.568 6.689 5.292 1.00 0.30 H new ATOM 0 HD11 LEU A 105 7.826 7.577 2.993 1.00 1.01 H new ATOM 0 HD12 LEU A 105 9.394 7.482 3.829 1.00 1.01 H new ATOM 0 HD13 LEU A 105 8.955 6.253 2.619 1.00 1.01 H new ATOM 0 HD21 LEU A 105 6.049 5.990 3.506 1.00 1.09 H new ATOM 0 HD22 LEU A 105 7.146 4.650 3.097 1.00 1.09 H new ATOM 0 HD23 LEU A 105 6.330 4.681 4.678 1.00 1.09 H new ATOM 1013 N MET A 106 11.068 2.994 3.619 1.00 0.41 N ATOM 1014 CA MET A 106 12.452 2.596 3.645 1.00 0.45 C ATOM 1015 C MET A 106 13.344 3.762 3.250 1.00 0.92 C ATOM 1016 O MET A 106 13.424 4.128 2.076 1.00 1.28 O ATOM 1017 CB MET A 106 12.691 1.411 2.710 1.00 0.27 C ATOM 1018 CG MET A 106 14.158 1.215 2.335 1.00 0.30 C ATOM 1019 SD MET A 106 14.447 -0.226 1.323 1.00 1.05 S ATOM 1020 CE MET A 106 14.392 -1.505 2.562 1.00 0.50 C ATOM 0 H MET A 106 10.709 3.197 2.686 1.00 0.41 H new ATOM 0 HA MET A 106 12.701 2.290 4.661 1.00 0.45 H new ATOM 0 HB2 MET A 106 12.322 0.503 3.186 1.00 0.27 H new ATOM 0 HB3 MET A 106 12.108 1.553 1.800 1.00 0.27 H new ATOM 0 HG2 MET A 106 14.510 2.099 1.804 1.00 0.30 H new ATOM 0 HG3 MET A 106 14.750 1.134 3.246 1.00 0.30 H new ATOM 0 HE1 MET A 106 15.397 -1.891 2.732 1.00 0.50 H new ATOM 0 HE2 MET A 106 13.999 -1.094 3.492 1.00 0.50 H new ATOM 0 HE3 MET A 106 13.746 -2.314 2.221 1.00 0.50 H new ATOM 1030 N LYS A 107 13.969 4.368 4.238 1.00 1.28 N ATOM 1031 CA LYS A 107 15.067 5.272 3.978 1.00 1.66 C ATOM 1032 C LYS A 107 16.233 4.820 4.831 1.00 1.09 C ATOM 1033 O LYS A 107 16.278 5.074 6.034 1.00 1.52 O ATOM 1034 CB LYS A 107 14.675 6.716 4.311 1.00 2.68 C ATOM 1035 CG LYS A 107 15.742 7.735 3.948 1.00 3.57 C ATOM 1036 CD LYS A 107 15.326 9.152 4.312 1.00 4.57 C ATOM 1037 CE LYS A 107 15.156 9.319 5.812 1.00 5.18 C ATOM 1038 NZ LYS A 107 14.935 10.738 6.194 1.00 5.65 N ATOM 0 H LYS A 107 13.736 4.251 5.224 1.00 1.28 H new ATOM 0 HA LYS A 107 15.336 5.252 2.922 1.00 1.66 H new ATOM 0 HB2 LYS A 107 13.753 6.964 3.784 1.00 2.68 H new ATOM 0 HB3 LYS A 107 14.462 6.789 5.378 1.00 2.68 H new ATOM 0 HG2 LYS A 107 16.670 7.486 4.463 1.00 3.57 H new ATOM 0 HG3 LYS A 107 15.946 7.681 2.879 1.00 3.57 H new ATOM 0 HD2 LYS A 107 16.075 9.856 3.950 1.00 4.57 H new ATOM 0 HD3 LYS A 107 14.390 9.397 3.810 1.00 4.57 H new ATOM 0 HE2 LYS A 107 14.312 8.717 6.150 1.00 5.18 H new ATOM 0 HE3 LYS A 107 16.042 8.940 6.321 1.00 5.18 H new ATOM 0 HZ1 LYS A 107 14.824 10.807 7.226 1.00 5.65 H new ATOM 0 HZ2 LYS A 107 15.751 11.309 5.895 1.00 5.65 H new ATOM 0 HZ3 LYS A 107 14.075 11.093 5.729 1.00 5.65 H new ATOM 1052 N ASP A 108 17.168 4.142 4.200 1.00 1.16 N ATOM 1053 CA ASP A 108 18.253 3.507 4.920 1.00 1.22 C ATOM 1054 C ASP A 108 19.599 3.993 4.405 1.00 1.17 C ATOM 1055 O ASP A 108 19.804 4.093 3.195 1.00 1.12 O ATOM 1056 CB ASP A 108 18.138 1.988 4.793 1.00 1.88 C ATOM 1057 CG ASP A 108 18.830 1.261 5.925 1.00 2.55 C ATOM 1058 OD1 ASP A 108 20.043 0.986 5.808 1.00 3.03 O ATOM 1059 OD2 ASP A 108 18.167 0.957 6.935 1.00 2.80 O ATOM 0 H ASP A 108 17.199 4.016 3.188 1.00 1.16 H new ATOM 0 HA ASP A 108 18.183 3.777 5.974 1.00 1.22 H new ATOM 0 HB2 ASP A 108 17.085 1.706 4.774 1.00 1.88 H new ATOM 0 HB3 ASP A 108 18.570 1.672 3.844 1.00 1.88 H new ATOM 1064 N PRO A 109 20.538 4.302 5.306 1.00 1.79 N ATOM 1065 CA PRO A 109 21.880 4.727 4.919 1.00 2.23 C ATOM 1066 C PRO A 109 22.757 3.553 4.496 1.00 2.02 C ATOM 1067 O PRO A 109 23.845 3.742 3.953 1.00 2.25 O ATOM 1068 CB PRO A 109 22.418 5.373 6.192 1.00 3.08 C ATOM 1069 CG PRO A 109 21.728 4.653 7.298 1.00 3.14 C ATOM 1070 CD PRO A 109 20.364 4.283 6.772 1.00 2.41 C ATOM 0 HA PRO A 109 21.871 5.395 4.058 1.00 2.23 H new ATOM 0 HB2 PRO A 109 23.500 5.266 6.264 1.00 3.08 H new ATOM 0 HB3 PRO A 109 22.200 6.441 6.217 1.00 3.08 H new ATOM 0 HG2 PRO A 109 22.286 3.764 7.592 1.00 3.14 H new ATOM 0 HG3 PRO A 109 21.646 5.285 8.182 1.00 3.14 H new ATOM 0 HD2 PRO A 109 20.051 3.300 7.126 1.00 2.41 H new ATOM 0 HD3 PRO A 109 19.604 4.995 7.094 1.00 2.41 H new ATOM 1078 N ASN A 110 22.275 2.342 4.745 1.00 1.75 N ATOM 1079 CA ASN A 110 23.014 1.137 4.402 1.00 1.67 C ATOM 1080 C ASN A 110 22.370 0.421 3.221 1.00 1.25 C ATOM 1081 O ASN A 110 23.029 -0.343 2.516 1.00 1.26 O ATOM 1082 CB ASN A 110 23.087 0.205 5.620 1.00 1.96 C ATOM 1083 CG ASN A 110 23.726 -1.141 5.316 1.00 2.05 C ATOM 1084 OD1 ASN A 110 24.950 -1.282 5.344 1.00 2.18 O ATOM 1085 ND2 ASN A 110 22.900 -2.147 5.062 1.00 2.57 N ATOM 0 H ASN A 110 21.371 2.170 5.185 1.00 1.75 H new ATOM 0 HA ASN A 110 24.025 1.421 4.111 1.00 1.67 H new ATOM 0 HB2 ASN A 110 23.654 0.697 6.411 1.00 1.96 H new ATOM 0 HB3 ASN A 110 22.080 0.042 6.004 1.00 1.96 H new ATOM 0 HD21 ASN A 110 23.272 -3.079 4.881 1.00 2.57 H new ATOM 0 HD22 ASN A 110 21.892 -1.989 5.048 1.00 2.57 H new ATOM 1092 N TYR A 111 21.094 0.692 2.977 1.00 0.95 N ATOM 1093 CA TYR A 111 20.382 0.011 1.905 1.00 0.70 C ATOM 1094 C TYR A 111 20.138 0.936 0.726 1.00 0.60 C ATOM 1095 O TYR A 111 19.661 2.060 0.885 1.00 0.80 O ATOM 1096 CB TYR A 111 19.031 -0.548 2.369 1.00 0.70 C ATOM 1097 CG TYR A 111 18.352 -1.376 1.301 1.00 0.76 C ATOM 1098 CD1 TYR A 111 18.702 -2.703 1.081 1.00 0.94 C ATOM 1099 CD2 TYR A 111 17.367 -0.822 0.502 1.00 0.89 C ATOM 1100 CE1 TYR A 111 18.086 -3.449 0.091 1.00 1.18 C ATOM 1101 CE2 TYR A 111 16.748 -1.557 -0.489 1.00 1.12 C ATOM 1102 CZ TYR A 111 17.108 -2.869 -0.692 1.00 1.23 C ATOM 1103 OH TYR A 111 16.503 -3.595 -1.691 1.00 1.57 O ATOM 0 H TYR A 111 20.538 1.369 3.499 1.00 0.95 H new ATOM 0 HA TYR A 111 21.023 -0.816 1.601 1.00 0.70 H new ATOM 0 HB2 TYR A 111 19.180 -1.160 3.259 1.00 0.70 H new ATOM 0 HB3 TYR A 111 18.378 0.277 2.655 1.00 0.70 H new ATOM 0 HD1 TYR A 111 19.467 -3.159 1.692 1.00 0.94 H new ATOM 0 HD2 TYR A 111 17.077 0.207 0.657 1.00 0.89 H new ATOM 0 HE1 TYR A 111 18.369 -4.479 -0.068 1.00 1.18 H new ATOM 0 HE2 TYR A 111 15.984 -1.104 -1.103 1.00 1.12 H new ATOM 0 HH TYR A 111 16.350 -4.512 -1.382 1.00 1.57 H new ATOM 1113 N GLN A 112 20.467 0.448 -0.454 1.00 0.53 N ATOM 1114 CA GLN A 112 20.121 1.099 -1.675 1.00 0.55 C ATOM 1115 C GLN A 112 19.171 0.224 -2.465 1.00 0.45 C ATOM 1116 O GLN A 112 19.280 -1.003 -2.442 1.00 0.47 O ATOM 1117 CB GLN A 112 21.377 1.389 -2.466 1.00 0.70 C ATOM 1118 CG GLN A 112 21.105 1.621 -3.914 1.00 1.30 C ATOM 