USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1489 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 169 THR OG1 : rot 180:sc= 0.123 USER MOD Set 1.2: A 172 THR OG1 : rot 180:sc= 0.0184 USER MOD Set 2.1: A 28 GLN : amide:sc= -0.792 K(o=-0.79,f=-4.5!) USER MOD Set 2.2: A 137 MET CE :methyl 169:sc=-0.00065 (180deg=-0.102) USER MOD Set 3.1: A 79 MET CE :methyl -149:sc= 0 (180deg=0) USER MOD Set 3.2: A 186 THR OG1 : rot 110:sc= 1.11 USER MOD Set 4.1: A 18 GLN : amide:sc= -0.82 K(o=0.49,f=-0.37) USER MOD Set 4.2: A 22 THR OG1 : rot 142:sc= 1.31 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 153:sc= -0.0924 (180deg=-0.817) USER MOD Single : A 4 SER OG : rot 180:sc= -0.297 USER MOD Single : A 7 GLN : amide:sc= -0.392 X(o=-0.39,f=-0.29) USER MOD Single : A 14 THR OG1 : rot -32:sc= 0.616! USER MOD Single : A 15 SER OG : rot 180:sc= -0.45 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -153:sc= -0.893 (180deg=-2.62!) USER MOD Single : A 32 GLN : amide:sc= -0.568 X(o=-0.57,f=-0.83) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc=-0.000585 K(o=-0.00058,f=-0.8) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -149:sc= -0.14 (180deg=-0.8) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 157:sc= 0.97 USER MOD Single : A 64 LYS NZ :NH3+ -123:sc= -0.297 (180deg=-3.07!) USER MOD Single : A 72 SER OG : rot -133:sc= 1.05 USER MOD Single : A 73 ASN : amide:sc= -3.06 K(o=-3.1,f=-6.7!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 85 THR OG1 : rot 23:sc= 0.327 USER MOD Single : A 87 SER OG : rot 160:sc= 0 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -4.03! C(o=-4!,f=-11!) USER MOD Single : A 106 ASN : amide:sc= -6.77! K(o=-6.8!,f=-0.78) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= -0.0546 USER MOD Single : A 119 LYS NZ :NH3+ -179:sc= 0.432! (180deg=0.367!) USER MOD Single : A 123 LYS NZ :NH3+ 159:sc= -0.034 (180deg=-0.278) USER MOD Single : A 126 CYS SG : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot -22:sc= 0.313 USER MOD Single : A 128 LYS NZ :NH3+ -158:sc= -0.0644 (180deg=-0.476) USER MOD Single : A 135 THR OG1 : rot 82:sc= 1.28 USER MOD Single : A 140 THR OG1 : rot -44:sc= -1.47! USER MOD Single : A 153 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 155 GLN : amide:sc=-0.00459 X(o=-0.0046,f=-0.41) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 100:sc= 0.527! USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 GLN : amide:sc= -4.32! C(o=-4.3!,f=-4.6!) USER MOD Single : A 174 THR OG1 : rot 95:sc= 1.05 USER MOD Single : A 182 THR OG1 : rot -86:sc= 0.248 USER MOD Single : A 184 SER OG : rot -48:sc= 0.576 USER MOD Single : A 189 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.261) USER MOD Single : A 190 LYS NZ :NH3+ -162:sc= -0.043 (180deg=-0.539) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 44.221 -3.980 -6.597 1.00 17.15 N ATOM 2 CA MET A 1 44.504 -4.883 -5.446 1.00 16.73 C ATOM 3 C MET A 1 43.465 -4.651 -4.347 1.00 16.39 C ATOM 4 O MET A 1 42.990 -3.551 -4.150 1.00 16.40 O ATOM 5 CB MET A 1 45.903 -4.590 -4.899 1.00 16.98 C ATOM 6 CG MET A 1 46.051 -3.088 -4.648 1.00 17.51 C ATOM 7 SD MET A 1 47.680 -2.756 -3.932 1.00 17.69 S ATOM 8 CE MET A 1 47.539 -0.953 -3.867 1.00 17.86 C ATOM 0 H1 MET A 1 45.104 -3.786 -7.111 1.00 17.15 H new ATOM 0 H2 MET A 1 43.541 -4.437 -7.238 1.00 17.15 H new ATOM 0 H3 MET A 1 43.820 -3.086 -6.247 1.00 17.15 H new ATOM 0 HA MET A 1 44.455 -5.920 -5.777 1.00 16.73 H new ATOM 0 HB2 MET A 1 46.065 -5.142 -3.973 1.00 16.98 H new ATOM 0 HB3 MET A 1 46.660 -4.927 -5.608 1.00 16.98 H new ATOM 0 HG2 MET A 1 45.933 -2.539 -5.582 1.00 17.51 H new ATOM 0 HG3 MET A 1 45.268 -2.742 -3.974 1.00 17.51 H new ATOM 0 HE1 MET A 1 48.453 -0.531 -3.449 1.00 17.86 H new ATOM 0 HE2 MET A 1 47.387 -0.563 -4.874 1.00 17.86 H new ATOM 0 HE3 MET A 1 46.692 -0.677 -3.239 1.00 17.86 H new ATOM 20 N ASP A 2 43.107 -5.682 -3.630 1.00 16.24 N ATOM 21 CA ASP A 2 42.098 -5.522 -2.545 1.00 16.07 C ATOM 22 C ASP A 2 42.742 -4.824 -1.345 1.00 15.50 C ATOM 23 O ASP A 2 42.253 -3.824 -0.860 1.00 15.56 O ATOM 24 CB ASP A 2 41.585 -6.899 -2.119 1.00 16.42 C ATOM 25 CG ASP A 2 42.770 -7.790 -1.741 1.00 16.67 C ATOM 26 OD1 ASP A 2 43.345 -8.388 -2.635 1.00 16.77 O ATOM 27 OD2 ASP A 2 43.082 -7.858 -0.564 1.00 16.88 O ATOM 0 H ASP A 2 43.470 -6.628 -3.749 1.00 16.24 H new ATOM 0 HA ASP A 2 41.266 -4.920 -2.910 1.00 16.07 H new ATOM 0 HB2 ASP A 2 40.906 -6.800 -1.272 1.00 16.42 H new ATOM 0 HB3 ASP A 2 41.018 -7.355 -2.931 1.00 16.42 H new ATOM 32 N GLY A 3 43.837 -5.345 -0.862 1.00 15.11 N ATOM 33 CA GLY A 3 44.511 -4.712 0.306 1.00 14.72 C ATOM 34 C GLY A 3 43.565 -4.717 1.508 1.00 14.60 C ATOM 35 O GLY A 3 42.766 -5.618 1.678 1.00 14.88 O ATOM 0 H GLY A 3 44.293 -6.181 -1.226 1.00 15.11 H new ATOM 0 HA2 GLY A 3 45.426 -5.253 0.548 1.00 14.72 H new ATOM 0 HA3 GLY A 3 44.800 -3.690 0.062 1.00 14.72 H new ATOM 39 N SER A 4 43.647 -3.719 2.345 1.00 14.34 N ATOM 40 CA SER A 4 42.751 -3.668 3.535 1.00 14.41 C ATOM 41 C SER A 4 41.308 -3.437 3.076 1.00 13.79 C ATOM 42 O SER A 4 40.694 -4.298 2.477 1.00 14.02 O ATOM 43 CB SER A 4 43.190 -2.524 4.451 1.00 14.82 C ATOM 44 OG SER A 4 42.269 -2.405 5.528 1.00 14.88 O ATOM 0 H SER A 4 44.296 -2.937 2.256 1.00 14.34 H new ATOM 0 HA SER A 4 42.810 -4.610 4.079 1.00 14.41 H new ATOM 0 HB2 SER A 4 44.193 -2.714 4.834 1.00 14.82 H new ATOM 0 HB3 SER A 4 43.234 -1.590 3.890 1.00 14.82 H new ATOM 0 HG SER A 4 42.548 -1.674 6.118 1.00 14.88 H new ATOM 50 N GLY A 5 40.762 -2.283 3.349 1.00 13.15 N ATOM 51 CA GLY A 5 39.361 -2.001 2.924 1.00 12.67 C ATOM 52 C GLY A 5 38.388 -2.812 3.779 1.00 12.31 C ATOM 53 O GLY A 5 37.510 -2.266 4.416 1.00 12.37 O ATOM 0 H GLY A 5 41.225 -1.523 3.848 1.00 13.15 H new ATOM 0 HA2 GLY A 5 39.148 -0.937 3.025 1.00 12.67 H new ATOM 0 HA3 GLY A 5 39.233 -2.254 1.872 1.00 12.67 H new ATOM 57 N GLU A 6 38.536 -4.110 3.792 1.00 12.14 N ATOM 58 CA GLU A 6 37.623 -4.969 4.601 1.00 12.01 C ATOM 59 C GLU A 6 36.170 -4.718 4.188 1.00 11.53 C ATOM 60 O GLU A 6 35.611 -3.669 4.440 1.00 11.57 O ATOM 61 CB GLU A 6 37.796 -4.650 6.088 1.00 12.39 C ATOM 62 CG GLU A 6 36.956 -5.623 6.913 1.00 12.94 C ATOM 63 CD GLU A 6 37.208 -5.380 8.402 1.00 13.31 C ATOM 64 OE1 GLU A 6 37.319 -4.226 8.783 1.00 13.55 O ATOM 65 OE2 GLU A 6 37.287 -6.351 9.136 1.00 13.50 O ATOM 0 H GLU A 6 39.255 -4.615 3.274 1.00 12.14 H new ATOM 0 HA GLU A 6 37.870 -6.016 4.425 1.00 12.01 H new ATOM 0 HB2 GLU A 6 38.846 -4.729 6.369 1.00 12.39 H new ATOM 0 HB3 GLU A 6 37.488 -3.624 6.290 1.00 12.39 H new ATOM 0 HG2 GLU A 6 35.898 -5.490 6.686 1.00 12.94 H new ATOM 0 HG3 GLU A 6 37.211 -6.650 6.653 1.00 12.94 H new ATOM 72 N GLN A 7 35.552 -5.678 3.556 1.00 11.25 N ATOM 73 CA GLN A 7 34.137 -5.502 3.125 1.00 10.97 C ATOM 74 C GLN A 7 34.022 -4.247 2.239 1.00 10.29 C ATOM 75 O GLN A 7 33.381 -3.289 2.621 1.00 10.41 O ATOM 76 CB GLN A 7 33.249 -5.338 4.369 1.00 11.52 C ATOM 77 CG GLN A 7 31.786 -5.631 4.010 1.00 12.08 C ATOM 78 CD GLN A 7 31.611 -7.118 3.691 1.00 12.56 C ATOM 79 OE1 GLN A 7 31.094 -7.470 2.649 1.00 12.91 O ATOM 80 NE2 GLN A 7 32.020 -8.012 4.549 1.00 12.77 N ATOM 0 H GLN A 7 35.968 -6.579 3.319 1.00 11.25 H new ATOM 0 HA GLN A 7 33.814 -6.374 2.557 1.00 10.97 H new ATOM 0 HB2 GLN A 7 33.582 -6.015 5.156 1.00 11.52 H new ATOM 0 HB3 GLN A 7 33.340 -4.325 4.761 1.00 11.52 H new ATOM 0 HG2 GLN A 7 31.137 -5.350 4.839 1.00 12.08 H new ATOM 0 HG3 GLN A 7 31.486 -5.029 3.152 1.00 12.08 H new ATOM 0 HE21 GLN A 7 32.454 -7.718 5.424 1.00 12.77 H new ATOM 0 HE22 GLN A 7 31.906 -9.005 4.345 1.00 12.77 H new ATOM 89 N PRO A 8 34.649 -4.278 1.080 1.00 9.81 N ATOM 90 CA PRO A 8 34.612 -3.128 0.155 1.00 9.37 C ATOM 91 C PRO A 8 33.162 -2.826 -0.250 1.00 9.09 C ATOM 92 O PRO A 8 32.611 -3.452 -1.134 1.00 9.07 O ATOM 93 CB PRO A 8 35.463 -3.568 -1.062 1.00 9.20 C ATOM 94 CG PRO A 8 35.976 -5.010 -0.779 1.00 9.57 C ATOM 95 CD PRO A 8 35.431 -5.440 0.601 1.00 9.93 C ATOM 0 HA PRO A 8 35.002 -2.213 0.601 1.00 9.37 H new ATOM 0 HB2 PRO A 8 34.867 -3.545 -1.974 1.00 9.20 H new ATOM 0 HB3 PRO A 8 36.300 -2.886 -1.211 1.00 9.20 H new ATOM 0 HG2 PRO A 8 35.636 -5.696 -1.555 1.00 9.57 H new ATOM 0 HG3 PRO A 8 37.066 -5.036 -0.785 1.00 9.57 H new ATOM 0 HD2 PRO A 8 34.807 -6.330 0.520 1.00 9.93 H new ATOM 0 HD3 PRO A 8 36.242 -5.681 1.288 1.00 9.93 H new ATOM 103 N ARG A 9 32.544 -1.871 0.390 1.00 9.13 N ATOM 104 CA ARG A 9 31.134 -1.530 0.042 1.00 9.14 C ATOM 105 C ARG A 9 31.093 -0.871 -1.341 1.00 8.60 C ATOM 106 O ARG A 9 31.726 0.139 -1.575 1.00 8.68 O ATOM 107 CB ARG A 9 30.569 -0.563 1.094 1.00 10.09 C ATOM 108 CG ARG A 9 31.657 0.427 1.523 1.00 10.67 C ATOM 109 CD ARG A 9 31.018 1.597 2.277 1.00 11.51 C ATOM 110 NE ARG A 9 30.128 1.068 3.349 1.00 12.05 N ATOM 111 CZ ARG A 9 29.707 1.859 4.299 1.00 12.65 C ATOM 112 NH1 ARG A 9 30.068 3.113 4.313 1.00 12.79 N ATOM 113 NH2 ARG A 9 28.925 1.394 5.235 1.00 13.27 N ATOM 0 H ARG A 9 32.954 -1.312 1.138 1.00 9.13 H new ATOM 0 HA ARG A 9 30.532 -2.438 0.025 1.00 9.14 H new ATOM 0 HB2 ARG A 9 29.714 -0.024 0.685 1.00 10.09 H new ATOM 0 HB3 ARG A 9 30.210 -1.121 1.959 1.00 10.09 H new ATOM 0 HG2 ARG A 9 32.388 -0.073 2.159 1.00 10.67 H new ATOM 0 HG3 ARG A 9 32.194 0.794 0.648 1.00 10.67 H new ATOM 0 HD2 ARG A 9 31.792 2.230 2.711 1.00 11.51 H new ATOM 0 HD3 ARG A 9 30.446 2.219 1.588 1.00 11.51 H new ATOM 0 HE ARG A 9 29.847 0.087 3.341 1.00 12.05 H new ATOM 0 HH11 ARG A 9 30.679 3.476 3.582 1.00 12.79 H new ATOM 0 HH12 ARG A 9 29.739 3.730 5.055 1.00 12.79 H new ATOM 0 HH21 ARG A 9 28.643 0.414 5.224 1.00 13.27 H new ATOM 0 HH22 ARG A 9 28.596 2.011 5.977 1.00 13.27 H new ATOM 127 N GLY A 10 30.358 -1.437 -2.261 1.00 8.29 N ATOM 128 CA GLY A 10 30.280 -0.843 -3.626 1.00 8.00 C ATOM 129 C GLY A 10 29.223 -1.594 -4.440 1.00 7.45 C ATOM 130 