1119 CD GLN A 112 22.337 2.006 -4.701 1.00 1.42 C ATOM 1120 OE1 GLN A 112 23.042 1.149 -5.233 1.00 1.64 O ATOM 1121 NE2 GLN A 112 22.605 3.297 -4.777 1.00 2.05 N ATOM 0 H GLN A 112 20.987 -0.421 -0.579 1.00 0.53 H new ATOM 0 HA GLN A 112 19.621 2.044 -1.463 1.00 0.55 H new ATOM 0 HB2 GLN A 112 21.870 2.267 -2.048 1.00 0.70 H new ATOM 0 HB3 GLN A 112 22.069 0.554 -2.360 1.00 0.70 H new ATOM 0 HG2 GLN A 112 20.675 0.717 -4.345 1.00 1.30 H new ATOM 0 HG3 GLN A 112 20.358 2.408 -4.014 1.00 1.30 H new ATOM 0 HE21 GLN A 112 21.993 3.973 -4.320 1.00 2.05 H new ATOM 0 HE22 GLN A 112 23.424 3.618 -5.293 1.00 2.05 H new ATOM 1130 N LEU A 113 18.251 0.876 -3.158 1.00 0.40 N ATOM 1131 CA LEU A 113 17.206 0.198 -3.904 1.00 0.33 C ATOM 1132 C LEU A 113 17.805 -0.821 -4.865 1.00 0.36 C ATOM 1133 O LEU A 113 18.566 -0.468 -5.766 1.00 0.43 O ATOM 1134 CB LEU A 113 16.377 1.227 -4.669 1.00 0.32 C ATOM 1135 CG LEU A 113 15.244 0.654 -5.519 1.00 0.30 C ATOM 1136 CD1 LEU A 113 14.116 0.154 -4.632 1.00 0.25 C ATOM 1137 CD2 LEU A 113 14.736 1.698 -6.498 1.00 0.35 C ATOM 0 H LEU A 113 18.209 1.893 -3.218 1.00 0.40 H new ATOM 0 HA LEU A 113 16.562 -0.336 -3.205 1.00 0.33 H new ATOM 0 HB2 LEU A 113 15.952 1.931 -3.953 1.00 0.32 H new ATOM 0 HB3 LEU A 113 17.043 1.796 -5.318 1.00 0.32 H new ATOM 0 HG LEU A 113 15.630 -0.191 -6.090 1.00 0.30 H new ATOM 0 HD11 LEU A 113 13.317 -0.251 -5.253 1.00 0.25 H new ATOM 0 HD12 LEU A 113 14.492 -0.626 -3.970 1.00 0.25 H new ATOM 0 HD13 LEU A 113 13.729 0.980 -4.036 1.00 0.25 H new ATOM 0 HD21 LEU A 113 13.929 1.274 -7.096 1.00 0.35 H new ATOM 0 HD22 LEU A 113 14.364 2.562 -5.948 1.00 0.35 H new ATOM 0 HD23 LEU A 113 15.549 2.008 -7.154 1.00 0.35 H new ATOM 1149 N LYS A 114 17.482 -2.086 -4.643 1.00 0.40 N ATOM 1150 CA LYS A 114 18.009 -3.162 -5.466 1.00 0.47 C ATOM 1151 C LYS A 114 16.918 -3.741 -6.345 1.00 0.37 C ATOM 1152 O LYS A 114 15.830 -4.073 -5.871 1.00 0.33 O ATOM 1153 CB LYS A 114 18.604 -4.256 -4.589 1.00 0.63 C ATOM 1154 CG LYS A 114 19.476 -5.255 -5.326 1.00 0.90 C ATOM 1155 CD LYS A 114 20.602 -4.563 -6.076 1.00 1.14 C ATOM 1156 CE LYS A 114 21.615 -5.554 -6.623 1.00 1.51 C ATOM 1157 NZ LYS A 114 22.405 -6.202 -5.542 1.00 2.09 N ATOM 0 H LYS A 114 16.856 -2.392 -3.898 1.00 0.40 H new ATOM 0 HA LYS A 114 18.793 -2.754 -6.103 1.00 0.47 H new ATOM 0 HB2 LYS A 114 19.196 -3.790 -3.801 1.00 0.63 H new ATOM 0 HB3 LYS A 114 17.791 -4.794 -4.101 1.00 0.63 H new ATOM 0 HG2 LYS A 114 19.895 -5.968 -4.616 1.00 0.90 H new ATOM 0 HG3 LYS A 114 18.866 -5.824 -6.027 1.00 0.90 H new ATOM 0 HD2 LYS A 114 20.186 -3.980 -6.897 1.00 1.14 H new ATOM 0 HD3 LYS A 114 21.104 -3.862 -5.410 1.00 1.14 H new ATOM 0 HE2 LYS A 114 21.097 -6.319 -7.201 1.00 1.51 H new ATOM 0 HE3 LYS A 114 22.291 -5.041 -7.307 1.00 1.51 H new ATOM 0 HZ1 LYS A 114 23.221 -6.696 -5.957 1.00 2.09 H new ATOM 0 HZ2 LYS A 114 22.741 -5.478 -4.875 1.00 2.09 H new ATOM 0 HZ3 LYS A 114 21.806 -6.886 -5.037 1.00 2.09 H new ATOM 1171 N ASP A 115 17.234 -3.871 -7.626 1.00 0.40 N ATOM 1172 CA ASP A 115 16.292 -4.380 -8.627 1.00 0.41 C ATOM 1173 C ASP A 115 15.822 -5.786 -8.284 1.00 0.38 C ATOM 1174 O ASP A 115 14.792 -6.243 -8.776 1.00 0.42 O ATOM 1175 CB ASP A 115 16.929 -4.398 -10.021 1.00 0.53 C ATOM 1176 CG ASP A 115 17.265 -3.016 -10.544 1.00 1.12 C ATOM 1177 OD1 ASP A 115 16.326 -2.238 -10.830 1.00 1.11 O ATOM 1178 OD2 ASP A 115 18.466 -2.692 -10.659 1.00 1.88 O ATOM 0 H ASP A 115 18.149 -3.628 -8.006 1.00 0.40 H new ATOM 0 HA ASP A 115 15.435 -3.707 -8.626 1.00 0.41 H new ATOM 0 HB2 ASP A 115 17.838 -4.998 -9.990 1.00 0.53 H new ATOM 0 HB3 ASP A 115 16.248 -4.887 -10.718 1.00 0.53 H new ATOM 1183 N SER A 116 16.578 -6.458 -7.431 1.00 0.38 N ATOM 1184 CA SER A 116 16.284 -7.831 -7.066 1.00 0.44 C ATOM 1185 C SER A 116 15.207 -7.892 -5.985 1.00 0.40 C ATOM 1186 O SER A 116 14.484 -8.885 -5.870 1.00 0.51 O ATOM 1187 CB SER A 116 17.563 -8.519 -6.587 1.00 0.54 C ATOM 1188 OG SER A 116 17.340 -9.890 -6.302 1.00 0.92 O ATOM 0 H SER A 116 17.405 -6.070 -6.977 1.00 0.38 H new ATOM 0 HA SER A 116 15.903 -8.352 -7.944 1.00 0.44 H new ATOM 0 HB2 SER A 116 18.335 -8.426 -7.351 1.00 0.54 H new ATOM 0 HB3 SER A 116 17.935 -8.017 -5.694 1.00 0.54 H new ATOM 0 HG SER A 116 18.176 -10.302 -6.000 1.00 0.92 H new ATOM 1194 N ASP A 117 15.086 -6.827 -5.202 1.00 0.28 N ATOM 1195 CA ASP A 117 14.128 -6.806 -4.102 1.00 0.28 C ATOM 1196 C ASP A 117 12.846 -6.123 -4.539 1.00 0.22 C ATOM 1197 O ASP A 117 11.803 -6.246 -3.897 1.00 0.24 O ATOM 1198 CB ASP A 117 14.712 -6.095 -2.876 1.00 0.34 C ATOM 1199 CG ASP A 117 15.849 -6.867 -2.234 1.00 1.08 C ATOM 1200 OD1 ASP A 117 15.880 -8.109 -2.360 1.00 1.90 O ATOM 1201 OD2 ASP A 117 16.728 -6.238 -1.603 1.00 1.04 O ATOM 0 H ASP A 117 15.634 -5.973 -5.306 1.00 0.28 H new ATOM 0 HA ASP A 117 13.907 -7.837 -3.824 1.00 0.28 H new ATOM 0 HB2 ASP A 117 15.070 -5.108 -3.170 1.00 0.34 H new ATOM 0 HB3 ASP A 117 13.922 -5.942 -2.140 1.00 0.34 H new ATOM 1206 N ILE A 118 12.937 -5.402 -5.642 1.00 0.23 N ATOM 1207 CA ILE A 118 11.794 -4.711 -6.205 1.00 0.22 C ATOM 1208 C ILE A 118 10.764 -5.696 -6.736 1.00 0.26 C ATOM 1209 O ILE A 118 11.020 -6.423 -7.696 1.00 0.34 O ATOM 1210 CB ILE A 118 12.229 -3.773 -7.343 1.00 0.26 C ATOM 1211 CG1 ILE A 118 13.153 -2.692 -6.790 1.00 0.26 C ATOM 1212 CG2 ILE A 118 11.016 -3.156 -8.026 1.00 0.31 C ATOM 1213 CD1 ILE A 118 13.904 -1.931 -7.857 1.00 0.32 C ATOM 0 H ILE A 118 13.801 -5.280 -6.170 1.00 0.23 H new ATOM 0 HA ILE A 118 11.344 -4.124 -5.405 1.00 0.22 H new ATOM 0 HB ILE A 118 12.772 -4.350 -8.092 1.00 0.26 H new ATOM 0 HG12 ILE A 118 12.564 -1.989 -6.202 1.00 0.26 H new ATOM 0 HG13 ILE A 118 13.871 -3.152 -6.111 1.00 0.26 H new ATOM 0 HG21 ILE A 118 11.347 -2.496 -8.828 1.00 0.31 H new ATOM 0 HG22 ILE A 118 10.391 -3.947 -8.441 1.00 0.31 H new ATOM 0 HG23 ILE A 118 10.441 -2.583 -7.298 1.00 0.31 H new ATOM 0 HD11 ILE A 118 14.540 -1.180 -7.389 1.00 0.32 H new ATOM 0 HD12 ILE A 118 14.521 -2.622 -8.431 1.00 0.32 H new ATOM 0 HD13 ILE A 118 13.193 -1.441 -8.523 1.00 0.32 H new ATOM 1225 N VAL A 119 9.613 -5.731 -6.089 1.00 0.24 N ATOM 1226 CA VAL A 119 8.494 -6.507 -6.576 1.00 0.31 C ATOM 1227 C VAL A 119 7.649 -5.635 -7.493 1.00 0.27 C ATOM 1228 O VAL A 119 7.156 -6.084 -8.530 1.00 0.31 O ATOM 1229 CB VAL A 119 7.615 -7.034 -5.423 1.00 0.36 C ATOM 1230 CG1 VAL A 119 6.497 -7.903 -5.969 1.00 0.47 C ATOM 1231 CG2 VAL A 119 8.452 -7.797 -4.404 1.00 0.38 C ATOM 0 H VAL A 119 9.431 -5.227 -5.221 1.00 0.24 H new ATOM 0 HA VAL A 119 8.888 -7.368 -7.116 1.00 0.31 H new ATOM 0 HB VAL A 119 7.169 -6.181 -4.912 1.00 0.36 H new ATOM 0 HG11 VAL A 119 5.884 -8.268 -5.145 1.00 0.47 H new ATOM 0 HG12 VAL A 119 5.879 -7.316 -6.648 1.00 0.47 H new ATOM 0 HG13 VAL A 119 6.924 -8.750 -6.507 1.00 0.47 H new ATOM 0 HG21 VAL A 119 7.808 -8.158 -3.602 1.00 0.38 H new ATOM 0 HG22 VAL A 119 8.935 -8.644 -4.891 1.00 0.38 H new ATOM 0 HG23 VAL A 119 9.213 -7.135 -3.989 1.00 0.38 H new ATOM 1241 N ASN A 120 7.503 -4.378 -7.103 1.00 0.25 N ATOM 1242 CA ASN A 120 6.725 -3.415 -7.872 1.00 0.24 C ATOM 1243 C ASN A 120 7.246 -2.000 -7.634 1.00 0.23 C ATOM 1244 O ASN A 120 7.953 -1.739 -6.660 1.00 0.26 O ATOM 1245 CB ASN A 120 5.249 -3.512 -7.482 1.00 0.31 C ATOM 1246 CG ASN A 120 4.336 -2.636 -8.316 1.00 0.54 C ATOM 1247 OD1 ASN A 120 3.852 -3.046 -9.370 1.00 1.17 O ATOM 1248 ND2 ASN A 120 4.077 -1.434 -7.837 1.00 0.36 N ATOM 0 H ASN A 120 7.916 -3.997 -6.252 1.00 0.25 H new ATOM 0 HA ASN A 120 6.826 -3.644 -8.933 1.00 0.24 H new ATOM 0 HB2 ASN A 120 4.926 -4.549 -7.575 1.00 0.31 H new ATOM 0 HB3 ASN A 120 5.141 -3.237 -6.433 1.00 0.31 H new ATOM 0 HD21 ASN A 120 3.454 -0.806 -8.345 1.00 0.36 H new ATOM 0 HD22 ASN A 120 4.499 -1.133 -6.959 1.00 0.36 H new ATOM 1255 N GLU A 121 6.884 -1.101 -8.523 1.00 0.24 N ATOM 1256 CA GLU A 121 7.278 0.297 -8.428 1.00 0.25 C ATOM 1257 C GLU A 121 6.051 1.191 -8.384 1.00 0.25 C ATOM 1258 O GLU A 121 5.120 1.036 -9.176 1.00 0.32 O ATOM 1259 CB GLU A 121 8.168 0.687 -9.612 1.00 0.31 C ATOM 1260 CG GLU A 121 8.313 2.191 -9.821 1.00 0.35 C ATOM 1261 CD GLU A 121 8.959 2.541 -11.146 1.00 0.71 C ATOM 1262 OE1 GLU A 121 9.584 1.650 -11.770 1.00 1.17 O ATOM 1263 OE2 GLU A 121 8.849 3.708 -11.569 1.00 1.24 O ATOM 0 H GLU A 121 6.307 -1.315 -9.336 1.00 0.24 H new ATOM 0 HA GLU A 121 7.845 0.430 -7.506 1.00 0.25 H new ATOM 0 HB2 GLU A 121 9.158 0.256 -9.465 1.00 0.31 H new ATOM 0 HB3 GLU A 121 7.759 0.244 -10.520 1.00 0.31 H new ATOM 0 HG2 GLU A 121 7.329 2.657 -9.768 1.00 0.35 H new ATOM 0 HG3 GLU A 121 8.909 2.610 -9.010 1.00 0.35 H new ATOM 1270 N ILE A 122 6.056 2.121 -7.450 1.00 0.21 N ATOM 1271 CA ILE A 122 4.969 3.064 -7.304 1.00 0.23 C ATOM 1272 C ILE A 122 5.497 4.477 -7.498 1.00 0.26 C ATOM 1273 O ILE A 122 6.662 4.666 -7.848 1.00 0.25 O ATOM 1274 CB ILE A 122 4.258 2.920 -5.945 1.00 0.26 C ATOM 1275 CG1 ILE A 122 5.246 3.095 -4.792 1.00 0.27 C ATOM 1276 CG2 ILE A 122 3.572 1.565 -5.861 1.00 0.27 C ATOM 1277 CD1 ILE A 122 4.653 2.785 -3.438 1.00 0.31 C ATOM 0 H ILE A 122 6.811 2.243 -6.775 1.00 0.21 H new ATOM 0 HA ILE A 122 4.223 2.849 -8.069 1.00 0.23 H new ATOM 0 HB ILE A 122 3.505 3.703 -5.862 1.00 0.26 H new ATOM 0 HG12 ILE A 122 6.106 2.447 -4.960 1.00 0.27 H new ATOM 0 HG13 ILE A 122 5.614 4.121 -4.792 1.00 0.27 H new ATOM 0 HG21 ILE A 122 3.071 1.470 -4.898 1.00 0.27 H new ATOM 0 HG22 ILE A 122 2.838 1.479 -6.662 1.00 0.27 H new ATOM 0 HG23 ILE A 122 4.315 0.774 -5.963 1.00 0.27 H new ATOM 0 HD11 ILE A 122 5.410 2.930 -2.667 1.00 0.31 H new ATOM 0 HD12 ILE A 122 3.810 3.450 -3.249 1.00 0.31 H new ATOM 0 HD13 ILE A 122 4.310 1.751 -3.419 1.00 0.31 H new ATOM 1289 N LYS A 123 4.643 5.461 -7.323 1.00 0.30 N ATOM 1290 CA LYS A 123 5.023 6.836 -7.589 1.00 0.34 C ATOM 1291 C LYS A 123 5.953 7.361 -6.511 1.00 0.36 C ATOM 1292 O LYS A 123 5.576 7.475 -5.350 1.00 0.42 O ATOM 1293 CB LYS A 123 3.782 7.708 -7.699 1.00 0.39 C ATOM 1294 CG LYS A 123 3.998 8.948 -8.536 1.00 0.48 C ATOM 1295 CD LYS A 123 2.693 9.678 -8.790 1.00 0.75 C ATOM 1296 CE LYS A 123 1.748 8.857 -9.655 1.00 1.35 C ATOM 1297 NZ LYS A 123 0.477 9.578 -9.928 1.00 2.15 N ATOM 0 H LYS A 123 3.684 5.339 -6.999 1.00 0.30 H new ATOM 0 HA LYS A 123 5.560 6.868 -8.537 1.00 0.34 H new ATOM 0 HB2 LYS A 123 2.971 7.122 -8.132 1.00 0.39 H new ATOM 0 HB3 LYS A 123 3.463 8.003 -6.699 1.00 0.39 H new ATOM 0 HG2 LYS A 123 4.697 9.614 -8.029 1.00 0.48 H new ATOM 0 HG3 LYS A 123 4.454 8.672 -9.487 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.212 9.904 -7.839 1.00 0.75 H new ATOM 0 HD3 LYS A 123 2.898 10.631 -9.278 1.00 0.75 H new ATOM 0 HE2 LYS A 123 2.238 8.615 -10.598 1.00 1.35 H new ATOM 0 HE3 LYS A 123 1.529 7.912 -9.158 1.00 1.35 H new ATOM 0 HZ1 LYS A 123 -0.139 8.985 -10.520 1.00 2.15 H new ATOM 0 HZ2 LYS A 123 -0.004 9.787 -9.030 1.00 2.15 H new ATOM 0 HZ3 LYS A 123 0.683 10.468 -10.426 1.00 2.15 H new ATOM 1311 N GLY A 124 7.179 7.650 -6.914 1.00 0.37 N ATOM 1312 CA GLY A 124 8.179 8.160 -6.001 1.00 0.42 C ATOM 1313 C GLY A 124 8.857 7.067 -5.196 1.00 0.38 C ATOM 1314 O GLY A 124 10.041 7.167 -4.866 1.00 0.42 O ATOM 0 H GLY A 124 7.504 7.538 -7.874 1.00 0.37 H new ATOM 0 HA2 GLY A 124 8.933 8.709 -6.566 1.00 0.42 H new ATOM 0 HA3 GLY A 124 7.712 8.870 -5.319 1.00 0.42 H new ATOM 1318 N GLY A 125 8.101 6.035 -4.862 1.00 0.34 N ATOM 1319 CA GLY A 125 8.626 4.949 -4.067 1.00 0.31 C ATOM 1320 C GLY A 125 8.632 3.625 -4.799 1.00 0.25 C ATOM 1321 O GLY A 125 8.075 3.493 -5.884 1.00 0.29 O ATOM 0 H GLY A 125 7.123 5.930 -5.131 1.00 0.34 H new ATOM 0 HA2 GLY A 125 9.643 5.191 -3.759 1.00 0.31 H new ATOM 0 HA3 GLY A 125 8.032 4.852 -3.158 1.00 0.31 H new ATOM 1325 N TYR A 126 9.275 2.645 -4.203 1.00 0.19 N ATOM 1326 CA TYR A 126 9.239 1.285 -4.700 1.00 0.16 C ATOM 1327 C TYR A 126 8.730 0.369 -3.611 1.00 0.16 C ATOM 1328 O TYR A 126 9.316 0.308 -2.534 1.00 0.17 O ATOM 1329 CB TYR A 126 10.632 0.825 -5.133 1.00 0.15 C ATOM 1330 CG TYR A 126 10.985 1.176 -6.558 1.00 0.18 C ATOM 1331 CD1 TYR A 126 11.108 2.492 -6.953 1.00 0.24 C ATOM 1332 CD2 TYR A 126 11.180 0.187 -7.508 1.00 0.21 C ATOM 1333 CE1 TYR A 126 11.418 2.820 -8.253 1.00 0.29 C ATOM 1334 CE2 TYR A 126 11.499 0.505 -8.814 1.00 0.27 C ATOM 1335 CZ TYR A 126 11.618 1.826 -9.179 1.00 0.30 C ATOM 1336 OH TYR A 126 11.932 2.157 -10.476 1.00 0.38 O ATOM 0 H TYR A 126 9.837 2.767 -3.361 1.00 0.19 H new ATOM 0 HA TYR A 126 8.576 1.249 -5.564 1.00 0.16 H new ATOM 0 HB2 TYR A 126 11.372 1.269 -4.467 1.00 0.15 H new ATOM 0 HB3 TYR A 126 10.700 -0.256 -5.009 1.00 0.15 H new ATOM 0 HD1 TYR A 126 10.958 3.279 -6.229 1.00 0.24 H new ATOM 0 HD2 TYR A 126 11.081 -0.850 -7.223 1.00 0.21 H new ATOM 0 HE1 TYR A 126 11.504 3.856 -8.544 1.00 0.29 H new ATOM 0 HE2 TYR A 126 11.654 -0.277 -9.543 1.00 0.27 H new ATOM 0 HH TYR A 126 11.452 1.563 -11.090 1.00 0.38 H new ATOM 1346 N VAL A 127 7.645 -0.330 -3.871 1.00 0.18 N ATOM 1347 CA VAL A 127 7.183 -1.321 -2.926 1.00 0.20 C ATOM 1348 C VAL A 127 8.038 -2.571 -3.101 1.00 0.17 C ATOM 1349 O VAL A 127 7.980 -3.263 -4.122 1.00 0.20 O ATOM 1350 CB VAL A 127 5.667 -1.610 -3.070 1.00 0.29 C ATOM 1351 CG1 VAL A 127 5.291 -1.959 -4.500 1.00 0.55 C ATOM 1352 CG2 VAL A 127 5.234 -2.705 -2.112 1.00 0.60 C ATOM 0 H VAL A 127 7.077 -0.233 -4.712 1.00 0.18 H new ATOM 0 HA VAL A 127 7.298 -0.943 -1.910 1.00 0.20 H new ATOM 0 HB VAL A 127 5.134 -0.695 -2.810 1.00 0.29 H new ATOM 0 HG11 VAL A 127 4.220 -2.154 -4.557 1.00 0.55 H new ATOM 0 HG12 VAL A 127 5.544 -1.126 -5.156 1.00 0.55 H new ATOM 0 HG13 VAL A 127 5.839 -2.847 -4.814 1.00 0.55 H new ATOM 0 HG21 VAL A 127 4.167 -2.891 -2.231 1.00 0.60 H new ATOM 0 HG22 VAL A 127 5.788 -3.618 -2.329 1.00 0.60 H new ATOM 0 HG23 VAL A 127 5.436 -2.393 -1.087 1.00 0.60 H new ATOM 1362 N ILE A 128 8.856 -2.832 -2.102 1.00 0.14 N ATOM 1363 CA ILE A 128 9.963 -3.753 -2.246 1.00 0.12 C ATOM 1364 C ILE A 128 9.956 -4.824 -1.179 1.00 0.13 C ATOM 1365 O ILE A 128 9.563 -4.582 -0.039 1.00 0.16 O ATOM 1366 CB ILE A 128 11.309 -2.998 -2.187 1.00 0.13 C ATOM 1367 CG1 ILE A 128 11.381 -2.125 -0.921 1.00 0.16 C ATOM 1368 CG2 ILE A 128 11.493 -2.154 -3.438 1.00 0.16 C ATOM 1369 CD1 ILE A 128 12.645 -1.303 -0.815 1.00 0.19 C ATOM 0 H ILE A 128 8.773 -2.415 -1.175 1.00 0.14 H new ATOM 0 HA ILE A 128 9.846 -4.233 -3.217 1.00 0.12 H new ATOM 0 HB ILE A 128 12.119 -3.727 -2.142 1.00 0.13 H new ATOM 0 HG12 ILE A 128 10.521 -1.455 -0.904 1.00 0.16 H new ATOM 0 HG13 ILE A 128 11.302 -2.767 -0.044 1.00 0.16 H new ATOM 0 HG21 ILE A 128 12.445 -1.627 -3.384 1.00 0.16 H new ATOM 0 HG22 ILE A 128 11.484 -2.799 -4.317 1.00 0.16 H new ATOM 0 HG23 ILE A 128 10.681 -1.430 -3.511 1.00 0.16 H new ATOM 0 HD11 ILE A 128 12.621 -0.715 0.103 1.00 0.19 H new ATOM 0 HD12 ILE A 128 13.510 -1.966 -0.799 1.00 0.19 H new ATOM 0 HD13 ILE A 128 12.717 -0.634 -1.672 1.00 0.19 H new ATOM 1381 N LYS A 129 10.397 -6.004 -1.557 1.00 0.15 N ATOM 1382 CA LYS A 129 10.561 -7.090 -0.616 1.00 0.18 C ATOM 1383 C LYS A 129 12.044 -7.314 -0.385 1.00 0.19 C ATOM 1384 O LYS A 129 12.735 -7.877 -1.231 1.00 0.20 O ATOM 1385 CB LYS A 129 9.904 -8.365 -1.149 1.00 0.22 C ATOM 1386 CG LYS A 129 9.998 -9.550 -0.201 1.00 0.28 C ATOM 1387 CD LYS A 129 9.303 -10.773 -0.774 1.00 0.40 C ATOM 1388 CE LYS A 129 9.363 -11.948 0.189 1.00 0.51 C ATOM 1389 NZ LYS A 129 8.650 -13.142 -0.344 1.00 0.76 N ATOM 0 H LYS A 129 10.650 -6.237 -2.517 1.00 0.15 H new ATOM 0 HA LYS A 129 10.077 -6.834 0.327 1.00 0.18 H new ATOM 0 HB2 LYS A 129 8.854 -8.161 -1.357 1.00 0.22 H new ATOM 0 HB3 LYS A 129 10.370 -8.633 -2.097 1.00 0.22 H new ATOM 0 HG2 LYS A 129 11.045 -9.782 -0.008 1.00 0.28 H new ATOM 0 HG3 LYS A 129 9.548 -9.289 0.757 1.00 0.28 H new ATOM 0 HD2 LYS A 129 8.263 -10.533 -0.993 1.00 0.40 H new ATOM 0 HD3 LYS A 129 9.771 -11.050 -1.718 1.00 0.40 H new ATOM 0 HE2 LYS A 129 10.404 -12.204 0.384 1.00 0.51 H new ATOM 0 HE3 LYS A 129 8.922 -11.658 1.143 1.00 0.51 H new ATOM 0 HZ1 LYS A 129 8.567 -13.860 0.404 1.00 0.76 H new ATOM 0 HZ2 LYS A 129 7.700 -12.865 -0.664 1.00 0.76 H new ATOM 0 HZ3 LYS A 129 9.184 -13.537 -1.144 1.00 0.76 H new ATOM 1403 N VAL A 130 12.532 -6.862 0.755 1.00 0.21 N ATOM 1404 CA VAL A 130 13.934 -6.985 1.080 1.00 0.24 C ATOM 1405 C VAL A 130 14.091 -7.758 2.381 1.00 0.29 C ATOM 1406 O VAL A 130 13.389 -7.492 3.365 1.00 0.29 O ATOM 1407 CB VAL A 130 14.638 -5.595 1.164 1.00 0.24 C ATOM 1408 CG1 VAL A 130 13.784 -4.512 0.530 1.00 0.26 C ATOM 1409 CG2 VAL A 130 14.990 -5.194 2.589 1.00 0.26 C ATOM 0 H VAL A 130 11.971 -6.404 1.473 1.00 0.21 H new ATOM 0 HA VAL A 130 14.423 -7.535 0.276 1.00 0.24 H new ATOM 0 HB VAL A 130 15.571 -5.698 0.610 1.00 0.24 H new ATOM 0 HG11 VAL A 130 14.299 -3.554 0.603 1.00 0.26 H new ATOM 0 HG12 VAL A 130 13.611 -4.753 -0.519 1.00 0.26 H new ATOM 0 HG13 VAL A 130 12.828 -4.451 1.051 1.00 0.26 H new ATOM 0 HG21 VAL A 130 15.477 -4.219 2.583 1.00 0.26 H new ATOM 0 HG22 VAL A 130 14.080 -5.142 3.187 1.00 0.26 H new ATOM 0 HG23 VAL A 130 15.665 -5.934 3.019 1.00 0.26 H new ATOM 1419 N ASP A 131 14.966 -8.756 2.356 1.00 0.36 N ATOM 1420 CA ASP A 131 15.294 -9.534 3.547 1.00 0.44 C ATOM 1421 C ASP A 131 14.040 -10.206 4.119 1.00 0.43 C ATOM 1422 O ASP A 131 13.873 -10.344 5.330 1.00 0.50 O ATOM 1423 CB ASP A 131 15.967 -8.623 4.579 1.00 0.48 C ATOM 1424 CG ASP A 131 16.544 -9.373 5.765 1.00 0.59 C ATOM 1425 OD1 ASP A 131 17.418 -10.240 5.560 1.00 0.74 O ATOM 1426 OD2 ASP A 131 16.145 -9.078 6.912 1.00 0.59 O ATOM 0 H ASP A 131 15.466 -9.048 1.516 1.00 0.36 H new ATOM 0 HA ASP A 131 15.990 -10.329 3.281 1.00 0.44 H new ATOM 0 HB2 ASP A 131 16.764 -8.062 4.091 1.00 0.48 H new ATOM 0 HB3 ASP A 131 15.239 -7.895 4.939 1.00 0.48 H new ATOM 1431 N GLY A 132 13.145 -10.597 3.221 1.00 0.39 N ATOM 1432 CA GLY A 132 11.931 -11.290 3.614 1.00 0.40 C ATOM 1433 C GLY A 132 10.803 -10.339 3.968 1.00 0.40 C ATOM 1434 O GLY A 132 9.638 -10.735 4.023 1.00 0.59 O ATOM 0 H GLY A 132 13.239 -10.445 2.217 1.00 0.39 H new ATOM 0 HA2 GLY A 132 11.610 -11.942 2.801 1.00 0.40 H new ATOM 0 HA3 GLY A 132 12.144 -11.930 4.470 1.00 0.40 H new ATOM 1438 N LYS A 133 11.145 -9.082 4.187 1.00 0.30 N ATOM 1439 CA LYS A 133 10.177 -8.085 4.613 1.00 0.29 C ATOM 1440 C LYS A 133 9.824 -7.155 3.476 1.00 0.26 C ATOM 1441 O LYS A 133 10.470 -7.155 2.435 1.00 0.33 O ATOM 1442 CB LYS A 133 10.732 -7.281 5.787 1.00 0.33 C ATOM 1443 CG LYS A 133 10.769 -8.058 7.087 1.00 0.40 C ATOM 1444 CD LYS A 133 11.662 -7.387 8.116 1.00 0.80 C ATOM 1445 CE LYS A 133 13.125 -7.443 7.705 1.00 0.62 C ATOM 1446 NZ LYS A 133 13.650 -8.835 7.706 1.00 1.15 N ATOM 0 H LYS A 133 12.094 -8.725 4.076 1.00 0.30 H new ATOM 0 HA LYS A 133 9.272 -8.604 4.928 1.00 0.29 H new ATOM 0 HB2 LYS A 133 11.741 -6.947 5.544 1.00 0.33 H new ATOM 0 HB3 LYS A 133 10.124 -6.387 5.924 1.00 0.33 H new