O GLY A 10 28.870 -2.713 -4.124 1.00 7.68 O ATOM 0 H GLY A 10 29.808 -2.285 -2.125 1.00 8.29 H new ATOM 0 HA2 GLY A 10 30.024 0.214 -3.562 1.00 8.00 H new ATOM 0 HA3 GLY A 10 31.250 -0.906 -4.120 1.00 8.00 H new ATOM 134 N GLY A 11 28.722 -1.004 -5.489 1.00 7.01 N ATOM 135 CA GLY A 11 27.698 -1.709 -6.314 1.00 6.74 C ATOM 136 C GLY A 11 26.367 -1.729 -5.563 1.00 5.83 C ATOM 137 O GLY A 11 26.310 -2.004 -4.381 1.00 6.06 O ATOM 0 H GLY A 11 28.974 -0.070 -5.811 1.00 7.01 H new ATOM 0 HA2 GLY A 11 27.579 -1.206 -7.274 1.00 6.74 H new ATOM 0 HA3 GLY A 11 28.024 -2.727 -6.526 1.00 6.74 H new ATOM 141 N GLY A 12 25.297 -1.425 -6.242 1.00 5.12 N ATOM 142 CA GLY A 12 23.963 -1.407 -5.580 1.00 4.52 C ATOM 143 C GLY A 12 23.797 -0.096 -4.797 1.00 3.52 C ATOM 144 O GLY A 12 23.769 -0.115 -3.589 1.00 3.54 O ATOM 0 H GLY A 12 25.289 -1.187 -7.234 1.00 5.12 H new ATOM 0 HA2 GLY A 12 23.174 -1.500 -6.326 1.00 4.52 H new ATOM 0 HA3 GLY A 12 23.868 -2.259 -4.907 1.00 4.52 H new ATOM 148 N PRO A 13 23.705 1.011 -5.506 1.00 3.15 N ATOM 149 CA PRO A 13 23.539 2.340 -4.866 1.00 2.77 C ATOM 150 C PRO A 13 22.142 2.448 -4.229 1.00 2.05 C ATOM 151 O PRO A 13 21.233 3.040 -4.773 1.00 2.37 O ATOM 152 CB PRO A 13 23.759 3.353 -6.018 1.00 3.47 C ATOM 153 CG PRO A 13 23.878 2.521 -7.340 1.00 3.99 C ATOM 154 CD PRO A 13 23.791 1.032 -6.977 1.00 3.79 C ATOM 0 HA PRO A 13 24.239 2.524 -4.051 1.00 2.77 H new ATOM 0 HB2 PRO A 13 22.928 4.056 -6.078 1.00 3.47 H new ATOM 0 HB3 PRO A 13 24.662 3.940 -5.849 1.00 3.47 H new ATOM 0 HG2 PRO A 13 23.081 2.791 -8.032 1.00 3.99 H new ATOM 0 HG3 PRO A 13 24.822 2.736 -7.841 1.00 3.99 H new ATOM 0 HD2 PRO A 13 22.918 0.564 -7.432 1.00 3.79 H new ATOM 0 HD3 PRO A 13 24.666 0.486 -7.331 1.00 3.79 H new ATOM 162 N THR A 14 21.988 1.854 -3.071 1.00 1.59 N ATOM 163 CA THR A 14 20.671 1.866 -2.339 1.00 1.24 C ATOM 164 C THR A 14 20.569 3.159 -1.537 1.00 1.07 C ATOM 165 O THR A 14 21.341 3.398 -0.630 1.00 1.20 O ATOM 166 CB THR A 14 20.604 0.642 -1.387 1.00 1.43 C ATOM 167 OG1 THR A 14 20.756 1.002 -0.027 1.00 2.16 O ATOM 168 CG2 THR A 14 21.698 -0.342 -1.837 1.00 1.78 C ATOM 0 H THR A 14 22.732 1.350 -2.588 1.00 1.59 H new ATOM 0 HA THR A 14 19.844 1.810 -3.047 1.00 1.24 H new ATOM 0 HB THR A 14 19.619 0.180 -1.450 1.00 1.43 H new ATOM 0 HG1 THR A 14 21.347 1.781 0.041 1.00 2.16 H new ATOM 0 HG21 THR A 14 21.685 -1.220 -1.191 1.00 1.78 H new ATOM 0 HG22 THR A 14 21.512 -0.646 -2.867 1.00 1.78 H new ATOM 0 HG23 THR A 14 22.672 0.142 -1.772 1.00 1.78 H new ATOM 176 N SER A 15 19.625 4.002 -1.882 1.00 1.07 N ATOM 177 CA SER A 15 19.463 5.302 -1.154 1.00 0.91 C ATOM 178 C SER A 15 18.006 5.481 -0.735 1.00 0.75 C ATOM 179 O SER A 15 17.097 5.347 -1.532 1.00 0.78 O ATOM 180 CB SER A 15 19.886 6.457 -2.062 1.00 0.99 C ATOM 181 OG SER A 15 18.918 6.629 -3.088 1.00 1.38 O ATOM 0 H SER A 15 18.958 3.846 -2.638 1.00 1.07 H new ATOM 0 HA SER A 15 20.093 5.296 -0.264 1.00 0.91 H new ATOM 0 HB2 SER A 15 19.983 7.374 -1.481 1.00 0.99 H new ATOM 0 HB3 SER A 15 20.863 6.251 -2.499 1.00 0.99 H new ATOM 0 HG SER A 15 19.187 7.370 -3.670 1.00 1.38 H new ATOM 187 N SER A 16 17.776 5.784 0.512 1.00 0.72 N ATOM 188 CA SER A 16 16.378 5.973 0.984 1.00 0.82 C ATOM 189 C SER A 16 15.672 6.978 0.072 1.00 0.81 C ATOM 190 O SER A 16 14.517 6.813 -0.266 1.00 0.92 O ATOM 191 CB SER A 16 16.393 6.493 2.422 1.00 1.06 C ATOM 192 OG SER A 16 15.060 6.744 2.845 1.00 1.64 O ATOM 0 H SER A 16 18.496 5.909 1.224 1.00 0.72 H new ATOM 0 HA SER A 16 15.845 5.023 0.955 1.00 0.82 H new ATOM 0 HB2 SER A 16 16.864 5.763 3.080 1.00 1.06 H new ATOM 0 HB3 SER A 16 16.985 7.406 2.484 1.00 1.06 H new ATOM 0 HG SER A 16 15.066 7.076 3.767 1.00 1.64 H new ATOM 198 N GLU A 17 16.344 8.026 -0.321 1.00 0.80 N ATOM 199 CA GLU A 17 15.703 9.041 -1.204 1.00 0.94 C ATOM 200 C GLU A 17 15.111 8.375 -2.451 1.00 0.85 C ATOM 201 O GLU A 17 14.136 8.843 -3.003 1.00 0.89 O ATOM 202 CB GLU A 17 16.739 10.097 -1.601 1.00 1.13 C ATOM 203 CG GLU A 17 16.043 11.299 -2.240 1.00 1.71 C ATOM 204 CD GLU A 17 17.098 12.303 -2.713 1.00 2.26 C ATOM 205 OE1 GLU A 17 18.017 11.888 -3.400 1.00 2.90 O ATOM 206 OE2 GLU A 17 16.969 13.469 -2.379 1.00 2.68 O ATOM 0 H GLU A 17 17.312 8.223 -0.068 1.00 0.80 H new ATOM 0 HA GLU A 17 14.889 9.522 -0.661 1.00 0.94 H new ATOM 0 HB2 GLU A 17 17.300 10.416 -0.723 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.457 9.669 -2.300 1.00 1.13 H new ATOM 0 HG2 GLU A 17 15.431 10.974 -3.081 1.00 1.71 H new ATOM 0 HG3 GLU A 17 15.373 11.770 -1.521 1.00 1.71 H new ATOM 213 N GLN A 18 15.678 7.293 -2.907 1.00 0.80 N ATOM 214 CA GLN A 18 15.107 6.628 -4.113 1.00 0.83 C ATOM 215 C GLN A 18 13.760 5.995 -3.732 1.00 0.68 C ATOM 216 O GLN A 18 12.847 5.921 -4.531 1.00 0.69 O ATOM 217 CB GLN A 18 16.083 5.550 -4.626 1.00 0.96 C ATOM 218 CG GLN A 18 15.977 5.429 -6.152 1.00 1.53 C ATOM 219 CD GLN A 18 14.530 5.125 -6.545 1.00 2.23 C ATOM 220 OE1 GLN A 18 14.070 4.010 -6.401 1.00 2.69 O ATOM 221 NE2 GLN A 18 13.789 6.079 -7.040 1.00 3.07 N ATOM 0 H GLN A 18 16.501 6.845 -2.504 1.00 0.80 H new ATOM 0 HA GLN A 18 14.954 7.358 -4.908 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.104 5.808 -4.344 1.00 0.96 H new ATOM 0 HB3 GLN A 18 15.856 4.591 -4.160 1.00 0.96 H new ATOM 0 HG2 GLN A 18 16.305 6.355 -6.624 1.00 1.53 H new ATOM 0 HG3 GLN A 18 16.635 4.638 -6.511 1.00 1.53 H new ATOM 0 HE21 GLN A 18 14.176 7.015 -7.161 1.00 3.07 H new ATOM 0 HE22 GLN A 18 12.823 5.888 -7.306 1.00 3.07 H new ATOM 230 N ILE A 19 13.633 5.548 -2.510 1.00 0.59 N ATOM 231 CA ILE A 19 12.352 4.928 -2.059 1.00 0.58 C ATOM 232 C ILE A 19 11.268 6.004 -1.946 1.00 0.52 C ATOM 233 O ILE A 19 10.091 5.732 -2.067 1.00 0.59 O ATOM 234 CB ILE A 19 12.560 4.255 -0.701 1.00 0.64 C ATOM 235 CG1 ILE A 19 13.681 3.219 -0.823 1.00 0.74 C ATOM 236 CG2 ILE A 19 11.264 3.565 -0.262 1.00 0.73 C ATOM 237 CD1 ILE A 19 13.983 2.624 0.554 1.00 0.81 C ATOM 0 H ILE A 19 14.366 5.586 -1.801 1.00 0.59 H new ATOM 0 HA ILE A 19 12.036 4.180 -2.786 1.00 0.58 H new ATOM 0 HB ILE A 19 12.832 5.005 0.042 1.00 0.64 H new ATOM 0 HG12 ILE A 19 13.387 2.430 -1.515 1.00 0.74 H new ATOM 0 HG13 ILE A 19 14.577 3.685 -1.233 1.00 0.74 H new ATOM 0 HG21 ILE A 19 11.416 3.087 0.706 1.00 0.73 H new ATOM 0 HG22 ILE A 19 10.468 4.305 -0.180 1.00 0.73 H new ATOM 0 HG23 ILE A 19 10.985 2.812 -0.999 1.00 0.73 H new ATOM 0 HD11 ILE A 19 14.781 1.887 0.465 1.00 0.81 H new ATOM 0 HD12 ILE A 19 14.296 3.418 1.233 1.00 0.81 H new ATOM 0 HD13 ILE A 19 13.087 2.143 0.947 1.00 0.81 H new ATOM 249 N MET A 20 11.658 7.222 -1.714 1.00 0.51 N ATOM 250 CA MET A 20 10.670 8.326 -1.590 1.00 0.60 C ATOM 251 C MET A 20 10.030 8.647 -2.945 1.00 0.55 C ATOM 252 O MET A 20 8.833 8.813 -3.062 1.00 0.59 O ATOM 253 CB MET A 20 11.415 9.589 -1.072 1.00 0.82 C ATOM 254 CG MET A 20 11.031 9.852 0.402 1.00 1.07 C ATOM 255 SD MET A 20 9.273 10.324 0.501 1.00 1.43 S ATOM 256 CE MET A 20 8.751 9.135 1.770 1.00 0.93 C ATOM 0 H MET A 20 12.632 7.504 -1.603 1.00 0.51 H new ATOM 0 HA MET A 20 9.882 8.023 -0.901 1.00 0.60 H new ATOM 0 HB2 MET A 20 12.492 9.448 -1.158 1.00 0.82 H new ATOM 0 HB3 MET A 20 11.157 10.453 -1.685 1.00 0.82 H new ATOM 0 HG2 MET A 20 11.213 8.959 1.000 1.00 1.07 H new ATOM 0 HG3 MET A 20 11.655 10.645 0.815 1.00 1.07 H new ATOM 0 HE1 MET A 20 7.688 9.265 1.975 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.931 8.121 1.414 1.00 0.93 H new ATOM 0 HE3 MET A 20 9.320 9.305 2.684 1.00 0.93 H new ATOM 266 N LYS A 21 10.842 8.748 -3.969 1.00 0.57 N ATOM 267 CA LYS A 21 10.311 9.074 -5.322 1.00 0.61 C ATOM 268 C LYS A 21 9.487 7.903 -5.863 1.00 0.53 C ATOM 269 O LYS A 21 8.368 8.078 -6.302 1.00 0.51 O ATOM 270 CB LYS A 21 11.483 9.353 -6.280 1.00 0.72 C ATOM 271 CG LYS A 21 11.935 10.814 -6.150 1.00 1.09 C ATOM 272 CD LYS A 21 13.204 11.053 -6.999 1.00 1.24 C ATOM 273 CE LYS A 21 14.458 10.849 -6.142 1.00 1.80 C ATOM 274 NZ LYS A 21 14.550 11.948 -5.140 1.00 2.40 N ATOM 0 H LYS A 21 11.853 8.618 -3.922 1.00 0.57 H new ATOM 0 HA LYS A 21 9.674 9.956 -5.248 1.00 0.61 H new ATOM 0 HB2 LYS A 21 12.315 8.686 -6.054 1.00 0.72 H new ATOM 0 HB3 LYS A 21 11.180 9.148 -7.307 1.00 0.72 H new ATOM 0 HG2 LYS A 21 11.137 11.480 -6.478 1.00 1.09 H new ATOM 0 HG3 LYS A 21 12.137 11.049 -5.105 1.00 1.09 H new ATOM 0 HD2 LYS A 21 13.218 10.368 -7.847 1.00 1.24 H new ATOM 0 HD3 LYS A 21 13.193 12.064 -7.406 1.00 1.24 H new ATOM 0 HE2 LYS A 21 14.416 9.884 -5.638 1.00 1.80 H new ATOM 0 HE3 LYS A 21 15.347 10.840 -6.773 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 15.546 12.100 -4.882 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 14.160 12.822 -5.547 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 14.008 11.690 -4.291 1.00 2.40 H new ATOM 288 N THR A 22 10.019 6.711 -5.839 1.00 0.53 N ATOM 289 CA THR A 22 9.249 5.549 -6.360 1.00 0.52 C ATOM 290 C THR A 22 8.040 5.301 -5.460 1.00 0.45 C ATOM 291 O THR A 22 6.957 5.004 -5.924 1.00 0.48 O ATOM 292 CB THR A 22 10.154 4.311 -6.365 1.00 0.55 C ATOM 293 OG1 THR A 22 11.396 4.634 -6.978 1.00 0.64 O ATOM 294 CG2 THR A 22 9.481 3.179 -7.141 1.00 0.62 C ATOM 0 H THR A 22 10.950 6.493 -5.482 1.00 0.53 H new ATOM 0 HA THR A 22 8.906 5.754 -7.374 1.00 0.52 H new ATOM 0 HB THR A 22 10.326 3.988 -5.338 1.00 0.55 H new ATOM 0 HG1 THR A 22 12.124 4.184 -6.500 1.00 0.64 H new ATOM 0 HG21 THR A 22 10.129 2.302 -7.141 1.00 0.62 H new ATOM 0 HG22 THR A 22 8.531 2.928 -6.668 1.00 0.62 H new ATOM 0 HG23 THR A 22 9.302 3.498 -8.168 1.00 0.62 H new ATOM 302 N GLY A 23 8.218 5.415 -4.174 1.00 0.42 N ATOM 303 CA GLY A 23 7.083 5.181 -3.238 1.00 0.43 C ATOM 304 C GLY A 23 5.921 6.124 -3.567 1.00 0.41 C ATOM 305 O GLY A 23 4.779 5.713 -3.626 1.00 0.47 O ATOM 0 H GLY A 23 9.102 5.661 -3.729 1.00 0.42 H new ATOM 0 HA2 GLY A 23 6.751 4.145 -3.309 