ATOM 0 HG2 LYS A 133 9.759 -8.149 7.486 1.00 0.40 H new ATOM 0 HG3 LYS A 133 11.129 -9.069 6.897 1.00 0.40 H new ATOM 0 HD2 LYS A 133 11.358 -6.348 8.241 1.00 0.80 H new ATOM 0 HD3 LYS A 133 11.536 -7.875 9.083 1.00 0.80 H new ATOM 0 HE2 LYS A 133 13.239 -7.013 6.710 1.00 0.62 H new ATOM 0 HE3 LYS A 133 13.717 -6.832 8.386 1.00 0.62 H new ATOM 0 HZ1 LYS A 133 14.686 -8.815 7.792 1.00 1.15 H new ATOM 0 HZ2 LYS A 133 13.246 -9.358 8.509 1.00 1.15 H new ATOM 0 HZ3 LYS A 133 13.386 -9.306 6.817 1.00 1.15 H new ATOM 1460 N TYR A 134 8.799 -6.362 3.685 1.00 0.25 N ATOM 1461 CA TYR A 134 8.331 -5.447 2.665 1.00 0.23 C ATOM 1462 C TYR A 134 8.494 -4.007 3.103 1.00 0.22 C ATOM 1463 O TYR A 134 8.264 -3.663 4.265 1.00 0.26 O ATOM 1464 CB TYR A 134 6.876 -5.718 2.344 1.00 0.28 C ATOM 1465 CG TYR A 134 6.650 -6.197 0.939 1.00 0.46 C ATOM 1466 CD1 TYR A 134 6.542 -5.303 -0.115 1.00 0.64 C ATOM 1467 CD2 TYR A 134 6.520 -7.542 0.675 1.00 0.63 C ATOM 1468 CE1 TYR A 134 6.307 -5.747 -1.399 1.00 0.88 C ATOM 1469 CE2 TYR A 134 6.276 -7.995 -0.609 1.00 0.86 C ATOM 1470 CZ TYR A 134 6.170 -7.092 -1.637 1.00 0.91 C ATOM 1471 OH TYR A 134 5.902 -7.538 -2.902 1.00 1.22 O ATOM 0 H TYR A 134 8.270 -6.331 4.556 1.00 0.25 H new ATOM 0 HA TYR A 134 8.936 -5.607 1.773 1.00 0.23 H new ATOM 0 HB2 TYR A 134 6.492 -6.464 3.040 1.00 0.28 H new ATOM 0 HB3 TYR A 134 6.301 -4.806 2.505 1.00 0.28 H new ATOM 0 HD1 TYR A 134 6.643 -4.244 0.072 1.00 0.64 H new ATOM 0 HD2 TYR A 134 6.610 -8.254 1.482 1.00 0.63 H new ATOM 0 HE1 TYR A 134 6.231 -5.041 -2.213 1.00 0.88 H new ATOM 0 HE2 TYR A 134 6.170 -9.052 -0.801 1.00 0.86 H new ATOM 0 HH TYR A 134 5.837 -8.516 -2.897 1.00 1.22 H new ATOM 1481 N TYR A 135 8.888 -3.177 2.162 1.00 0.19 N ATOM 1482 CA TYR A 135 9.087 -1.765 2.407 1.00 0.20 C ATOM 1483 C TYR A 135 8.597 -0.966 1.228 1.00 0.19 C ATOM 1484 O TYR A 135 8.219 -1.520 0.198 1.00 0.21 O ATOM 1485 CB TYR A 135 10.570 -1.447 2.605 1.00 0.19 C ATOM 1486 CG TYR A 135 11.224 -2.146 3.752 1.00 0.21 C ATOM 1487 CD1 TYR A 135 11.750 -3.411 3.596 1.00 0.22 C ATOM 1488 CD2 TYR A 135 11.344 -1.525 4.979 1.00 0.28 C ATOM 1489 CE1 TYR A 135 12.374 -4.049 4.625 1.00 0.26 C ATOM 1490 CE2 TYR A 135 11.968 -2.156 6.030 1.00 0.32 C ATOM 1491 CZ TYR A 135 12.486 -3.423 5.852 1.00 0.31 C ATOM 1492 OH TYR A 135 13.120 -4.056 6.896 1.00 0.37 O ATOM 0 H TYR A 135 9.080 -3.463 1.202 1.00 0.19 H new ATOM 0 HA TYR A 135 8.532 -1.505 3.308 1.00 0.20 H new ATOM 0 HB2 TYR A 135 11.105 -1.704 1.691 1.00 0.19 H new ATOM 0 HB3 TYR A 135 10.679 -0.372 2.746 1.00 0.19 H new ATOM 0 HD1 TYR A 135 11.666 -3.905 2.640 1.00 0.22 H new ATOM 0 HD2 TYR A 135 10.943 -0.532 5.115 1.00 0.28 H new ATOM 0 HE1 TYR A 135 12.780 -5.040 4.483 1.00 0.26 H new ATOM 0 HE2 TYR A 135 12.052 -1.664 6.988 1.00 0.32 H new ATOM 0 HH TYR A 135 13.111 -3.475 7.685 1.00 0.37 H new ATOM 1502 N VAL A 136 8.601 0.334 1.398 1.00 0.21 N ATOM 1503 CA VAL A 136 8.373 1.243 0.307 1.00 0.22 C ATOM 1504 C VAL A 136 9.526 2.223 0.232 1.00 0.23 C ATOM 1505 O VAL A 136 9.691 3.095 1.090 1.00 0.31 O ATOM 1506 CB VAL A 136 7.024 1.969 0.446 1.00 0.25 C ATOM 1507 CG1 VAL A 136 6.878 3.056 -0.611 1.00 0.26 C ATOM 1508 CG2 VAL A 136 5.898 0.953 0.330 1.00 0.26 C ATOM 0 H VAL A 136 8.762 0.789 2.297 1.00 0.21 H new ATOM 0 HA VAL A 136 8.323 0.677 -0.623 1.00 0.22 H new ATOM 0 HB VAL A 136 6.978 2.452 1.422 1.00 0.25 H new ATOM 0 HG11 VAL A 136 5.916 3.554 -0.491 1.00 0.26 H new ATOM 0 HG12 VAL A 136 7.680 3.785 -0.497 1.00 0.26 H new ATOM 0 HG13 VAL A 136 6.933 2.608 -1.603 1.00 0.26 H new ATOM 0 HG21 VAL A 136 4.938 1.461 0.428 1.00 0.26 H new ATOM 0 HG22 VAL A 136 5.951 0.461 -0.641 1.00 0.26 H new ATOM 0 HG23 VAL A 136 5.997 0.209 1.120 1.00 0.26 H new ATOM 1518 N TYR A 137 10.340 2.036 -0.786 1.00 0.20 N ATOM 1519 CA TYR A 137 11.533 2.829 -0.984 1.00 0.24 C ATOM 1520 C TYR A 137 11.186 4.153 -1.579 1.00 0.27 C ATOM 1521 O TYR A 137 10.936 4.264 -2.769 1.00 0.46 O ATOM 1522 CB TYR A 137 12.508 2.106 -1.910 1.00 0.35 C ATOM 1523 CG TYR A 137 13.596 3.015 -2.410 1.00 0.50 C ATOM 1524 CD1 TYR A 137 14.513 3.512 -1.530 1.00 0.59 C ATOM 1525 CD2 TYR A 137 13.690 3.387 -3.743 1.00 0.63 C ATOM 1526 CE1 TYR A 137 15.512 4.360 -1.937 1.00 0.76 C ATOM 1527 CE2 TYR A 137 14.690 4.237 -4.169 1.00 0.78 C ATOM 1528 CZ TYR A 137 15.601 4.722 -3.260 1.00 0.77 C ATOM 1529 OH TYR A 137 16.606 5.564 -3.675 1.00 1.01 O ATOM 0 H TYR A 137 10.191 1.326 -1.503 1.00 0.20 H new ATOM 0 HA TYR A 137 12.002 2.980 -0.012 1.00 0.24 H new ATOM 0 HB2 TYR A 137 12.955 1.265 -1.379 1.00 0.35 H new ATOM 0 HB3 TYR A 137 11.962 1.694 -2.759 1.00 0.35 H new ATOM 0 HD1 TYR A 137 14.451 3.231 -0.489 1.00 0.59 H new ATOM 0 HD2 TYR A 137 12.973 3.007 -4.455 1.00 0.63 H new ATOM 0 HE1 TYR A 137 16.225 4.741 -1.221 1.00 0.76 H new ATOM 0 HE2 TYR A 137 14.757 4.520 -5.209 1.00 0.78 H new ATOM 0 HH TYR A 137 16.526 5.718 -4.639 1.00 1.01 H new ATOM 1539 N LEU A 138 11.199 5.158 -0.754 1.00 0.29 N ATOM 1540 CA LEU A 138 10.838 6.459 -1.207 1.00 0.38 C ATOM 1541 C LEU A 138 12.070 7.252 -1.569 1.00 0.44 C ATOM 1542 O LEU A 138 12.962 7.455 -0.745 1.00 0.50 O ATOM 1543 CB LEU A 138 10.029 7.169 -0.147 1.00 0.48 C ATOM 1544 CG LEU A 138 9.103 8.244 -0.698 1.00 0.64 C ATOM 1545 CD1 LEU A 138 8.154 7.649 -1.725 1.00 0.72 C ATOM 1546 CD2 LEU A 138 8.326 8.905 0.418 1.00 0.72 C ATOM 0 H LEU A 138 11.455 5.098 0.231 1.00 0.29 H new ATOM 0 HA LEU A 138 10.224 6.365 -2.103 1.00 0.38 H new ATOM 0 HB2 LEU A 138 9.435 6.434 0.396 1.00 0.48 H new ATOM 0 HB3 LEU A 138 10.710 7.623 0.573 1.00 0.48 H new ATOM 0 HG LEU A 138 9.713 9.004 -1.186 1.00 0.64 H new ATOM 0 HD11 LEU A 138 7.498 8.430 -2.110 1.00 0.72 H new ATOM 0 HD12 LEU A 138 8.729 7.220 -2.546 1.00 0.72 H new ATOM 0 HD13 LEU A 138 7.553 6.869 -1.257 1.00 0.72 H new ATOM 0 HD21 LEU A 138 7.671 9.670 0.002 1.00 0.72 H new ATOM 0 HD22 LEU A 138 7.727 8.157 0.937 1.00 0.72 H new ATOM 0 HD23 LEU A 138 9.020 9.365 1.121 1.00 0.72 H new ATOM 1558 N LYS A 139 12.115 7.685 -2.811 1.00 0.46 N ATOM 1559 CA LYS A 139 13.235 8.457 -3.305 1.00 0.54 C ATOM 1560 C LYS A 139 13.173 9.889 -2.779 1.00 0.64 C ATOM 1561 O LYS A 139 14.147 10.637 -2.866 1.00 0.74 O ATOM 1562 CB LYS A 139 13.260 8.437 -4.829 1.00 0.56 C ATOM 1563 CG LYS A 139 13.456 7.045 -5.407 1.00 0.50 C ATOM 1564 CD LYS A 139 13.633 7.084 -6.917 1.00 0.59 C ATOM 1565 CE LYS A 139 13.831 5.692 -7.495 1.00 1.51 C ATOM 1566 NZ LYS A 139 14.076 5.727 -8.963 1.00 2.31 N ATOM 0 H LYS A 139 11.384 7.514 -3.501 1.00 0.46 H new ATOM 0 HA LYS A 139 14.158 8.005 -2.942 1.00 0.54 H new ATOM 0 HB2 LYS A 139 12.325 8.852 -5.207 1.00 0.56 H new ATOM 0 HB3 LYS A 139 14.062 9.086 -5.181 1.00 0.56 H new ATOM 0 HG2 LYS A 139 14.330 6.581 -4.950 1.00 0.50 H new ATOM 0 HG3 LYS A 139 12.597 6.423 -5.157 1.00 0.50 H new ATOM 0 HD2 LYS A 139 12.759 7.547 -7.374 1.00 0.59 H new ATOM 0 HD3 LYS A 139 14.491 7.708 -7.167 1.00 0.59 H new ATOM 0 HE2 LYS A 139 14.673 5.210 -6.998 1.00 1.51 H new ATOM 0 HE3 LYS A 139 12.949 5.085 -7.289 1.00 1.51 H new ATOM 0 HZ1 LYS A 139 14.206 4.758 -9.317 1.00 2.31 H new ATOM 0 HZ2 LYS A 139 13.262 6.164 -9.441 1.00 2.31 H new ATOM 0 HZ3 LYS A 139 14.932 6.284 -9.159 1.00 2.31 H new ATOM 1580 N ASP A 140 12.021 10.262 -2.228 1.00 0.66 N ATOM 1581 CA ASP A 140 11.866 11.560 -1.589 1.00 0.78 C ATOM 1582 C ASP A 140 10.881 11.461 -0.433 1.00 0.77 C ATOM 1583 O ASP A 140 9.681 11.680 -0.600 1.00 0.88 O ATOM 1584 CB ASP A 140 11.393 12.615 -2.585 1.00 1.00 C ATOM 1585 CG ASP A 140 11.448 14.007 -1.991 1.00 1.24 C ATOM 1586 OD1 ASP A 140 12.558 14.560 -1.850 1.00 1.57 O ATOM 1587 OD2 ASP A 140 10.371 14.559 -1.678 1.00 1.58 O ATOM 0 H ASP A 140 11.182 9.682 -2.213 1.00 0.66 H new ATOM 0 HA ASP A 140 12.841 11.865 -1.208 1.00 0.78 H new ATOM 0 HB2 ASP A 140 12.014 12.576 -3.480 1.00 1.00 H new ATOM 0 HB3 ASP A 140 10.372 12.391 -2.896 1.00 1.00 H new ATOM 1592 N ALA A 141 11.393 11.115 0.737 1.00 0.73 N ATOM 1593 CA ALA A 141 10.561 10.931 1.919 1.00 0.79 C ATOM 1594 C ALA A 141 10.192 12.265 2.553 1.00 0.97 C ATOM 1595 O ALA A 141 9.337 12.328 3.440 1.00 1.12 O ATOM 1596 CB ALA A 141 11.275 10.048 2.931 1.00 0.86 C ATOM 0 H ALA A 141 12.388 10.955 0.896 1.00 0.73 H new ATOM 0 HA ALA A 141 9.638 10.443 1.606 1.00 0.79 H new ATOM 0 HB1 ALA A 141 10.643 9.918 3.810 1.00 0.86 H new ATOM 0 HB2 ALA A 141 11.480 9.075 2.484 1.00 0.86 H new ATOM 0 HB3 ALA A 141 12.214 10.517 3.225 1.00 0.86 H new ATOM 1602 N ALA A 142 10.825 13.329 2.083 1.00 1.02 N ATOM 1603 CA ALA A 142 10.665 14.640 2.692 1.00 1.26 C ATOM 1604 C ALA A 142 9.311 15.260 2.373 1.00 1.37 C ATOM 1605 O ALA A 142 8.622 15.751 3.267 1.00 1.60 O ATOM 1606 CB ALA A 142 11.774 15.572 2.232 1.00 1.38 C ATOM 0 H ALA A 142 11.455 13.310 1.281 1.00 1.02 H new ATOM 0 HA ALA A 142 10.722 14.502 3.772 1.00 1.26 H new ATOM 0 HB1 ALA A 142 11.643 16.550 2.695 1.00 1.38 H new ATOM 0 HB2 ALA A 142 12.740 15.159 2.523 1.00 1.38 H new ATOM 0 HB3 ALA A 142 11.736 15.676 1.148 1.00 1.38 H new ATOM 1612 N HIS A 143 8.917 15.215 1.109 1.00 1.30 N ATOM 1613 CA HIS A 143 7.741 15.954 0.672 1.00 1.50 C ATOM 1614 C HIS A 143 6.548 15.041 0.432 1.00 1.25 C ATOM 1615 O HIS A 143 5.515 15.486 -0.070 1.00 1.33 O ATOM 1616 CB HIS A 143 8.055 16.737 -0.597 1.00 1.74 C ATOM 1617 CG HIS A 143 7.510 18.124 -0.580 1.00 2.20 C ATOM 1618 ND1 HIS A 143 6.334 18.482 -1.196 1.00 2.83 N ATOM 1619 CD2 HIS A 143 7.993 19.247 -0.010 1.00 2.47 C ATOM 1620 CE1 HIS A 143 6.116 19.768 -1.006 1.00 3.41 C ATOM 1621 NE2 HIS A 143 7.108 20.257 -0.288 1.00 3.11 N ATOM 0 H HIS A 143 9.386 14.683 0.376 1.00 1.30 H new ATOM 0 HA HIS A 143 7.475 16.643 1.473 1.00 1.50 H new ATOM 0 HB2 HIS A 143 9.136 16.780 -0.732 1.00 1.74 H new ATOM 0 HB3 HIS A 143 7.647 16.204 -1.456 1.00 1.74 H new ATOM 0 HD2 HIS A 143 8.907 19.334 0.559 1.00 2.47 H new ATOM 0 HE1 HIS A 143 5.269 20.326 -1.376 1.00 3.41 H new ATOM 0 HE2 HIS A 143 7.202 21.228 0.012 1.00 3.11 H new ATOM 1630 N ALA A 144 6.701 13.775 0.821 1.00 0.99 N ATOM 1631 CA ALA A 144 5.686 12.745 0.611 1.00 0.77 C ATOM 1632 C ALA A 144 5.414 12.506 -0.859 1.00 0.76 C ATOM 1633 O ALA A 144 4.915 13.366 -1.579 1.00 1.13 O ATOM 1634 CB ALA A 144 4.394 13.077 1.333 1.00 0.88 C ATOM 0 H ALA A 144 7.538 13.434 1.294 1.00 0.99 H new ATOM 0 HA ALA A 144 6.091 11.825 1.033 1.00 0.77 H new ATOM 0 HB1 ALA A 144 3.664 12.288 1.153 1.00 0.88 H new ATOM 0 HB2 ALA A 144 4.585 13.157 2.403 1.00 0.88 H new ATOM 0 HB3 ALA A 144 4.003 14.025 0.962 1.00 0.88 H new ATOM 1640 N ASP A 145 5.737 11.314 -1.288 1.00 0.59 N ATOM 1641 CA ASP A 145 5.475 10.898 -2.640 1.00 0.87 C ATOM 1642 C ASP A 145 4.543 9.709 -2.606 1.00 0.66 C ATOM 1643 O ASP A 145 4.950 8.610 -2.924 1.00 0.75 O ATOM 1644 CB ASP A 145 6.764 10.573 -3.385 1.00 1.23 C ATOM 1645 CG ASP A 145 6.869 11.348 -4.683 1.00 1.79 C ATOM 1646 OD1 ASP A 145 6.367 10.851 -5.713 1.00 1.99 O ATOM 1647 OD2 ASP A 145 7.469 12.444 -4.691 1.00 2.20 O ATOM 0 H ASP A 145 6.189 10.605 -0.710 1.00 0.59 H new ATOM 0 HA ASP A 145 5.002 11.715 -3.184 1.00 0.87 H new ATOM 0 HB2 ASP A 145 7.620 10.806 -2.751 1.00 1.23 H new ATOM 0 HB3 ASP A 145 6.804 9.504 -3.595 1.00 1.23 H new ATOM 1652 N ASN A 146 3.319 9.967 -2.135 1.00 0.48 N ATOM 1653 CA ASN A 146 2.244 8.962 -1.961 1.00 0.32 C ATOM 1654 C ASN A 146 2.372 8.279 -0.611 1.00 0.25 C ATOM 1655 O ASN A 146 1.762 7.256 -0.339 1.00 0.37 O ATOM 1656 CB ASN A 146 2.158 7.935 -3.130 1.00 0.38 C ATOM 1657 CG ASN A 146 2.782 6.551 -2.881 1.00 0.76 C ATOM 1658 OD1 ASN A 146 2.167 5.668 -2.294 1.00 1.69 O ATOM 1659 ND2 ASN A 146 3.979 6.328 -3.380 1.00 0.65 N ATOM 0 H ASN A 146 3.032 10.905 -1.854 1.00 0.48 H new ATOM 0 HA ASN A 146 1.298 9.502 -1.988 1.00 0.32 H new ATOM 0 HB2 ASN A 146 1.107 7.794 -3.382 1.00 0.38 H new ATOM 0 HB3 ASN A 146 2.640 8.373 -4.004 1.00 0.38 H new ATOM 0 HD21 ASN A 146 4.409 5.409 -3.281 1.00 0.65 H new ATOM 0 HD22 ASN A 146 4.476 7.075 -3.865 1.00 0.65 H new ATOM 1666 N ILE A 147 3.108 8.910 0.275 1.00 0.30 N ATOM 1667 CA ILE A 147 3.199 8.426 1.631 1.00 0.34 C ATOM 1668 C ILE A 147 2.325 9.258 2.552 1.00 0.38 C ATOM 1669 O ILE A 147 2.462 10.481 2.624 1.00 0.46 O ATOM 1670 CB ILE A 147 4.644 8.426 2.149 1.00 0.42 C ATOM 1671 CG1 ILE A 147 5.513 7.528 1.265 1.00 0.46 C ATOM 1672 CG2 ILE A 147 4.689 7.977 3.599 1.00 0.49 C ATOM 1673 CD1 ILE A 147 4.976 6.123 1.093 1.00 0.50 C ATOM 0 H ILE A 147 3.648 9.753 0.082 1.00 0.30 H new ATOM 0 HA ILE A 147 2.846 7.395 1.626 1.00 0.34 H new ATOM 0 HB ILE A 147 5.040 9.441 2.103 