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.411 5.341 -2.211 1.00 0.43 H new ATOM 309 N ALA A 24 6.196 7.382 -3.780 1.00 0.40 N ATOM 310 CA ALA A 24 5.099 8.341 -4.103 1.00 0.41 C ATOM 311 C ALA A 24 4.597 8.115 -5.527 1.00 0.41 C ATOM 312 O ALA A 24 3.515 8.543 -5.881 1.00 0.41 O ATOM 313 CB ALA A 24 5.629 9.772 -4.000 1.00 0.42 C ATOM 0 H ALA A 24 7.131 7.788 -3.745 1.00 0.40 H new ATOM 0 HA ALA A 24 4.282 8.184 -3.399 1.00 0.41 H new ATOM 0 HB1 ALA A 24 4.829 10.474 -4.236 1.00 0.42 H new ATOM 0 HB2 ALA A 24 5.986 9.956 -2.987 1.00 0.42 H new ATOM 0 HB3 ALA A 24 6.450 9.908 -4.704 1.00 0.42 H new ATOM 319 N LEU A 25 5.366 7.446 -6.357 1.00 0.42 N ATOM 320 CA LEU A 25 4.898 7.217 -7.760 1.00 0.44 C ATOM 321 C LEU A 25 4.034 5.961 -7.769 1.00 0.44 C ATOM 322 O LEU A 25 2.933 5.955 -8.283 1.00 0.46 O ATOM 323 CB LEU A 25 6.092 7.058 -8.708 1.00 0.47 C ATOM 324 CG LEU A 25 6.770 8.423 -8.939 1.00 0.77 C ATOM 325 CD1 LEU A 25 8.212 8.210 -9.408 1.00 1.58 C ATOM 326 CD2 LEU A 25 6.017 9.223 -10.014 1.00 1.67 C ATOM 0 H LEU A 25 6.280 7.056 -6.128 1.00 0.42 H new ATOM 0 HA LEU A 25 4.318 8.073 -8.106 1.00 0.44 H new ATOM 0 HB2 LEU A 25 6.809 6.353 -8.287 1.00 0.47 H new ATOM 0 HB3 LEU A 25 5.758 6.643 -9.659 1.00 0.47 H new ATOM 0 HG LEU A 25 6.757 8.976 -8.000 1.00 0.77 H new ATOM 0 HD11 LEU A 25 8.688 9.177 -9.570 1.00 1.58 H new ATOM 0 HD12 LEU A 25 8.764 7.657 -8.648 1.00 1.58 H new ATOM 0 HD13 LEU A 25 8.212 7.645 -10.340 1.00 1.58 H new ATOM 0 HD21 LEU A 25 6.509 10.184 -10.164 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.018 8.665 -10.950 1.00 1.67 H new ATOM 0 HD23 LEU A 25 4.989 9.389 -9.691 1.00 1.67 H new ATOM 338 N LEU A 26 4.541 4.883 -7.230 1.00 0.45 N ATOM 339 CA LEU A 26 3.768 3.615 -7.228 1.00 0.47 C ATOM 340 C LEU A 26 2.351 3.862 -6.723 1.00 0.49 C ATOM 341 O LEU A 26 1.386 3.552 -7.393 1.00 0.52 O ATOM 342 CB LEU A 26 4.476 2.579 -6.323 1.00 0.51 C ATOM 343 CG LEU A 26 5.693 1.971 -7.052 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.546 1.164 -6.070 1.00 1.17 C ATOM 345 CD2 LEU A 26 5.190 1.057 -8.182 1.00 1.35 C ATOM 0 H LEU A 26 5.460 4.830 -6.791 1.00 0.45 H new ATOM 0 HA LEU A 26 3.714 3.230 -8.246 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.799 3.056 -5.398 1.00 0.51 H new ATOM 0 HB3 LEU A 26 3.777 1.789 -6.048 1.00 0.51 H new ATOM 0 HG LEU A 26 6.306 2.770 -7.468 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.402 0.740 -6.595 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.898 1.817 -5.271 1.00 1.17 H new ATOM 0 HD13 LEU A 26 5.947 0.360 -5.643 1.00 1.17 H new ATOM 0 HD21 LEU A 26 6.042 0.622 -8.704 1.00 1.35 H new ATOM 0 HD22 LEU A 26 4.577 0.260 -7.760 1.00 1.35 H new ATOM 0 HD23 LEU A 26 4.594 1.640 -8.884 1.00 1.35 H new ATOM 357 N LEU A 27 2.207 4.394 -5.547 1.00 0.50 N ATOM 358 CA LEU A 27 0.835 4.619 -5.027 1.00 0.56 C ATOM 359 C LEU A 27 0.104 5.592 -5.956 1.00 0.56 C ATOM 360 O LEU A 27 -1.028 5.362 -6.333 1.00 0.60 O ATOM 361 CB LEU A 27 0.907 5.170 -3.599 1.00 0.64 C ATOM 362 CG LEU A 27 -0.497 5.300 -2.990 1.00 0.95 C ATOM 363 CD1 LEU A 27 -1.061 3.915 -2.643 1.00 1.66 C ATOM 364 CD2 LEU A 27 -0.407 6.148 -1.716 1.00 1.42 C ATOM 0 H LEU A 27 2.967 4.680 -4.930 1.00 0.50 H new ATOM 0 HA LEU A 27 0.284 3.679 -4.999 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.516 4.511 -2.981 1.00 0.64 H new ATOM 0 HB3 LEU A 27 1.397 6.144 -3.605 1.00 0.64 H new ATOM 0 HG LEU A 27 -1.160 5.775 -3.713 1.00 0.95 H new ATOM 0 HD11 LEU A 27 -2.056 4.025 -2.212 1.00 1.66 H new ATOM 0 HD12 LEU A 27 -1.122 3.310 -3.548 1.00 1.66 H new ATOM 0 HD13 LEU A 27 -0.406 3.426 -1.922 1.00 1.66 H new ATOM 0 HD21 LEU A 27 -1.399 6.247 -1.274 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.261 5.664 -1.003 1.00 1.42 H new ATOM 0 HD23 LEU A 27 -0.019 7.136 -1.963 1.00 1.42 H new ATOM 376 N GLN A 28 0.725 6.677 -6.329 1.00 0.55 N ATOM 377 CA GLN A 28 0.037 7.644 -7.228 1.00 0.58 C ATOM 378 C GLN A 28 -0.295 6.967 -8.561 1.00 0.54 C ATOM 379 O GLN A 28 -1.287 7.267 -9.196 1.00 0.58 O ATOM 380 CB GLN A 28 0.962 8.833 -7.489 1.00 0.60 C ATOM 381 CG GLN A 28 0.195 9.909 -8.257 1.00 1.00 C ATOM 382 CD GLN A 28 1.089 11.134 -8.455 1.00 1.40 C ATOM 383 OE1 GLN A 28 1.824 11.214 -9.419 1.00 2.09 O ATOM 384 NE2 GLN A 28 1.057 12.100 -7.577 1.00 1.91 N ATOM 0 H GLN A 28 1.672 6.934 -6.052 1.00 0.55 H new ATOM 0 HA GLN A 28 -0.884 7.984 -6.754 1.00 0.58 H new ATOM 0 HB2 GLN A 28 1.331 9.236 -6.546 1.00 0.60 H new ATOM 0 HB3 GLN A 28 1.833 8.513 -8.061 1.00 0.60 H new ATOM 0 HG2 GLN A 28 -0.126 9.521 -9.224 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -0.706 10.188 -7.710 1.00 1.00 H new ATOM 0 HE21 GLN A 28 0.440 12.033 -6.768 1.00 1.91 H new ATOM 0 HE22 GLN A 28 1.649 12.921 -7.701 1.00 1.91 H new ATOM 393 N GLY A 29 0.548 6.066 -8.997 1.00 0.50 N ATOM 394 CA GLY A 29 0.312 5.375 -10.298 1.00 0.48 C ATOM 395 C GLY A 29 -0.900 4.447 -10.197 1.00 0.44 C ATOM 396 O GLY A 29 -1.885 4.624 -10.886 1.00 0.50 O ATOM 0 H GLY A 29 1.394 5.779 -8.504 1.00 0.50 H new ATOM 0 HA2 GLY A 29 0.149 6.112 -11.084 1.00 0.48 H new ATOM 0 HA3 GLY A 29 1.195 4.801 -10.578 1.00 0.48 H new ATOM 400 N PHE A 30 -0.834 3.450 -9.356 1.00 0.44 N ATOM 401 CA PHE A 30 -1.985 2.511 -9.234 1.00 0.43 C ATOM 402 C PHE A 30 -3.269 3.310 -9.013 1.00 0.40 C ATOM 403 O PHE A 30 -4.362 2.817 -9.230 1.00 0.43 O ATOM 404 CB PHE A 30 -1.756 1.555 -8.057 1.00 0.47 C ATOM 405 CG PHE A 30 -2.965 0.658 -7.884 1.00 0.47 C ATOM 406 CD1 PHE A 30 -3.344 -0.214 -8.915 1.00 1.20 C ATOM 407 CD2 PHE A 30 -3.706 0.692 -6.693 1.00 1.39 C ATOM 408 CE1 PHE A 30 -4.458 -1.046 -8.756 1.00 1.21 C ATOM 409 CE2 PHE A 30 -4.821 -0.141 -6.537 1.00 1.42 C ATOM 410 CZ PHE A 30 -5.197 -1.010 -7.568 1.00 0.58 C ATOM 0 H PHE A 30 -0.038 3.246 -8.752 1.00 0.44 H new ATOM 0 HA PHE A 30 -2.075 1.927 -10.150 1.00 0.43 H new ATOM 0 HB2 PHE A 30 -0.866 0.951 -8.234 1.00 0.47 H new ATOM 0 HB3 PHE A 30 -1.579 2.123 -7.144 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -2.775 -0.243 -9.833 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -3.416 1.361 -5.896 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -4.748 -1.717 -9.551 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -5.391 -0.113 -5.620 1.00 1.42 H new ATOM 0 HZ PHE A 30 -6.057 -1.652 -7.447 1.00 0.58 H new ATOM 420 N ILE A 31 -3.159 4.549 -8.614 1.00 0.40 N ATOM 421 CA ILE A 31 -4.383 5.376 -8.408 1.00 0.40 C ATOM 422 C ILE A 31 -4.795 5.978 -9.759 1.00 0.40 C ATOM 423 O ILE A 31 -5.916 5.821 -10.201 1.00 0.43 O ATOM 424 CB ILE A 31 -4.072 6.482 -7.384 1.00 0.41 C ATOM 425 CG1 ILE A 31 -4.027 5.869 -5.982 1.00 0.53 C ATOM 426 CG2 ILE A 31 -5.140 7.580 -7.424 1.00 0.72 C ATOM 427 CD1 ILE A 31 -3.435 6.878 -4.995 1.00 0.48 C ATOM 0 H ILE A 31 -2.277 5.023 -8.422 1.00 0.40 H new ATOM 0 HA ILE A 31 -5.204 4.771 -8.024 1.00 0.40 H new ATOM 0 HB ILE A 31 -3.109 6.928 -7.632 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -5.031 5.584 -5.667 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -3.426 4.960 -5.992 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.898 8.350 -6.691 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -5.169 8.023 -8.420 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -6.113 7.149 -7.189 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -3.405 6.437 -3.998 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -2.424 7.141 -5.306 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -4.054 7.775 -4.977 1.00 0.48 H new ATOM 439 N GLN A 32 -3.908 6.685 -10.405 1.00 0.42 N ATOM 440 CA GLN A 32 -4.259 7.318 -11.712 1.00 0.47 C ATOM 441 C GLN A 32 -4.734 6.262 -12.723 1.00 0.50 C ATOM 442 O GLN A 32 -5.757 6.417 -13.359 1.00 0.61 O ATOM 443 CB GLN A 32 -3.023 8.043 -12.261 1.00 0.57 C ATOM 444 CG GLN A 32 -3.316 8.637 -13.646 1.00 1.19 C ATOM 445 CD GLN A 32 -4.536 9.558 -13.572 1.00 1.59 C ATOM 446 OE1 GLN A 32 -5.661 9.100 -13.605 1.00 2.16 O ATOM 447 NE2 GLN A 32 -4.359 10.847 -13.473 1.00 2.21 N ATOM 0 H GLN A 32 -2.954 6.853 -10.085 1.00 0.42 H new ATOM 0 HA GLN A 32 -5.072 8.027 -11.556 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -2.725 8.836 -11.575 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -2.186 7.348 -12.327 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -2.450 9.195 -14.002 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -3.497 7.837 -14.363 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -3.415 11.231 -13.445 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -5.165 11.470 -13.423 1.00 2.21 H new ATOM 456 N ASP A 33 -3.988 5.198 -12.888 1.00 0.49 N ATOM 457 CA ASP A 33 -4.379 4.138 -13.869 1.00 0.58 C ATOM 458 C ASP A 33 -5.764 3.572 -13.537 1.00 0.61 C ATOM 459 O ASP A 33 -6.602 3.416 -14.402 1.00 0.70 O ATOM 460 CB ASP A 33 -3.344 3.006 -13.819 1.00 0.61 C ATOM 461 CG ASP A 33 -3.397 2.313 -12.462 1.00 1.10 C ATOM 462 OD1 ASP A 33 -3.758 2.968 -11.506 1.00 1.78 O ATOM 463 OD2 ASP A 33 -3.073 1.138 -12.404 1.00 1.89 O ATOM 0 H ASP A 33 -3.121 5.017 -12.383 1.00 0.49 H new ATOM 0 HA ASP A 33 -4.414 4.577 -14.866 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -3.542 2.286 -14.613 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -2.345 3.407 -13.994 1.00 0.61 H new ATOM 468 N ARG A 34 -6.013 3.261 -12.292 1.00 0.58 N ATOM 469 CA ARG A 34 -7.344 2.704 -11.908 1.00 0.71 C ATOM 470 C ARG A 34 -8.359 3.844 -11.738 1.00 0.65 C ATOM 471 O ARG A 34 -9.545 3.607 -11.630 1.00 0.85 O ATOM 472 CB ARG A 34 -7.203 1.911 -10.601 1.00 0.85 C ATOM 473 CG ARG A 34 -8.472 1.089 -10.332 1.00 1.25 C ATOM 474 CD ARG A 34 -8.361 0.371 -8.973 1.00 1.31 C ATOM 475 NE ARG A 34 -9.027 -0.967 -9.051 1.00 1.58 N ATOM 476 CZ ARG A 34 -10.217 -1.103 -9.578 1.00 2.09 C ATOM 477 NH1 ARG A 34 -10.913 -0.057 -9.928 1.00 2.58 N ATOM 478 NH2 ARG A 34 -10.732 -2.294 -9.712 1.00 2.75 N ATOM 0 H ARG A 34 -5.351 3.369 -11.523 1.00 0.58 H new ATOM 0 HA ARG A 34 -7.703 2.038 -12.692 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -6.339 1.249 -10.662 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -7.023 2.595 -9.771 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -9.345 1.742 -10.337 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -8.616 0.358 -11.127 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -7.313 0.250 -8.700 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -8.826 0.974 -8.193 1.00 1.31 H new ATOM 0 HE ARG A 34 -8.544 -1.788 -8.687 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -10.531 0.879 -9.792 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -11.840 -0.175 -10.338 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -10.207 -3.114 -9.407 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -11.659 -2.405 -10.122 1.00 2.75 H new ATOM 492 N ALA A 35 -7.938 5.076 -11.744 1.00 0.59 N ATOM 493 CA ALA A 35 -8.943 6.173 -11.604 1.00 0.66 C ATOM 494 C ALA A 35 -9.802 6.215 -12.881 1.00 0.80 C ATOM 495 O ALA A 35 -10.883 6.770 -12.908 1.00 0.88 O ATOM 496 CB ALA A 35 -8.233 7.509 -11.396 1.00 0.94 C ATOM 0 H ALA A 35 -6.966 5.371 -11.837 1.00 0.59 H new ATOM 0 HA ALA A 35 -9.580 5.988 -10.739 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.973 8.303 -11.295 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -7.626 7.462 -10.492 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -7.592 7.718 -12.253 1.00 0.94 H new ATOM 502 N GLY A 36 -9.318 5.590 -13.922 1.00 1.15 N ATOM 503 CA GLY A 36 -10.079 5.534 -15.204 1.00 1.62 C ATOM 504 C GLY A 36 -9.127 5.544 -16.396 1.00 1.54 C ATOM 505 O GLY A 36 -8.042 5.000 -16.355 1.00 2.10 O ATOM 0 H GLY A 36 -8.418 5.111 -13.938 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -10.693 4.633 -15.230 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -10.758 6.384 -15.267 1.00 1.62 H new ATOM 509 N ARG A 37 -9.548 6.158 -17.463 1.00 2.07 N ATOM 510 CA ARG A 37 -8.706 6.220 -18.691 1.00 2.87 C ATOM 511 C ARG A 37 -7.657 7.324 -18.533 1.00 3.46 C ATOM 512 O ARG A 37 -7.434 8.110 -19.431 1.00 4.10 O ATOM 513 CB ARG A 37 -9.600 6.533 -19.905 1.00 3.63 C ATOM 514 CG ARG A 37 -8.883 6.113 -21.194 1.00 4.34 C ATOM 515 CD ARG A 37 -9.600 6.708 -22.408 1.00 5.18 C ATOM 516 NE ARG A 37 -11.059 6.419 -22.317 1.00 5.74 N ATOM 517 CZ ARG A 37 -11.900 7.056 -23.085 1.00 6.53 C ATOM 518 NH1 ARG A 37 -11.462 7.941 -23.939 1.00 6.88 N ATOM 519 NH2 ARG A 37 -13.178 6.808 -23.000 1.00 7.21 N ATOM 0 H ARG A 37 -10.451 6.626 -17.539 1.00 2.07 H new ATOM 0 HA ARG A 37 -8.207 5.263 -18.842 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -10.549 6.005 -19.816 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -9.830 7.598 -19.935 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -7.847 6.452 -21.171 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -8.861 5.026 -21.270 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -9.434 7.784 -22.450 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -9.192 6.287 -23.327 1.00 5.18 H new ATOM 0 HE ARG A 37 -11.400 5.723 -21.654 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -10.463 8.134 -24.006 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -12.119 8.439 -24.539 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -13.520 6.116 -22.333 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -13.835 7.306 -23.600 1.00 7.21 H new ATOM 533 N MET A 38 -7.023 7.399 -17.394 1.00 3.74 N ATOM 534 CA MET A 38 -6.002 8.464 -17.179 1.00 4.68 C ATOM 535 C MET A 38 -6.617 9.822 -17.527 1.00 4.70 C ATOM 536 O MET A 38 -6.072 10.581 -18.304 1.00 5.17 O ATOM 537 CB MET A 38 -4.789 8.206 -18.081 1.00 5.62 C ATOM 538 CG MET A 38 -4.133 6.877 -17.695 1.00 5.93 C ATOM 539 SD MET A 38 -5.135 5.502 -18.321 1.00 6.79 S ATOM 540 CE MET A 38 -4.131 5.105 -19.776 1.00 7.04 C ATOM 0 H MET A 38 -7.168 6.770 -16.604 1.00 3.74 H new ATOM 0 HA MET A 38 -5.681 8.459 -16.137 1.00 4.68 H new ATOM 0 HB2 MET A 38 -5.099 8.180 -19.126 1.00 5.62 H new ATOM 0 HB3 MET A 38 -4.070 9.020 -17.982 1.00 5.62 H new ATOM 0 HG2 MET A 38 -3.125 6.824 -18.107 1.00 5.93 H new ATOM 0 HG3 MET A 38 -4.038 6.808 -16.611 1.00 5.93 H new ATOM 0 HE1 MET A 38 -4.582 4.270 -20.312 1.00 7.04 H new ATOM 0 HE2 MET A 38 -4.082 5.974 -20.433 1.00 7.04 H new ATOM 0 HE3 MET A 38 -3.124 4.832 -19.460 1.00 7.04 H new ATOM 550 N GLY A 39 -7.749 10.132 -16.955 1.00 4.57 N ATOM 551 CA GLY A 39 -8.404 11.439 -17.247 1.00 4.85 C ATOM 552 C GLY A 39 -7.405 12.576 -17.031 1.00 4.67 C ATOM 553 O GLY A 39 -7.246 13.079 -15.937 1.00 4.95 O ATOM 0 H GLY A 39 -8.249 9.535 -16.297 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -8.768 11.453 -18.274 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -9.270 11.575 -16.600 1.00 4.85 H new ATOM 557 N GLY A 40 -6.729 12.983 -18.068 1.00 4.58 N ATOM 558 CA GLY A 40 -5.738 14.084 -17.927 1.00 4.69 C ATOM 559 C GLY A 40 -6.461 15.398 -17.621 1.00 4.20 C ATOM 560 O GLY A 40 -7.489 15.422 -16.974 1.00 4.34 O ATOM 0 H GLY A 40 -6.820 12.600 -19.009 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -5.034 13.851 -17.128 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -5.158 14.183 -18.844 1.00 4.69 H new ATOM 564 N GLU A 41 -5.931 16.488 -18.099 1.00 4.01 N ATOM 565 CA GLU A 41 -6.571 17.813 -17.861 1.00 3.88 C ATOM 566 C GLU A 41 -6.978 17.946 -16.396 1.00 3.63 C ATOM 567 O GLU A 41 -7.797 18.773 -16.049 1.00 4.16 O ATOM 568 CB GLU A 41 -7.813 17.934 -18.740 1.00 4.26 C ATOM 569 CG GLU A 41 -7.393 17.892 -20.209 1.00 4.51 C ATOM 570 CD GLU A 41 -8.626 18.045 -21.099 1.00 4.90 C ATOM 571 OE1 GLU A 41 -9.671 18.392 -20.574 1.00 5.28 O ATOM 572 OE2 GLU A 41 -8.505 17.811 -22.290 1.00 5.19 O ATOM 0 H GLU A 41 -5.073 16.519 -18.650 1.00 4.01 H new ATOM 0 HA GLU A 41 -5.860 18.602 -18.106 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -8.507 17.122 -18.524 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -8.336 18.866 -18.525 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -6.681 18.690 -20.417 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -6.889 16.950 -20.427 1.00 4.51 H new ATOM 579 N ALA A 42 -6.445 17.101 -15.547 1.00 3.19 N ATOM 580 CA ALA A 42 -6.816 17.136 -14.097 1.00 3.24 C ATOM 581 C ALA A 42 -5.631 17.632 -13.239 1.00 2.77 C ATOM 582 O ALA A 42 -4.819 16.827 -12.827 1.00 3.06 O ATOM 583 CB ALA A 42 -7.164 15.727 -13.624 1.00 4.08 C ATOM 0 H ALA A 42 -5.764 16.384 -15.798 1.00 3.19 H new ATOM 0 HA ALA A 42 -7.665 17.811 -13.986 1.00 3.24 H new ATOM 0 HB1 ALA A 42 -7.434 15.754 -12.568 1.00 4.08 H new ATOM 0 HB2 ALA A 42 -8.005 15.346 -14.204 1.00 4.08 H new ATOM 0 HB3 ALA A 42 -6.302 15.074 -13.762 1.00 4.08 H new ATOM 589 N PRO A 43 -5.560 18.922 -12.958 1.00 2.70 N ATOM 590 CA PRO A 43 -4.475 19.470 -12.114 1.00 3.03 C ATOM 591 C PRO A 43 -4.583 18.918 -10.681 1.00 2.67 C ATOM 592 O PRO A 43 -4.109 19.524 -9.741 1.00 2.87 O ATOM 593 CB PRO A 43 -4.690 21.003 -12.133 1.00 3.84 C ATOM 594 CG PRO A 43 -5.964 21.289 -12.976 1.00 3.86 C ATOM 595 CD PRO A 43 -6.522 19.933 -13.450 1.00 3.12 C ATOM 0 HA PRO A 43 -3.486 19.196 -12.480 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -4.808 21.386 -11.119 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -3.824 21.506 -12.565 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -6.706 21.821 -12.381 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -5.724 21.924 -13.829 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -7.519 19.756 -13.048 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -6.606 19.900 -14.536 1.00 3.12 H new ATOM 603 N GLU A 44 -5.190 17.776 -10.506 1.00 2.45 N ATOM 604 CA GLU A 44 -5.310 17.202 -9.137 1.00 2.23 C ATOM 605 C GLU A 44 -3.961 16.617 -8.712 1.00 1.75 C ATOM 606 O GLU A 44 -3.217 17.224 -7.967 1.00 2.00 O ATOM 607 CB GLU A 44 -6.369 16.098 -9.140 1.00 2.55 C ATOM 608 CG GLU A 44 -6.566 15.574 -7.716 1.00 2.70 C ATOM 609 CD GLU A 44 -7.683 14.529 -7.707 1.00 3.17 C ATOM 610 OE1 GLU A 44 -8.837 14.924 -7.737 1.00 3.42 O ATOM 611 OE2 GLU A 44 -7.365 13.351 -7.671 1.00 3.77 O ATOM 0 H GLU A 44 -5.607 17.217 -11.250 1.00 2.45 H new ATOM 0 HA GLU A 44 -5.604 17.984 -8.437 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -7.311 16.484 -9.530 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -6.061 15.286 -9.798 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -5.639 15.134 -7.347 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -6.817 16.396 -7.046 1.00 2.70 H new ATOM 618 N LEU A 45 -3.636 15.439 -9.182 1.00 1.80 N ATOM 619 CA LEU A 45 -2.332 14.809 -8.808 1.00 1.80 C ATOM 620 C LEU A 45 -1.264 15.207 -9.836 1.00 2.29 C ATOM 621 O LEU A 45 -0.441 14.411 -10.242 1.00 3.01 O ATOM 622 CB LEU A 45 -2.488 13.274 -8.746 1.00 2.23 C ATOM 623 CG LEU A 45 -3.537 12.799 -9.756 1.00 2.52 C ATOM 624 CD1 LEU A 45 -3.116 13.205 -11.170 1.00 3.22 C ATOM 625 CD2 LEU A 45 -3.649 11.276 -9.677 1.00 3.00 C ATOM 0 H LEU A 45 -4.218 14.885 -9.810 1.00 1.80 H new ATOM 0 HA LEU A 45 -2.022 15.160 -7.824 1.00 1.80 H new ATOM 0 HB2 LEU A 45 -1.531 12.797 -8.956 1.00 2.23 H new ATOM 0 HB3 LEU A 45 -2.781 12.973 -7.740 1.00 2.23 H new ATOM 0 HG LEU A 45 -4.499 13.255 -9.525 1.00 2.52 H new ATOM 0 HD11 LEU A 45 -3.865 12.865 -11.885 1.00 3.22 H new ATOM 0 HD12 LEU A 45 -3.028 14.290 -11.226 1.00 3.22 H new ATOM 0 HD13 LEU A 45 -2.155 12.750 -11.408 1.00 3.22 H new ATOM 0 HD21 LEU A 45 -4.394 10.928 -10.393 1.00 3.00 H new ATOM 0 HD22 LEU A 45 -2.684 10.828 -9.911 1.00 3.00 H new ATOM 0 HD23 LEU A 45 -3.950 10.985 -8.670 1.00 3.00 H new ATOM 637 N ALA A 46 -1.266 16.446 -10.243 1.00 2.46 N ATOM 638 CA ALA A 46 -0.251 16.923 -11.226 1.00 3.15 C ATOM 639 C ALA A 46 1.148 16.592 -10.702 1.00 2.91 C ATOM 640 O ALA