1.00 0.42 H new ATOM 0 HG12 ILE A 147 5.612 7.990 0.283 1.00 0.46 H new ATOM 0 HG13 ILE A 147 6.514 7.473 1.694 1.00 0.46 H new ATOM 0 HG21 ILE A 147 5.721 7.983 3.950 1.00 0.49 H new ATOM 0 HG22 ILE A 147 4.094 8.657 4.209 1.00 0.49 H new ATOM 0 HG23 ILE A 147 4.284 6.968 3.680 1.00 0.49 H new ATOM 0 HD11 ILE A 147 5.649 5.552 0.454 1.00 0.50 H new ATOM 0 HD12 ILE A 147 4.903 5.639 2.067 1.00 0.50 H new ATOM 0 HD13 ILE A 147 3.988 6.165 0.634 1.00 0.50 H new ATOM 1685 N ARG A 148 1.407 8.591 3.215 1.00 0.36 N ATOM 1686 CA ARG A 148 0.575 9.219 4.219 1.00 0.38 C ATOM 1687 C ARG A 148 1.055 8.803 5.591 1.00 0.36 C ATOM 1688 O ARG A 148 1.173 7.611 5.883 1.00 0.39 O ATOM 1689 CB ARG A 148 -0.888 8.825 4.038 1.00 0.45 C ATOM 1690 CG ARG A 148 -1.503 9.347 2.755 1.00 0.62 C ATOM 1691 CD ARG A 148 -1.560 10.863 2.740 1.00 0.83 C ATOM 1692 NE ARG A 148 -2.199 11.375 1.532 1.00 0.98 N ATOM 1693 CZ ARG A 148 -2.177 12.651 1.157 1.00 1.03 C ATOM 1694 NH1 ARG A 148 -1.634 13.570 1.943 1.00 1.40 N ATOM 1695 NH2 ARG A 148 -2.744 13.007 0.013 1.00 1.78 N ATOM 0 H ARG A 148 1.216 7.599 3.074 1.00 0.36 H new ATOM 0 HA ARG A 148 0.649 10.301 4.113 1.00 0.38 H new ATOM 0 HB2 ARG A 148 -0.967 7.738 4.053 1.00 0.45 H new ATOM 0 HB3 ARG A 148 -1.464 9.198 4.885 1.00 0.45 H new ATOM 0 HG2 ARG A 148 -0.921 8.996 1.903 1.00 0.62 H new ATOM 0 HG3 ARG A 148 -2.509 8.943 2.642 1.00 0.62 H new ATOM 0 HD2 ARG A 148 -2.106 11.214 3.615 1.00 0.83 H new ATOM 0 HD3 ARG A 148 -0.549 11.264 2.813 1.00 0.83 H new ATOM 0 HE ARG A 148 -2.695 10.711 0.937 1.00 0.98 H new ATOM 0 HH11 ARG A 148 -1.230 13.300 2.840 1.00 1.40 H new ATOM 0 HH12 ARG A 148 -1.620 14.547 1.651 1.00 1.40 H new ATOM 0 HH21 ARG A 148 -3.194 12.304 -0.574 1.00 1.78 H new ATOM 0 HH22 ARG A 148 -2.731 13.984 -0.281 1.00 1.78 H new ATOM 1709 N THR A 149 1.365 9.782 6.414 1.00 0.33 N ATOM 1710 CA THR A 149 1.805 9.508 7.761 1.00 0.31 C ATOM 1711 C THR A 149 0.688 8.871 8.565 1.00 0.28 C ATOM 1712 O THR A 149 -0.475 9.149 8.294 1.00 0.29 O ATOM 1713 CB THR A 149 2.281 10.786 8.466 1.00 0.34 C ATOM 1714 OG1 THR A 149 1.353 11.856 8.226 1.00 0.37 O ATOM 1715 CG2 THR A 149 3.659 11.173 7.971 1.00 0.40 C ATOM 0 H THR A 149 1.320 10.772 6.173 1.00 0.33 H new ATOM 0 HA THR A 149 2.645 8.816 7.697 1.00 0.31 H new ATOM 0 HB THR A 149 2.333 10.597 9.538 1.00 0.34 H new ATOM 0 HG1 THR A 149 1.664 12.667 8.681 1.00 0.37 H new ATOM 0 HG21 THR A 149 3.986 12.081 8.478 1.00 0.40 H new ATOM 0 HG22 THR A 149 4.361 10.366 8.182 1.00 0.40 H new ATOM 0 HG23 THR A 149 3.623 11.351 6.896 1.00 0.40 H new ATOM 1723 N LYS A 150 1.020 8.019 9.540 1.00 0.31 N ATOM 1724 CA LYS A 150 -0.006 7.407 10.385 1.00 0.34 C ATOM 1725 C LYS A 150 -0.920 8.493 10.927 1.00 0.31 C ATOM 1726 O LYS A 150 -2.142 8.335 11.016 1.00 0.39 O ATOM 1727 CB LYS A 150 0.620 6.662 11.562 1.00 0.41 C ATOM 1728 CG LYS A 150 1.783 5.765 11.208 1.00 0.63 C ATOM 1729 CD LYS A 150 3.110 6.396 11.596 1.00 1.48 C ATOM 1730 CE LYS A 150 4.155 5.347 11.945 1.00 2.24 C ATOM 1731 NZ LYS A 150 5.496 5.941 12.184 1.00 3.02 N ATOM 0 H LYS A 150 1.976 7.742 9.760 1.00 0.31 H new ATOM 0 HA LYS A 150 -0.567 6.696 9.779 1.00 0.34 H new ATOM 0 HB2 LYS A 150 0.956 7.393 12.297 1.00 0.41 H new ATOM 0 HB3 LYS A 150 -0.151 6.059 12.042 1.00 0.41 H new ATOM 0 HG2 LYS A 150 1.672 4.807 11.715 1.00 0.63 H new ATOM 0 HG3 LYS A 150 1.775 5.562 10.137 1.00 0.63 H new ATOM 0 HD2 LYS A 150 3.474 7.012 10.773 1.00 1.48 H new ATOM 0 HD3 LYS A 150 2.962 7.059 12.449 1.00 1.48 H new ATOM 0 HE2 LYS A 150 3.837 4.804 12.835 1.00 2.24 H new ATOM 0 HE3 LYS A 150 4.221 4.621 11.135 1.00 2.24 H new ATOM 0 HZ1 LYS A 150 6.100 5.250 12.673 1.00 3.02 H new ATOM 0 HZ2 LYS A 150 5.930 6.196 11.274 1.00 3.02 H new ATOM 0 HZ3 LYS A 150 5.398 6.793 12.772 1.00 3.02 H new ATOM 1745 N GLU A 151 -0.287 9.610 11.257 1.00 0.29 N ATOM 1746 CA GLU A 151 -0.970 10.790 11.760 1.00 0.34 C ATOM 1747 C GLU A 151 -2.017 11.281 10.763 1.00 0.36 C ATOM 1748 O GLU A 151 -3.184 11.465 11.114 1.00 0.48 O ATOM 1749 CB GLU A 151 0.054 11.896 12.021 1.00 0.44 C ATOM 1750 CG GLU A 151 1.243 11.447 12.851 1.00 0.56 C ATOM 1751 CD GLU A 151 2.383 12.445 12.823 1.00 1.01 C ATOM 1752 OE1 GLU A 151 3.053 12.560 11.774 1.00 1.36 O ATOM 1753 OE2 GLU A 151 2.618 13.116 13.850 1.00 1.19 O ATOM 0 H GLU A 151 0.724 9.722 11.182 1.00 0.29 H new ATOM 0 HA GLU A 151 -1.478 10.529 12.688 1.00 0.34 H new ATOM 0 HB2 GLU A 151 0.413 12.278 11.066 1.00 0.44 H new ATOM 0 HB3 GLU A 151 -0.441 12.723 12.530 1.00 0.44 H new ATOM 0 HG2 GLU A 151 0.925 11.294 13.882 1.00 0.56 H new ATOM 0 HG3 GLU A 151 1.598 10.485 12.480 1.00 0.56 H new ATOM 1760 N GLU A 152 -1.600 11.473 9.516 1.00 0.34 N ATOM 1761 CA GLU A 152 -2.498 11.979 8.486 1.00 0.40 C ATOM 1762 C GLU A 152 -3.511 10.936 8.093 1.00 0.40 C ATOM 1763 O GLU A 152 -4.632 11.262 7.729 1.00 0.50 O ATOM 1764 CB GLU A 152 -1.738 12.398 7.244 1.00 0.44 C ATOM 1765 CG GLU A 152 -2.597 13.177 6.266 1.00 0.54 C ATOM 1766 CD GLU A 152 -1.765 13.895 5.226 1.00 0.67 C ATOM 1767 OE1 GLU A 152 -0.989 13.230 4.510 1.00 0.83 O ATOM 1768 OE2 GLU A 152 -1.858 15.137 5.147 1.00 0.76 O ATOM 0 H GLU A 152 -0.650 11.287 9.196 1.00 0.34 H new ATOM 0 HA GLU A 152 -3.004 12.846 8.911 1.00 0.40 H new ATOM 0 HB2 GLU A 152 -0.883 13.008 7.535 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -1.344 11.511 6.748 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -3.289 12.496 5.770 1.00 0.54 H new ATOM 0 HG3 GLU A 152 -3.200 13.903 6.812 1.00 0.54 H new ATOM 1775 N ILE A 153 -3.103 9.685 8.138 1.00 0.34 N ATOM 1776 CA ILE A 153 -4.000 8.596 7.814 1.00 0.35 C ATOM 1777 C ILE A 153 -5.250 8.679 8.680 1.00 0.39 C ATOM 1778 O ILE A 153 -6.368 8.551 8.189 1.00 0.43 O ATOM 1779 CB ILE A 153 -3.335 7.212 7.997 1.00 0.35 C ATOM 1780 CG1 ILE A 153 -2.176 7.047 7.016 1.00 0.39 C ATOM 1781 CG2 ILE A 153 -4.355 6.093 7.810 1.00 0.43 C ATOM 1782 CD1 ILE A 153 -1.431 5.740 7.169 1.00 0.47 C ATOM 0 H ILE A 153 -2.159 9.398 8.395 1.00 0.34 H new ATOM 0 HA ILE A 153 -4.265 8.698 6.762 1.00 0.35 H new ATOM 0 HB ILE A 153 -2.944 7.150 9.013 1.00 0.35 H new ATOM 0 HG12 ILE A 153 -2.560 7.119 5.998 1.00 0.39 H new ATOM 0 HG13 ILE A 153 -1.476 7.872 7.152 1.00 0.39 H new ATOM 0 HG21 ILE A 153 -3.865 