A 46 1.709 17.337 -9.922 1.00 3.07 O ATOM 641 CB ALA A 46 -0.365 18.442 -11.351 1.00 4.05 C ATOM 0 H ALA A 46 -1.932 17.154 -9.935 1.00 2.46 H new ATOM 0 HA ALA A 46 -0.418 16.443 -12.190 1.00 3.15 H new ATOM 0 HB1 ALA A 46 0.372 18.804 -12.067 1.00 4.05 H new ATOM 0 HB2 ALA A 46 -1.365 18.705 -11.695 1.00 4.05 H new ATOM 0 HB3 ALA A 46 -0.183 18.902 -10.379 1.00 4.05 H new ATOM 647 N LEU A 47 1.732 15.496 -11.113 1.00 3.18 N ATOM 648 CA LEU A 47 3.092 15.162 -10.622 1.00 3.43 C ATOM 649 C LEU A 47 3.831 14.359 -11.692 1.00 3.14 C ATOM 650 O LEU A 47 3.610 14.513 -12.876 1.00 3.51 O ATOM 651 CB LEU A 47 2.982 14.349 -9.311 1.00 4.05 C ATOM 652 CG LEU A 47 4.187 14.639 -8.386 1.00 4.77 C ATOM 653 CD1 LEU A 47 3.942 15.922 -7.580 1.00 5.26 C ATOM 654 CD2 LEU A 47 4.379 13.474 -7.409 1.00 5.35 C ATOM 0 H LEU A 47 1.325 14.824 -11.764 1.00 3.18 H new ATOM 0 HA LEU A 47 3.650 16.076 -10.419 1.00 3.43 H new ATOM 0 HB2 LEU A 47 2.054 14.601 -8.798 1.00 4.05 H new ATOM 0 HB3 LEU A 47 2.941 13.284 -9.540 1.00 4.05 H new ATOM 0 HG LEU A 47 5.077 14.761 -9.004 1.00 4.77 H new ATOM 0 HD11 LEU A 47 4.798 16.114 -6.933 1.00 5.26 H new ATOM 0 HD12 LEU A 47 3.808 16.761 -8.263 1.00 5.26 H new ATOM 0 HD13 LEU A 47 3.046 15.803 -6.971 1.00 5.26 H new ATOM 0 HD21 LEU A 47 5.229 13.681 -6.758 1.00 5.35 H new ATOM 0 HD22 LEU A 47 3.480 13.354 -6.805 1.00 5.35 H new ATOM 0 HD23 LEU A 47 4.565 12.557 -7.968 1.00 5.35 H new ATOM 666 N ASP A 48 4.730 13.529 -11.267 1.00 3.02 N ATOM 667 CA ASP A 48 5.538 12.727 -12.223 1.00 3.07 C ATOM 668 C ASP A 48 6.086 13.633 -13.343 1.00 2.77 C ATOM 669 O ASP A 48 5.878 13.347 -14.506 1.00 2.85 O ATOM 670 CB ASP A 48 4.658 11.634 -12.832 1.00 3.61 C ATOM 671 CG ASP A 48 5.520 10.686 -13.667 1.00 4.22 C ATOM 672 OD1 ASP A 48 6.268 9.923 -13.078 1.00 4.69 O ATOM 673 OD2 ASP A 48 5.417 10.740 -14.881 1.00 4.68 O ATOM 0 H ASP A 48 4.945 13.367 -10.283 1.00 3.02 H new ATOM 0 HA ASP A 48 6.376 12.274 -11.694 1.00 3.07 H new ATOM 0 HB2 ASP A 48 4.151 11.080 -12.042 1.00 3.61 H new ATOM 0 HB3 ASP A 48 3.884 12.082 -13.455 1.00 3.61 H new ATOM 678 N PRO A 49 6.780 14.699 -12.975 1.00 3.11 N ATOM 679 CA PRO A 49 7.358 15.631 -13.971 1.00 3.40 C ATOM 680 C PRO A 49 8.563 14.969 -14.644 1.00 3.08 C ATOM 681 O PRO A 49 9.245 15.568 -15.452 1.00 3.32 O ATOM 682 CB PRO A 49 7.835 16.843 -13.135 1.00 4.36 C ATOM 683 CG PRO A 49 7.807 16.412 -11.641 1.00 4.66 C ATOM 684 CD PRO A 49 7.051 15.069 -11.562 1.00 3.86 C ATOM 0 HA PRO A 49 6.648 15.911 -14.749 1.00 3.40 H new ATOM 0 HB2 PRO A 49 8.841 17.142 -13.430 1.00 4.36 H new ATOM 0 HB3 PRO A 49 7.186 17.703 -13.299 1.00 4.36 H new ATOM 0 HG2 PRO A 49 8.820 16.305 -11.253 1.00 4.66 H new ATOM 0 HG3 PRO A 49 7.311 17.168 -11.033 1.00 4.66 H new ATOM 0 HD2 PRO A 49 7.650 14.308 -11.062 1.00 3.86 H new ATOM 0 HD3 PRO A 49 6.125 15.169 -10.995 1.00 3.86 H new ATOM 692 N VAL A 50 8.830 13.745 -14.308 1.00 3.08 N ATOM 693 CA VAL A 50 9.991 13.047 -14.908 1.00 3.10 C ATOM 694 C VAL A 50 9.927 11.526 -14.613 1.00 2.75 C ATOM 695 O VAL A 50 10.509 11.052 -13.661 1.00 2.91 O ATOM 696 CB VAL A 50 11.295 13.655 -14.364 1.00 3.88 C ATOM 697 CG1 VAL A 50 11.269 13.732 -12.835 1.00 4.44 C ATOM 698 CG2 VAL A 50 12.493 12.818 -14.835 1.00 4.50 C ATOM 0 H VAL A 50 8.291 13.195 -13.640 1.00 3.08 H new ATOM 0 HA VAL A 50 9.965 13.178 -15.990 1.00 3.10 H new ATOM 0 HB VAL A 50 11.391 14.670 -14.750 1.00 3.88 H new ATOM 0 HG11 VAL A 50 12.203 14.165 -12.477 1.00 4.44 H new ATOM 0 HG12 VAL A 50 10.434 14.355 -12.516 1.00 4.44 H new ATOM 0 HG13 VAL A 50 11.152 12.730 -12.422 1.00 4.44 H new ATOM 0 HG21 VAL A 50 13.415 13.252 -14.448 1.00 4.50 H new ATOM 0 HG22 VAL A 50 12.390 11.797 -14.468 1.00 4.50 H new ATOM 0 HG23 VAL A 50 12.526 12.810 -15.924 1.00 4.50 H new ATOM 708 N PRO A 51 9.269 10.778 -15.493 1.00 2.91 N ATOM 709 CA PRO A 51 9.203 9.303 -15.379 1.00 3.22 C ATOM 710 C PRO A 51 10.592 8.730 -15.677 1.00 2.93 C ATOM 711 O PRO A 51 11.393 8.578 -14.777 1.00 3.37 O ATOM 712 CB PRO A 51 8.194 8.855 -16.456 1.00 4.09 C ATOM 713 CG PRO A 51 8.020 10.046 -17.423 1.00 4.27 C ATOM 714 CD PRO A 51 8.540 11.302 -16.689 1.00 3.50 C ATOM 0 HA PRO A 51 8.900 8.964 -14.388 1.00 3.22 H new ATOM 0 HB2 PRO A 51 8.559 7.976 -16.987 1.00 4.09 H new ATOM 0 HB3 PRO A 51 7.241 8.581 -16.004 1.00 4.09 H new ATOM 0 HG2 PRO A 51 8.577 9.879 -18.345 1.00 4.27 H new ATOM 0 HG3 PRO A 51 6.973 10.167 -17.701 1.00 4.27 H new ATOM 0 HD2 PRO A 51 9.201 11.888 -17.328 1.00 3.50 H new ATOM 0 HD3 PRO A 51 7.719 11.956 -16.395 1.00 3.50 H new ATOM 722 N GLN A 52 10.881 8.370 -16.899 1.00 2.70 N ATOM 723 CA GLN A 52 12.216 7.765 -17.184 1.00 2.85 C ATOM 724 C GLN A 52 12.448 6.644 -16.169 1.00 2.14 C ATOM 725 O GLN A 52 12.978 6.892 -15.109 1.00 2.38 O ATOM 726 CB GLN A 52 13.309 8.822 -17.026 1.00 3.67 C ATOM 727 CG GLN A 52 13.077 9.949 -18.030 1.00 4.37 C ATOM 728 CD GLN A 52 14.216 10.963 -17.930 1.00 5.22 C ATOM 729 OE1 GLN A 52 14.494 11.482 -16.866 1.00 5.74 O ATOM 730 NE2 GLN A 52 14.893 11.270 -19.001 1.00 5.74 N ATOM 0 H GLN A 52 10.261 8.466 -17.703 1.00 2.70 H new ATOM 0 HA GLN A 52 12.245 7.378 -18.203 1.00 2.85 H new ATOM 0 HB2 GLN A 52 13.302 9.218 -16.011 1.00 3.67 H new ATOM 0 HB3 GLN A 52 14.289 8.374 -17.187 1.00 3.67 H new ATOM 0 HG2 GLN A 52 13.024 9.545 -19.041 1.00 4.37 H new ATOM 0 HG3 GLN A 52 12.123 10.437 -17.831 1.00 4.37 H new ATOM 0 HE21 GLN A 52 14.660 10.835 -19.894 1.00 5.74 H new ATOM 0 HE22 GLN A 52 15.656 11.945 -18.946 1.00 5.74 H new ATOM 739 N ASP A 53 12.084 5.422 -16.506 1.00 1.78 N ATOM 740 CA ASP A 53 12.272 4.232 -15.601 1.00 1.30 C ATOM 741 C ASP A 53 11.061 3.312 -15.790 1.00 1.07 C ATOM 742 O ASP A 53 9.965 3.619 -15.363 1.00 1.19 O ATOM 743 CB ASP A 53 12.370 4.611 -14.112 1.00 1.65 C ATOM 744 CG ASP A 53 11.247 5.588 -13.750 1.00 2.27 C ATOM 745 OD1 ASP A 53 10.405 5.833 -14.598 1.00 2.80 O ATOM 746 OD2 ASP A 53 11.250 6.075 -12.631 1.00 2.91 O ATOM 0 H ASP A 53 11.650 5.194 -17.401 1.00 1.78 H new ATOM 0 HA ASP A 53 13.212 3.751 -15.870 1.00 1.30 H new ATOM 0 HB2 ASP A 53 12.299 3.716 -13.494 1.00 1.65 H new ATOM 0 HB3 ASP A 53 13.339 5.064 -13.906 1.00 1.65 H new ATOM 751 N ALA A 54 11.255 2.170 -16.406 1.00 0.91 N ATOM 752 CA ALA A 54 10.115 1.217 -16.600 1.00 0.84 C ATOM 753 C ALA A 54 10.072 0.271 -15.403 1.00 0.76 C ATOM 754 O ALA A 54 9.184 -0.547 -15.271 1.00 0.75 O ATOM 755 CB ALA A 54 10.281 0.423 -17.898 1.00 0.95 C ATOM 0 H ALA A 54 12.150 1.857 -16.782 1.00 0.91 H new ATOM 0 HA ALA A 54 9.181 1.775 -16.673 1.00 0.84 H new ATOM 0 HB1 ALA A 54 9.441 -0.262 -18.016 1.00 0.95 H new ATOM 0 HB2 ALA A 54 10.310 1.110 -18.744 1.00 0.95 H new ATOM 0 HB3 ALA A 54 11.210 -0.146 -17.860 1.00 0.95 H new ATOM 761 N SER A 55 10.988 0.434 -14.492 1.00 0.75 N ATOM 762 CA SER A 55 10.977 -0.389 -13.255 1.00 0.71 C ATOM 763 C SER A 55 9.627 -0.204 -12.565 1.00 0.66 C ATOM 764 O SER A 55 9.044 -1.133 -12.042 1.00 0.66 O ATOM 765 CB SER A 55 12.076 0.123 -12.324 1.00 0.76 C ATOM 766 OG SER A 55 13.343 -0.086 -12.937 1.00 1.37 O ATOM 0 H SER A 55 11.750 1.109 -14.553 1.00 0.75 H new ATOM 0 HA SER A 55 11.141 -1.440 -13.493 1.00 0.71 H new ATOM 0 HB2 SER A 55 11.929 1.183 -12.117 1.00 0.76 H new ATOM 0 HB3 SER A 55 12.031 -0.398 -11.368 1.00 0.76 H new ATOM 0 HG SER A 55 14.051 0.242 -12.345 1.00 1.37 H new ATOM 772 N THR A 56 9.139 1.008 -12.547 1.00 0.65 N ATOM 773 CA THR A 56 7.839 1.290 -11.877 1.00 0.62 C ATOM 774 C THR A 56 6.677 0.886 -12.789 1.00 0.59 C ATOM 775 O THR A 56 5.588 0.591 -12.330 1.00 0.57 O ATOM 776 CB THR A 56 7.758 2.791 -11.576 1.00 0.67 C ATOM 777 OG1 THR A 56 8.977 3.219 -10.986 1.00 1.09 O ATOM 778 CG2 THR A 56 6.604 3.069 -10.616 1.00 1.06 C ATOM 0 H THR A 56 9.589 1.819 -12.971 1.00 0.65 H new ATOM 0 HA THR A 56 7.772 0.717 -10.952 1.00 0.62 H new ATOM 0 HB THR A 56 7.588 3.334 -12.505 1.00 0.67 H new ATOM 0 HG1 THR A 56 8.928 4.179 -10.794 1.00 1.09 H new ATOM 0 HG21 THR A 56 6.554 4.138 -10.407 1.00 1.06 H new ATOM 0 HG22 THR A 56 5.668 2.743 -11.069 1.00 1.06 H new ATOM 0 HG23 THR A 56 6.766 2.525 -9.685 1.00 1.06 H new ATOM 786 N LYS A 57 6.888 0.882 -14.077 1.00 0.61 N ATOM 787 CA LYS A 57 5.779 0.515 -15.002 1.00 0.59 C ATOM 788 C LYS A 57 5.423 -0.964 -14.823 1.00 0.54 C ATOM 789 O LYS A 57 4.269 -1.317 -14.663 1.00 0.52 O ATOM 790 CB LYS A 57 6.209 0.783 -16.447 1.00 0.65 C ATOM 791 CG LYS A 57 5.134 0.276 -17.418 1.00 1.20 C ATOM 792 CD LYS A 57 5.445 0.760 -18.850 1.00 1.33 C ATOM 793 CE LYS A 57 4.793 2.124 -19.100 1.00 1.94 C ATOM 794 NZ LYS A 57 3.311 1.973 -19.077 1.00 2.73 N ATOM 0 H LYS A 57 7.774 1.115 -14.526 1.00 0.61 H new ATOM 0 HA LYS A 57 4.900 1.118 -14.774 1.00 0.59 H new ATOM 0 HB2 LYS A 57 6.370 1.851 -16.595 1.00 0.65 H new ATOM 0 HB3 LYS A 57 7.158 0.287 -16.651 1.00 0.65 H new ATOM 0 HG2 LYS A 57 5.095 -0.813 -17.394 1.00 1.20 H new ATOM 0 HG3 LYS A 57 4.153 0.637 -17.108 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.523 0.833 -18.991 1.00 1.33 H new ATOM 0 HD3 LYS A 57 5.077 0.034 -19.575 1.00 1.33 H new ATOM 0 HE2 LYS A 57 5.109 2.836 -18.338 1.00 1.94 H new ATOM 0 HE3 LYS A 57 5.115 2.523 -20.062 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 2.881 2.670 -19.718 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 3.055 1.014 -19.386 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 2.961 2.130 -18.110 1.00 2.73 H new ATOM 808 N LYS A 58 6.393 -1.837 -14.846 1.00 0.55 N ATOM 809 CA LYS A 58 6.080 -3.283 -14.675 1.00 0.53 C ATOM 810 C LYS A 58 5.501 -3.493 -13.274 1.00 0.48 C ATOM 811 O LYS A 58 4.559 -4.241 -13.086 1.00 0.46 O ATOM 812 CB LYS A 58 7.359 -4.111 -14.860 1.00 0.56 C ATOM 813 CG LYS A 58 7.008 -5.602 -14.912 1.00 0.78 C ATOM 814 CD LYS A 58 8.191 -6.394 -15.476 1.00 0.96 C ATOM 815 CE LYS A 58 7.782 -7.858 -15.649 1.00 0.85 