5.128 7.943 1.00 0.43 H new ATOM 0 HG22 ILE A 153 -5.152 6.200 8.546 1.00 0.43 H new ATOM 0 HG23 ILE A 153 -4.778 6.150 6.807 1.00 0.43 H new ATOM 0 HD11 ILE A 153 -0.623 5.694 6.439 1.00 0.47 H new ATOM 0 HD12 ILE A 153 -1.016 5.673 8.175 1.00 0.47 H new ATOM 0 HD13 ILE A 153 -2.117 4.909 7.003 1.00 0.47 H new ATOM 1794 N LYS A 154 -5.051 8.936 9.966 1.00 0.42 N ATOM 1795 CA LYS A 154 -6.165 9.082 10.892 1.00 0.50 C ATOM 1796 C LYS A 154 -6.879 10.411 10.665 1.00 0.56 C ATOM 1797 O LYS A 154 -8.051 10.563 11.007 1.00 0.64 O ATOM 1798 CB LYS A 154 -5.668 8.988 12.335 1.00 0.57 C ATOM 1799 CG LYS A 154 -5.002 7.662 12.665 1.00 1.42 C ATOM 1800 CD LYS A 154 -4.430 7.661 14.073 1.00 1.77 C ATOM 1801 CE LYS A 154 -3.768 6.333 14.411 1.00 2.57 C ATOM 1802 NZ LYS A 154 -4.744 5.210 14.439 1.00 3.43 N ATOM 0 H LYS A 154 -4.130 9.047 10.391 1.00 0.42 H new ATOM 0 HA LYS A 154 -6.874 8.274 10.711 1.00 0.50 H new ATOM 0 HB2 LYS A 154 -4.960 9.796 12.520 1.00 0.57 H new ATOM 0 HB3 LYS A 154 -6.510 9.140 13.011 1.00 0.57 H new ATOM 0 HG2 LYS A 154 -5.727 6.855 12.565 1.00 1.42 H new ATOM 0 HG3 LYS A 154 -4.205 7.465 11.947 1.00 1.42 H new ATOM 0 HD2 LYS A 154 -3.701 8.466 14.170 1.00 1.77 H new ATOM 0 HD3 LYS A 154 -5.226 7.863 14.789 1.00 1.77 H new ATOM 0 HE2 LYS A 154 -2.991 6.119 13.677 1.00 2.57 H new ATOM 0 HE3 LYS A 154 -3.277 6.410 15.381 1.00 2.57 H new ATOM 0 HZ1 LYS A 154 -4.288 4.364 14.835 1.00 3.43 H new ATOM 0 HZ2 LYS A 154 -5.559 5.473 15.029 1.00 3.43 H new ATOM 0 HZ3 LYS A 154 -5.068 5.008 13.472 1.00 3.43 H new ATOM 1816 N ARG A 155 -6.164 11.369 10.095 1.00 0.54 N ATOM 1817 CA ARG A 155 -6.760 12.645 9.728 1.00 0.63 C ATOM 1818 C ARG A 155 -7.675 12.491 8.521 1.00 0.66 C ATOM 1819 O ARG A 155 -8.866 12.788 8.597 1.00 0.80 O ATOM 1820 CB ARG A 155 -5.694 13.689 9.425 1.00 0.65 C ATOM 1821 CG ARG A 155 -4.930 14.159 10.645 1.00 1.21 C ATOM 1822 CD ARG A 155 -4.032 15.333 10.306 1.00 1.31 C ATOM 1823 NE ARG A 155 -3.274 15.796 11.465 1.00 2.28 N ATOM 1824 CZ ARG A 155 -2.898 17.061 11.655 1.00 2.71 C ATOM 1825 NH1 ARG A 155 -3.216 17.994 10.765 1.00 2.34 N ATOM 1826 NH2 ARG A 155 -2.198 17.387 12.733 1.00 3.70 N ATOM 0 H ARG A 155 -5.171 11.287 9.877 1.00 0.54 H new ATOM 0 HA ARG A 155 -7.347 12.982 10.582 1.00 0.63 H new ATOM 0 HB2 ARG A 155 -4.989 13.275 8.704 1.00 0.65 H new ATOM 0 HB3 ARG A 155 -6.166 14.549 8.951 1.00 0.65 H new ATOM 0 HG2 ARG A 155 -5.631 14.447 11.428 1.00 1.21 H new ATOM 0 HG3 ARG A 155 -4.329 13.340 11.040 1.00 1.21 H new ATOM 0 HD2 ARG A 155 -3.342 15.044 9.513 1.00 1.31 H new ATOM 0 HD3 ARG A 155 -4.638 16.152 9.918 1.00 1.31 H new ATOM 0 HE ARG A 155 -3.016 15.109 12.173 1.00 2.28 H new ATOM 0 HH11 ARG A 155 -3.750 17.744 9.933 1.00 2.34 H new ATOM 0 HH12 ARG A 155 -2.927 18.961 10.914 1.00 2.34 H new ATOM 0 HH21 ARG A 155 -1.948 16.671 13.415 1.00 3.70 H new ATOM 0 HH22 ARG A 155 -1.909 18.354 12.880 1.00 3.70 H new ATOM 1840 N GLN A 156 -7.126 12.003 7.408 1.00 0.58 N ATOM 1841 CA GLN A 156 -7.888 11.921 6.170 1.00 0.70 C ATOM 1842 C GLN A 156 -8.963 10.838 6.228 1.00 0.67 C ATOM 1843 O GLN A 156 -9.886 10.838 5.417 1.00 0.80 O ATOM 1844 CB GLN A 156 -7.006 11.703 4.949 1.00 0.77 C ATOM 1845 CG GLN A 156 -6.120 10.503 5.052 1.00 0.85 C ATOM 1846 CD GLN A 156 -5.833 9.900 3.692 1.00 1.05 C ATOM 1847 OE1 GLN A 156 -6.544 9.006 3.236 1.00 1.88 O ATOM 1848 NE2 GLN A 156 -4.815 10.404 3.016 1.00 0.92 N ATOM 0 H GLN A 156 -6.167 11.663 7.342 1.00 0.58 H new ATOM 0 HA GLN A 156 -8.374 12.891 6.065 1.00 0.70 H new ATOM 0 HB2 GLN A 156 -7.640 11.601 4.068 1.00 0.77 H new ATOM 0 HB3 GLN A 156 -6.388 12.588 4.796 1.00 0.77 H new ATOM 0 HG2 GLN A 156 -5.182 10.783 5.531 1.00 0.85 H new ATOM 0 HG3 GLN A 156 -6.592 9.755 5.689 1.00 0.85 H new ATOM 0 HE21 GLN A 156 -4.247 11.145 3.427 1.00 0.92 H new ATOM 0 HE22 GLN A 156 -4.597 10.052 2.084 1.00 0.92 H new ATOM 1857 N LYS A 157 -8.851 9.920 7.185 1.00 0.55 N ATOM 1858 CA LYS A 157 -9.836 8.850 7.318 1.00 0.54 C ATOM 1859 C LYS A 157 -11.139 9.377 7.917 1.00 0.62 C ATOM 1860 O LYS A 157 -12.135 8.657 7.997 1.00 0.67 O ATOM 1861 CB LYS A 157 -9.302 7.688 8.159 1.00 0.50 C ATOM 1862 CG LYS A 157 -9.254 7.964 9.645 1.00 0.81 C ATOM 1863 CD LYS A 157 -9.014 6.688 10.434 1.00 1.02 C ATOM 1864 CE LYS A 157 -7.755 5.976 9.965 1.00 0.68 C ATOM 1865 NZ LYS A 157 -7.493 4.736 10.747 1.00 0.90 N ATOM 0 H LYS A 157 -8.098 9.895 7.872 1.00 0.55 H new ATOM 0 HA LYS A 157 -10.037 8.474 6.315 1.00 0.54 H new ATOM 0 HB2 LYS A 157 -9.926 6.812 7.984 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -8.298 7.438 7.815 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -8.462 8.681 9.859 1.00 0.81 H new ATOM 0 HG3 LYS A 157 -10.191 8.420 9.963 1.00 0.81 H new ATOM 0 HD2 LYS A 157 -8.927 6.925 11.494 1.00 1.02 H new ATOM 0 HD3 LYS A 157 -9.872 6.024 10.325 1.00 1.02 H new ATOM 0 HE2 LYS A 157 -7.852 5.725 8.909 1.00 0.68 H new ATOM 0 HE3 LYS A 157 -6.902 6.649 10.056 1.00 0.68 H new ATOM 0 HZ1 LYS A 157 -6.626 4.281 10.396 1.00 0.90 H new ATOM 0 HZ2 LYS A 157 -7.375 4.978 11.752 1.00 0.90 H new ATOM 0 HZ3 LYS A 157 -8.295 4.082 10.640 1.00 0.90 H new ATOM 1879 N GLN A 158 -11.123 10.626 8.354 1.00 0.74 N ATOM 1880 CA GLN A 158 -12.307 11.259 8.885 1.00 0.91 C ATOM 1881 C GLN A 158 -12.941 12.172 7.842 1.00 1.15 C ATOM 1882 O GLN A 158 -12.541 13.349 7.754 1.00 1.78 O ATOM 1883 CB GLN A 158 -11.952 12.042 10.140 1.00 1.18 C ATOM 1884 CG GLN A 158 -11.403 11.164 11.246 1.00 1.48 C ATOM 1885 CD GLN A 158 -11.288 11.880 12.574 1.00 1.88 C ATOM 1886 OE1 GLN A 158 -11.050 13.088 12.634 1.00 2.12 O ATOM 1887 NE2 GLN A 158 -11.467 11.137 13.653 1.00 2.52 N ATOM 0 H GLN A 158 -10.294 11.220 8.349 1.00 0.74 H new ATOM 0 HA GLN A 158 -13.034 10.489 9.144 1.00 0.91 H new ATOM 0 HB2 GLN A 158 -11.216 12.806 9.890 1.00 1.18 H new ATOM 0 HB3 GLN A 158 -12.840 12.561 10.502 1.00 1.18 H new ATOM 0 HG2 GLN A 158 -12.049 10.294 11.364 1.00 1.48 H new ATOM 0 HG3 GLN A 158 -10.420 10.794 10.954 1.00 1.48 H new ATOM 0 HE21 GLN A 158 -11.662 10.140 13.559 1.00 2.52 H new ATOM 0 HE22 GLN A 158 -11.410 11.561 14.579 1.00 2.52 H new ATOM 1896 N GLU A 159 -13.839 11.702 7.113 1.00 1.48 N TER 1897 GLU A 159 HETATM 1898 ZN ZN A1159 -12.917 -0.212 1.870 1.00 0.33 ZN