C ATOM 816 NZ LYS A 58 8.878 -8.607 -16.326 1.00 1.75 N ATOM 0 H LYS A 58 7.380 -1.614 -14.975 1.00 0.55 H new ATOM 0 HA LYS A 58 5.352 -3.605 -15.419 1.00 0.53 H new ATOM 0 HB2 LYS A 58 7.865 -3.815 -15.779 1.00 0.56 H new ATOM 0 HB3 LYS A 58 8.050 -3.919 -14.039 1.00 0.56 H new ATOM 0 HG2 LYS A 58 6.761 -5.962 -13.913 1.00 0.78 H new ATOM 0 HG3 LYS A 58 6.126 -5.756 -15.534 1.00 0.78 H new ATOM 0 HD2 LYS A 58 8.501 -5.975 -16.434 1.00 0.96 H new ATOM 0 HD3 LYS A 58 9.046 -6.320 -14.804 1.00 0.96 H new ATOM 0 HE2 LYS A 58 7.569 -8.304 -14.677 1.00 0.85 H new ATOM 0 HE3 LYS A 58 6.866 -7.923 -16.237 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 8.598 -9.602 -16.443 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 9.060 -8.187 -17.260 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 9.742 -8.556 -15.749 1.00 1.75 H new ATOM 830 N LEU A 59 6.058 -2.862 -12.280 1.00 0.50 N ATOM 831 CA LEU A 59 5.520 -3.068 -10.908 1.00 0.47 C ATOM 832 C LEU A 59 4.040 -2.648 -10.892 1.00 0.43 C ATOM 833 O LEU A 59 3.278 -3.042 -10.031 1.00 0.42 O ATOM 834 CB LEU A 59 6.326 -2.227 -9.894 1.00 0.53 C ATOM 835 CG LEU A 59 7.269 -3.105 -9.052 1.00 0.71 C ATOM 836 CD1 LEU A 59 8.307 -2.201 -8.382 1.00 1.07 C ATOM 837 CD2 LEU A 59 6.466 -3.822 -7.959 1.00 1.34 C ATOM 0 H LEU A 59 6.849 -2.223 -12.355 1.00 0.50 H new ATOM 0 HA LEU A 59 5.606 -4.118 -10.628 1.00 0.47 H new ATOM 0 HB2 LEU A 59 6.907 -1.474 -10.426 1.00 0.53 H new ATOM 0 HB3 LEU A 59 5.640 -1.694 -9.236 1.00 0.53 H new ATOM 0 HG LEU A 59 7.755 -3.841 -9.692 1.00 0.71 H new ATOM 0 HD11 LEU A 59 8.984 -2.808 -7.781 1.00 1.07 H new ATOM 0 HD12 LEU A 59 8.876 -1.672 -9.146 1.00 1.07 H new ATOM 0 HD13 LEU A 59 7.801 -1.479 -7.741 1.00 1.07 H new ATOM 0 HD21 LEU A 59 7.135 -4.443 -7.364 1.00 1.34 H new ATOM 0 HD22 LEU A 59 5.988 -3.084 -7.315 1.00 1.34 H new ATOM 0 HD23 LEU A 59 5.703 -4.449 -8.420 1.00 1.34 H new ATOM 849 N SER A 60 3.626 -1.883 -11.869 1.00 0.43 N ATOM 850 CA SER A 60 2.194 -1.466 -11.943 1.00 0.42 C ATOM 851 C SER A 60 1.359 -2.672 -12.392 1.00 0.39 C ATOM 852 O SER A 60 0.324 -2.975 -11.831 1.00 0.41 O ATOM 853 CB SER A 60 2.054 -0.333 -12.962 1.00 0.47 C ATOM 854 OG SER A 60 0.819 0.336 -12.748 1.00 1.36 O ATOM 0 H SER A 60 4.219 -1.529 -12.620 1.00 0.43 H new ATOM 0 HA SER A 60 1.848 -1.118 -10.970 1.00 0.42 H new ATOM 0 HB2 SER A 60 2.883 0.367 -12.862 1.00 0.47 H new ATOM 0 HB3 SER A 60 2.095 -0.732 -13.976 1.00 0.47 H new ATOM 0 HG SER A 60 0.725 1.064 -13.397 1.00 1.36 H new ATOM 860 N GLU A 61 1.836 -3.379 -13.382 1.00 0.38 N ATOM 861 CA GLU A 61 1.123 -4.599 -13.869 1.00 0.38 C ATOM 862 C GLU A 61 0.778 -5.500 -12.677 1.00 0.38 C ATOM 863 O GLU A 61 -0.286 -6.085 -12.626 1.00 0.41 O ATOM 864 CB GLU A 61 2.035 -5.374 -14.835 1.00 0.39 C ATOM 865 CG GLU A 61 1.994 -4.728 -16.225 1.00 1.06 C ATOM 866 CD GLU A 61 2.289 -3.231 -16.113 1.00 1.67 C ATOM 867 OE1 GLU A 61 1.430 -2.512 -15.629 1.00 2.25 O ATOM 868 OE2 GLU A 61 3.367 -2.828 -16.517 1.00 2.40 O ATOM 0 H GLU A 61 2.699 -3.162 -13.880 1.00 0.38 H new ATOM 0 HA GLU A 61 0.209 -4.301 -14.383 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.057 -5.380 -14.457 1.00 0.39 H new ATOM 0 HB3 GLU A 61 1.713 -6.413 -14.898 1.00 0.39 H new ATOM 0 HG2 GLU A 61 2.726 -5.204 -16.878 1.00 1.06 H new ATOM 0 HG3 GLU A 61 1.015 -4.882 -16.678 1.00 1.06 H new ATOM 875 N CYS A 62 1.650 -5.615 -11.718 1.00 0.37 N ATOM 876 CA CYS A 62 1.333 -6.481 -10.543 1.00 0.39 C ATOM 877 C CYS A 62 0.175 -5.864 -9.748 1.00 0.38 C ATOM 878 O CYS A 62 -0.739 -6.549 -9.332 1.00 0.44 O ATOM 879 CB CYS A 62 2.565 -6.593 -9.644 1.00 0.41 C ATOM 880 SG CYS A 62 2.207 -7.715 -8.270 1.00 1.62 S ATOM 0 H CYS A 62 2.560 -5.154 -11.692 1.00 0.37 H new ATOM 0 HA CYS A 62 1.046 -7.473 -10.892 1.00 0.39 H new ATOM 0 HB2 CYS A 62 3.415 -6.963 -10.218 1.00 0.41 H new ATOM 0 HB3 CYS A 62 2.841 -5.610 -9.263 1.00 0.41 H new ATOM 0 HG CYS A 62 3.320 -8.196 -7.802 1.00 1.62 H new ATOM 886 N LEU A 63 0.199 -4.576 -9.549 1.00 0.35 N ATOM 887 CA LEU A 63 -0.903 -3.900 -8.800 1.00 0.36 C ATOM 888 C LEU A 63 -2.167 -3.846 -9.671 1.00 0.36 C ATOM 889 O LEU A 63 -3.268 -3.743 -9.167 1.00 0.41 O ATOM 890 CB LEU A 63 -0.447 -2.476 -8.432 1.00 0.38 C ATOM 891 CG LEU A 63 0.304 -2.507 -7.093 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.460 -3.509 -7.172 1.00 1.39 C ATOM 893 CD2 LEU A 63 0.855 -1.115 -6.783 1.00 1.11 C ATOM 0 H LEU A 63 0.940 -3.955 -9.875 1.00 0.35 H new ATOM 0 HA LEU A 63 -1.134 -4.456 -7.891 1.00 0.36 H new ATOM 0 HB2 LEU A 63 0.199 -2.076 -9.214 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -1.310 -1.814 -8.362 1.00 0.38 H new ATOM 0 HG LEU A 63 -0.382 -2.810 -6.303 1.00 0.69 H new ATOM 0 HD11 LEU A 63 1.991 -3.528 -6.220 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.066 -4.502 -7.388 1.00 1.39 H new ATOM 0 HD13 LEU A 63 2.147 -3.211 -7.964 1.00 1.39 H new ATOM 0 HD21 LEU A 63 1.388 -1.138 -5.832 1.00 1.11 H new ATOM 0 HD22 LEU A 63 1.539 -0.810 -7.575 1.00 1.11 H new ATOM 0 HD23 LEU A 63 0.032 -0.403 -6.720 1.00 1.11 H new ATOM 905 N LYS A 64 -2.026 -3.906 -10.966 1.00 0.35 N ATOM 906 CA LYS A 64 -3.236 -3.850 -11.844 1.00 0.37 C ATOM 907 C LYS A 64 -3.859 -5.242 -11.960 1.00 0.39 C ATOM 908 O LYS A 64 -5.051 -5.415 -11.797 1.00 0.43 O ATOM 909 CB LYS A 64 -2.847 -3.352 -13.241 1.00 0.38 C ATOM 910 CG LYS A 64 -2.454 -1.856 -13.195 1.00 0.82 C ATOM 911 CD LYS A 64 -2.811 -1.169 -14.526 1.00 1.35 C ATOM 912 CE LYS A 64 -4.329 -0.931 -14.628 1.00 1.38 C ATOM 913 NZ LYS A 64 -4.589 0.177 -15.587 1.00 2.09 N ATOM 0 H LYS A 64 -1.135 -3.991 -11.454 1.00 0.35 H new ATOM 0 HA LYS A 64 -3.958 -3.163 -11.403 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -2.014 -3.941 -13.624 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -3.681 -3.494 -13.929 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -2.972 -1.362 -12.373 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -1.385 -1.759 -13.003 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -2.283 -0.218 -14.603 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -2.478 -1.787 -15.360 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -4.830 -1.840 -14.960 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -4.737 -0.683 -13.648 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -5.131 0.927 -15.112 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -3.684 0.564 -15.924 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -5.134 -0.185 -16.396 1.00 2.09 H new ATOM 927 N ARG A 65 -3.064 -6.236 -12.237 1.00 0.43 N ATOM 928 CA ARG A 65 -3.609 -7.617 -12.362 1.00 0.47 C ATOM 929 C ARG A 65 -4.236 -8.048 -11.034 1.00 0.50 C ATOM 930 O ARG A 65 -5.254 -8.712 -11.004 1.00 0.54 O ATOM 931 CB ARG A 65 -2.470 -8.577 -12.710 1.00 0.45 C ATOM 932 CG ARG A 65 -1.964 -8.286 -14.131 1.00 0.94 C ATOM 933 CD ARG A 65 -3.038 -8.651 -15.180 1.00 1.55 C ATOM 934 NE ARG A 65 -2.391 -9.316 -16.356 1.00 1.86 N ATOM 935 CZ ARG A 65 -1.318 -8.816 -16.912 1.00 2.39 C ATOM 936 NH1 ARG A 65 -0.854 -7.657 -16.533 1.00 2.94 N ATOM 937 NH2 ARG A 65 -0.729 -9.461 -17.882 1.00 2.92 N ATOM 0 H ARG A 65 -2.058 -6.152 -12.383 1.00 0.43 H new ATOM 0 HA ARG A 65 -4.367 -7.636 -13.145 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -1.656 -8.466 -11.994 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -2.817 -9.608 -12.641 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -1.705 -7.231 -14.221 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -1.054 -8.855 -14.322 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -3.781 -9.315 -14.738 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -3.565 -7.753 -15.502 1.00 1.55 H new ATOM 0 HE ARG A 65 -2.795 -10.175 -16.730 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -1.329 -7.133 -15.798 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -0.017 -7.275 -16.972 1.00 2.94 H new ATOM 0 HH21 ARG A 65 -1.106 -10.352 -18.204 1.00 2.92 H new ATOM 0 HH22 ARG A 65 0.108 -9.074 -18.318 1.00 2.92 H new ATOM 951 N ILE A 66 -3.636 -7.679 -9.934 1.00 0.49 N ATOM 952 CA ILE A 66 -4.196 -8.076 -8.609 1.00 0.53 C ATOM 953 C ILE A 66 -5.371 -7.154 -8.263 1.00 0.54 C ATOM 954 O ILE A 66 -6.338 -7.564 -7.652 1.00 0.60 O ATOM 955 CB ILE A 66 -3.089 -7.950 -7.551 1.00 0.52 C ATOM 956 CG1 ILE A 66 -2.072 -9.079 -7.737 1.00 1.22 C ATOM 957 CG2 ILE A 66 -3.681 -8.009 -6.137 1.00 1.29 C ATOM 958 CD1 ILE A 66 -0.829 -8.790 -6.891 1.00 1.25 C ATOM 0 H ILE A 66 -2.783 -7.121 -9.895 1.00 0.49 H new ATOM 0 HA ILE A 66 -4.553 -9.105 -8.638 1.00 0.53 H new ATOM 0 HB ILE A 66 -2.593 -6.987 -7.676 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -2.512 -10.032 -7.442 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -1.797 -9.166 -8.788 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -2.880 -7.918 -5.403 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -4.389 -7.191 -6.005 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -4.195 -8.960 -5.997 1.00 1.29 H new ATOM 0 HD11 ILE A 66 -0.104 -9.593 -7.023 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -0.385 -7.846 -7.207 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -1.111 -8.725 -5.840 1.00 1.25 H new ATOM 970 N GLY A 67 -5.296 -5.916 -8.667 1.00 0.52 N ATOM 971 CA GLY A 67 -6.404 -4.958 -8.386 1.00 0.55 C ATOM 972 C GLY A 67 -7.640 -5.352 -9.193 1.00 0.53 C ATOM 973 O GLY A 67 -8.729 -5.461 -8.661 1.00 0.63 O ATOM 0 H GLY A 67 -4.509 -5.523 -9.184 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -6.637 -4.958 -7.321 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -6.096 -3.945 -8.644 1.00 0.55 H new ATOM 977 N ASP A 68 -7.493 -5.568 -10.470 1.00 0.54 N ATOM 978 CA ASP A 68 -8.665 -5.954 -11.303 1.00 0.54 C ATOM 979 C ASP A 68 -9.160 -7.341 -10.896 1.00 0.52 C ATOM 980 O ASP A 68 -10.282 -7.714 -11.176 1.00 0.56 O ATOM 981 CB ASP A 68 -8.242 -5.987 -12.773 1.00 0.60 C ATOM 982 CG ASP A 68 -7.792 -4.591 -13.207 1.00 1.43 C ATOM 983 OD1 ASP A 68 -8.450 -3.634 -12.833 1.00 2.12 O ATOM 984 OD2 ASP A 68 -6.796 -4.502 -13.906 1.00 2.20 O ATOM 0 H ASP A 68 -6.609 -5.494 -10.974 1.00 0.54 H new ATOM 0 HA ASP A 68 -9.466 -5.229 -11.157 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -7.431 -6.702 -12.913 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -9.073 -6.322 -13.394 1.00 0.60 H new ATOM 989 N GLU A 69 -8.329 -8.118 -10.250 1.00 0.56 N ATOM 990 CA GLU A 69 -8.752 -9.491 -9.839 1.00 0.56 C ATOM 991 C GLU A 69 -9.286 -9.469 -8.405 1.00 0.55 C ATOM 992 O GLU A 69 -9.863 -10.439 -7.953 1.00 0.73 O ATOM 993 CB GLU A 69 -7.547 -10.436 -9.924 1.00 0.61 C ATOM 994 CG GLU A 69 -7.992 -11.880 -9.648 1.00 0.84 C ATOM 995 CD GLU A 69 -6.944 -12.856 -10.193 1.00 1.65 C ATOM 996 OE1 GLU A 69 -5.774 -12.654 -9.912 1.00 2.48 O ATOM 997 OE2 GLU A 69 -7.330 -13.787 -10.880 1.00 2.23 O ATOM 0 H GLU A 69 -7.377 -7.862 -9.989 1.00 0.56 H new ATOM 0 HA GLU A 69 -9.542 -9.839 -10.505 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -7.091 -10.370 -10.912 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -6.788 -10.136 -9.202 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -8.122 -12.032 -8.577 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -8.958 -12.069 -10.117 1.00 0.84 H new ATOM 1004 N LEU A 70 -9.099 -8.397 -7.668 1.00 0.53 N ATOM 1005 CA LEU A 70 -9.606 -8.382 -6.254 1.00 0.52 C ATOM 1006 C LEU A 70 -11.068 -7.915 -6.246 1.00 0.54 C ATOM 1007 O LEU A 70 -11.879 -8.400 -5.482 1.00 0.60 O ATOM 1008 CB LEU A 70 -8.725 -7.446 -5.393 1.00 0.61 C ATOM 1009 CG LEU A 70 -8.067 -8.207 -4.237 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -6.961 -7.338 -3.631 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -9.113 -8.511 -3.162 1.00 1.61 C ATOM 0 H LEU A 70 -8.627 -7.547 -7.976 1.00 0.53 H new ATOM 0 HA LEU A 70 -9.555 -9.385 -5.831 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -7.955 -6.992 -6.017 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -9.334 -6.634 -4.996 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.645 -9.141 -4.608 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -6.488 -7.873 -2.807 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -6.215 -7.114 -4.394 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -7.391 -6.408 -3.260 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -8.644 -9.052 -2.340 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -9.533 -7.577 -2.788 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -9.909 -9.121 -3.591 1.00 1.61 H new ATOM 1023 N ASP A 71 -11.420 -7.013 -7.120 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.838 -6.565 -7.178 1.00 0.91 C ATOM 1025 C ASP A 71 -13.691 -7.764 -7.589 1.00 1.02 C ATOM 1026 O ASP A 71 -14.904 -7.747 -7.535 1.00 1.29 O ATOM 1027 CB ASP A 71 -12.985 -5.451 -8.215 1.00 1.09 C ATOM 1028 CG ASP A 71 -12.257 -5.851 -9.498 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -12.319 -7.017 -9.852 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -11.650 -4.985 -10.106 1.00 2.25 O ATOM 0 H ASP A 71 -10.792 -6.570 -7.791 1.00 0.67 H new ATOM 0 HA ASP A 71 -13.157 -6.183 -6.208 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -14.039 -5.270 -8.424 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -12.573 -4.520 -7.825 1.00 1.09 H new ATOM 1035 N SER A 72 -13.026 -8.806 -8.008 1.00 0.90 N ATOM 1036 CA SER A 72 -13.714 -10.048 -8.448 1.00 1.20 C ATOM 1037 C SER A 72 -14.676 -10.566 -7.380 1.00 0.98 C ATOM 1038 O SER A 72 -15.541 -11.366 -7.675 1.00 1.02 O ATOM 1039 CB SER A 72 -12.656 -11.127 -8.691 1.00 1.57 C ATOM 1040 OG SER A 72 -12.027 -11.458 -7.460 1.00 2.09 O ATOM 0 H SER A 72 -12.008 -8.846 -8.064 1.00 0.90 H new ATOM 0 HA SER A 72 -14.281 -9.823 -9.351 1.00 1.20 H new ATOM 0 HB2 SER A 72 -13.118 -12.013 -9.126 1.00 1.57 H new ATOM 0 HB3 SER A 72 -11.915 -10.770 -9.406 1.00 1.57 H new ATOM 0 HG SER A 72 -11.055 -11.481 -7.585 1.00 2.09 H new ATOM 1046 N ASN A 73 -14.522 -10.157 -6.134 1.00 0.92 N ATOM 1047 CA ASN A 73 -15.426 -10.688 -5.054 1.00 0.83 C ATOM 1048 C ASN A 73 -16.448 -9.628 -4.621 1.00 0.75 C ATOM 1049 O ASN A 73 -16.090 -8.569 -4.144 1.00 1.07 O ATOM 1050 CB ASN A 73 -14.567 -11.079 -3.845 1.00 0.91 C ATOM 1051 CG ASN A 73 -13.525 -9.989 -3.579 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -13.711 -8.849 -3.957 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -12.428 -10.294 -2.941 1.00 1.90 N ATOM 0 H ASN A 73 -13.819 -9.487 -5.823 1.00 0.92 H new ATOM 0 HA ASN A 73 -15.968 -11.551 -5.440 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -15.198 -11.215 -2.967 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -14.071 -12.032 -4.031 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -11.727 -9.576 -2.760 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -12.272 -11.251 -2.624 1.00 1.90 H new ATOM 1060 N MET A 74 -17.714 -9.899 -4.789 1.00 0.71 N ATOM 1061 CA MET A 74 -18.750 -8.900 -4.388 1.00 0.67 C ATOM 1062 C MET A 74 -18.857 -8.851 -2.858 1.00 0.67 C ATOM 1063 O MET A 74 -19.440 -7.945 -2.296 1.00 0.71 O ATOM 1064 CB MET A 74 -20.100 -9.285 -4.989 1.00 0.75 C ATOM 1065 CG MET A 74 -19.972 -9.387 -6.510 1.00 1.20 C ATOM 1066 SD MET A 74 -19.673 -7.742 -7.202 1.00 1.92 S ATOM 1067 CE MET A 74 -19.091 -8.284 -8.827 1.00 1.96 C ATOM 0 H MET A 74 -18.077 -10.766 -5.185 1.00 0.71 H new ATOM 0 HA MET A 74 -18.462 -7.916 -4.759 1.00 0.67 H new ATOM 0 HB2 MET A 74 -20.435 -10.237 -4.577 1.00 0.75 H new ATOM 0 HB3 MET A 74 -20.852 -8.541 -4.726 1.00 0.75 H new ATOM 0 HG2 MET A 74 -19.154 -10.058 -6.773 1.00 1.20 H new ATOM 0 HG3 MET A 74 -20.882 -9.812 -6.934 1.00 1.20 H new ATOM 0 HE1 MET A 74 -18.844 -7.413 -9.434 1.00 1.96 H new ATOM 0 HE2 MET A 74 -18.204 -8.906 -8.707 1.00 1.96 H new ATOM 0 HE3 MET A 74 -19.874 -8.860 -9.320 1.00 1.96 H new ATOM 1077 N GLU A 75 -18.265 -9.794 -2.183 1.00 0.70 N ATOM 1078 CA GLU A 75 -18.283 -9.795 -0.691 1.00 0.75 C ATOM 1079 C GLU A 75 -17.331 -8.713 -0.175 1.00 0.73 C ATOM 1080 O GLU A 75 -17.704 -7.895 0.642 1.00 0.78 O ATOM 1081 CB GLU A 75 -17.816 -11.161 -0.181 1.00 0.87 C ATOM 1082 CG GLU A 75 -18.879 -12.216 -0.494 1.00 1.15 C ATOM 1083 CD GLU A 75 -18.396 -13.586 -0.015 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -18.625 -13.903 1.141 1.00 2.21 O ATOM 1085 OE2 GLU A 75 -17.805 -14.296 -0.812 1.00 2.29 O ATOM 0 H GLU A 75 -17.762 -10.575 -2.605 1.00 0.70 H new ATOM 0 HA GLU A 75 -19.294 -9.596 -0.336 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -16.871 -11.432 -0.651 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -17.637 -11.118 0.893 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -19.818 -11.958 -0.004 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -19.076 -12.242 -1.566 1.00 1.15 H new ATOM 1092 N LEU A 76 -16.114 -8.691 -0.633 1.00 0.74 N ATOM 1093 CA LEU A 76 -15.165 -7.649 -0.146 1.00 0.80 C ATOM 1094 C LEU A 76 -15.680 -6.255 -0.522 1.00 0.75 C ATOM 1095 O LEU A 76 -15.442 -5.289 0.176 1.00 0.81 O ATOM 1096 CB LEU A 76 -13.783 -7.877 -0.760 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.754 -6.927 -0.128 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -12.476 -7.321 1.335 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -11.456 -6.999 -0.938 1.00 1.51 C ATOM 0 H LEU A 76 -15.734 -9.343 -1.319 1.00 0.74 H new ATOM 0 HA LEU A 76 -15.088 -7.718 0.939 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -13.476 -8.911 -0.606 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -13.825 -7.714 -1.837 1.00 0.92 H new ATOM 0 HG LEU A 76 -13.149 -5.911 -0.139 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -11.745 -6.636 1.764 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -13.402 -7.269 1.908 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -12.084 -8.338 1.370 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -10.716 -6.329 -0.500 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -11.074 -8.020 -0.924 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -11.652 -6.699 -1.967 1.00 1.51 H new ATOM 1111 N GLN A 77 -16.410 -6.143 -1.595 1.00 0.76 N ATOM 1112 CA GLN A 77 -16.962 -4.813 -1.982 1.00 0.74 C ATOM 1113 C GLN A 77 -18.197 -4.532 -1.124 1.00 0.71 C ATOM 1114 O GLN A 77 -18.522 -3.395 -0.834 1.00 0.72 O ATOM 1115 CB GLN A 77 -17.346 -4.822 -3.464 1.00 0.71 C ATOM 1116 CG GLN A 77 -17.744 -3.411 -3.902 1.00 1.26 C ATOM 1117 CD GLN A 77 -18.102 -3.421 -5.390 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -17.422 -4.038 -6.186 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -19.149 -2.760 -5.801 1.00 2.03 N ATOM 0 H GLN A 77 -16.649 -6.912 -2.221 1.00 0.76 H new ATOM 0 HA GLN A 77 -16.214 -4.037 -1.821 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -16.508 -5.177 -4.064 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -18.173 -5.512 -3.631 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.594 -3.062 -3.315 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -16.924 -2.717 -3.719 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -19.720 -2.242 -5.133 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -19.397 -2.761 -6.790 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.876 -5.556 -0.697 1.00 0.72 N ATOM 1129 CA ARG A 78 -20.077 -5.344 0.155 1.00 0.73 C ATOM 1130 C ARG A 78 -19.637 -4.956 1.568 1.00 0.75 C ATOM 1131 O ARG A 78 -20.249 -4.124 2.208 1.00 0.79 O ATOM 1132 CB ARG A 78 -20.897 -6.639 0.204 1.00 0.74 C ATOM 1133 CG ARG A 78 -22.079 -6.499 1.199 1.00 0.94 C ATOM 1134 CD ARG A 78 -21.764 -7.221 2.516 1.00 1.23 C ATOM 1135 NE ARG A 78 -22.956 -7.164 3.408 1.00 1.80 N ATOM 1136 CZ ARG A 78 -23.032 -7.949 4.447 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -22.059 -8.778 4.711 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.080 -7.906 5.222 1.00 3.41 N ATOM 0 H ARG A 78 -18.652 -6.530 -0.900 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.688 -4.544 -0.263 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.277 -6.873 -0.790 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -20.258 -7.469 0.504 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -22.275 -5.445 1.394 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -22.985 -6.915 0.757 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -21.492 -8.258 2.319 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -20.908 -6.754 3.004 1.00 1.23 H new ATOM 0 HE ARG A 78 -23.713 -6.511 3.206 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -21.239 -8.812 4.105 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -22.118 -9.392 5.523 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -24.841 -7.258 5.016 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -24.139 -8.520 6.034 1.00 3.41 H new ATOM 1152 N MET A 79 -18.576 -5.538 2.061 1.00 0.75 N ATOM 1153 CA MET A 79 -18.105 -5.184 3.429 1.00 0.77 C ATOM 1154 C MET A 79 -17.652 -3.721 3.439 1.00 0.77 C ATOM 1155 O MET A 79 -18.003 -2.959 4.318 1.00 0.78 O ATOM 1156 CB MET A 79 -16.929 -6.092 3.818 1.00 0.81 C ATOM 1157 CG MET A 79 -17.450 -7.467 4.252 1.00 1.08 C ATOM 1158 SD MET A 79 -16.075 -8.460 4.888 1.00 1.07 S ATOM 1159 CE MET A 79 -16.186 -7.930 6.616 1.00 0.81 C ATOM 0 H MET A 79 -18.018 -6.241 1.576 1.00 0.75 H new ATOM 0 HA MET A 79 -18.915 -5.321 4.145 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.249 -6.202 2.974 1.00 0.81 H new ATOM 0 HB3 MET A 79 -16.360 -5.637 4.629 1.00 0.81 H new ATOM 0 HG2 MET A 79 -18.215 -7.352 5.020 1.00 1.08 H new ATOM 0 HG3 MET A 79 -17.918 -7.973 3.408 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.193 -7.946 7.066 1.00 0.81 H new ATOM 0 HE2 MET A 79 -16.589 -6.918 6.661 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.843 -8.607 7.163 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.875 -3.320 2.468 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.407 -1.907 2.429 1.00 0.80 C ATOM 1171 C ILE A 80 -17.618 -0.973 2.464 1.00 0.80 C ATOM 1172 O ILE A 80 -17.557 0.115 3.001 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.598 -1.669 1.150 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -14.314 -2.501 1.205 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -15.234 -0.186 1.036 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -13.635 -2.492 -0.165 1.00 1.10 C ATOM 0 H ILE A 80 -16.546 -3.909 1.703 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.772 -1.706 3.292 1.00 0.80 H new ATOM 0 HB ILE A 80 -16.193 -1.962 0.285 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.639 -2.096 1.959 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.545 -3.524 1.501 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -14.659 -0.022 0.125 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -16.145 0.411 1.002 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.638 0.110 1.900 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.721 -3.085 -0.122 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -14.309 -2.917 -0.908 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -13.389 -1.467 -0.443 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.725 -1.391 1.907 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.936 -0.521 1.930 1.00 0.80 C ATOM 1190 C ALA A 81 -20.492 -0.473 3.358 1.00 0.81 C ATOM 1191 O ALA A 81 -21.248 0.409 3.712 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.996 -1.079 0.978 1.00 0.79 C ATOM 0 H ALA A 81 -18.842 -2.291 1.441 1.00 0.78 H new ATOM 0 HA ALA A 81 -19.669 0.485 1.607 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.878 -0.439 1.000 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -20.595 -1.110 -0.035 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -21.271 -2.086 1.290 1.00 0.79 H new ATOM 1198 N ALA A 82 -20.108 -1.408 4.183 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.595 -1.417 5.593 1.00 0.80 C ATOM 1200 C ALA A 82 -19.748 -0.459 6.436 1.00 0.79 C ATOM 1201 O ALA A 82 -20.066 -0.172 7.573 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.475 -2.831 6.164 1.00 0.87 C ATOM 0 H ALA A 82 -19.475 -2.170 3.941 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.637 -1.098 5.616 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -20.831 -2.839 7.194 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -21.077 -3.517 5.567 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.432 -3.147 6.138 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.677 0.049 5.886 1.00 0.80 N ATOM 1209 CA VAL A 83 -17.814 1.000 6.650 1.00 0.85 C ATOM 1210 C VAL A 83 -18.299 2.430 6.402 1.00 0.99 C ATOM 1211 O VAL A 83 -17.903 3.087 5.460 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.361 0.862 6.190 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -15.456 1.723 7.072 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -15.928 -0.602 6.291 1.00 1.40 C ATOM 0 H VAL A 83 -18.361 -0.154 4.938 1.00 0.80 H new ATOM 0 HA VAL A 83 -17.874 0.773 7.714 1.00 0.85 H new ATOM 0 HB VAL A 83 -16.279 1.195 5.155 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -14.422 1.622 6.741 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -15.761 2.767 6.996 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -15.539 1.395 8.108 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -14.893 -0.699 5.963 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -16.014 -0.936 7.325 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -16.568 -1.215 5.657 1.00 1.40 H new ATOM 1224 N ASP A 84 -19.142 2.914 7.276 1.00 1.46 N ATOM 1225 CA ASP A 84 -19.662 4.305 7.154 1.00 1.71 C ATOM 1226 C ASP A 84 -18.541 5.294 7.479 1.00 1.39 C ATOM 1227 O ASP A 84 -17.476 4.915 7.926 1.00 1.80 O ATOM 1228 CB ASP A 84 -20.805 4.502 8.154 1.00 2.38 C ATOM 1229 CG ASP A 84 -21.436 5.879 7.942 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -21.974 6.104 6.870 1.00 3.45 O ATOM 1231 OD2 ASP A 84 -21.371 6.686 8.855 1.00 3.57 O ATOM 0 H ASP A 84 -19.496 2.396 8.080 1.00 1.46 H new ATOM 0 HA ASP A 84 -20.021 4.475 6.139 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -21.555 3.722 8.023 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -20.429 4.415 9.174 1.00 2.38 H new ATOM 1236 N THR A 85 -18.772 6.561 7.260 1.00 1.68 N ATOM 1237 CA THR A 85 -17.722 7.582 7.557 1.00 1.97 C ATOM 1238 C THR A 85 -17.935 8.140 8.966 1.00 1.67 C ATOM 1239 O THR A 85 -19.015 8.574 9.315 1.00 2.28 O ATOM 1240 CB THR A 85 -17.823 8.720 6.538 1.00 3.20 C ATOM 1241 OG1 THR A 85 -19.082 9.365 6.674 1.00 3.80 O ATOM 1242 CG2 THR A 85 -17.689 8.152 5.124 1.00 3.87 C ATOM 0 H THR A 85 -19.645 6.935 6.887 1.00 1.68 H new ATOM 0 HA THR A 85 -16.736 7.121 7.496 1.00 1.97 H new ATOM 0 HB THR A 85 -17.025 9.440 6.716 1.00 3.20 H new ATOM 0 HG1 THR A 85 -19.437 9.204 7.573 1.00 3.80 H new ATOM 0 HG21 THR A 85 -17.761 8.962 4.398 1.00 3.87 H new ATOM 0 HG22 THR A 85 -16.723 7.657 5.021 1.00 3.87 H new ATOM 0 HG23 THR A 85 -18.487 7.432 4.944 1.00 3.87 H new ATOM 1250 N ASP A 86 -16.912 8.133 9.780 1.00 1.51 N ATOM 1251 CA ASP A 86 -17.051 8.664 11.168 1.00 1.98 C ATOM 1252 C ASP A 86 -15.698 9.185 11.653 1.00 1.78 C ATOM 1253 O ASP A 86 -15.585 10.274 12.178 1.00 2.48 O ATOM 1254 CB ASP A 86 -17.539 7.551 12.097 1.00 2.56 C ATOM 1255 CG ASP A 86 -18.902 7.050 11.616 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -19.810 7.860 11.527 1.00 3.57 O ATOM 1257 OD2 ASP A 86 -19.015 5.867 11.345 1.00 3.50 O ATOM 0 H ASP A 86 -15.984 7.782 9.543 1.00 1.51 H new ATOM 0 HA ASP A 86 -17.775 9.479 11.174 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -16.821 6.731 12.109 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -17.615 7.922 13.119 1.00 2.56 H new ATOM 1262 N SER A 87 -14.665 8.406 11.468 1.00 1.11 N ATOM 1263 CA SER A 87 -13.306 8.840 11.899 1.00 0.93 C ATOM 1264 C SER A 87 -12.265 7.947 11.200 1.00 0.84 C ATOM 1265 O SER A 87 -11.716 7.057 11.819 1.00 0.97 O ATOM 1266 CB SER A 87 -13.176 8.700 13.415 1.00 0.88 C ATOM 1267 OG SER A 87 -11.870 9.094 13.813 1.00 1.63 O ATOM 0 H SER A 87 -14.706 7.484 11.035 1.00 1.11 H new ATOM 0 HA SER A 87 -13.143 9.883 11.629 1.00 0.93 H new ATOM 0 HB2 SER A 87 -13.923 9.318 13.914 1.00 0.88 H new ATOM 0 HB3 SER A 87 -13.364 7.669 13.714 1.00 0.88 H new ATOM 0 HG SER A 87 -11.872 9.315 14.768 1.00 1.63 H new ATOM 1273 N PRO A 88 -12.037 8.188 9.920 1.00 0.77 N ATOM 1274 CA PRO A 88 -11.083 7.378 9.139 1.00 0.83 C ATOM 1275 C PRO A 88 -9.668 7.498 9.716 1.00 0.73 C ATOM 1276 O PRO A 88 -8.824 6.658 9.472 1.00 0.72 O ATOM 1277 CB PRO A 88 -11.151 7.950 7.701 1.00 1.01 C ATOM 1278 CG PRO A 88 -12.181 9.116 7.709 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.700 9.270 9.155 1.00 0.83 C ATOM 0 HA PRO A 88 -11.331 6.317 9.163 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -10.171 8.306 7.384 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -11.453 7.177 6.995 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -11.715 10.041 7.369 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -13.005 8.904 7.027 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -12.450 10.250 9.561 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.785 9.175 9.197 1.00 0.83 H new ATOM 1287 N ARG A 89 -9.388 8.526 10.471 1.00 0.75 N ATOM 1288 CA ARG A 89 -8.016 8.662 11.033 1.00 0.73 C ATOM 1289 C ARG A 89 -7.825 7.604 12.122 1.00 0.67 C ATOM 1290 O ARG A 89 -6.816 6.928 12.172 1.00 0.68 O ATOM 1291 CB ARG A 89 -7.839 10.070 11.608 1.00 0.79 C ATOM 1292 CG ARG A 89 -6.418 10.254 12.139 1.00 1.63 C ATOM 1293 CD ARG A 89 -6.267 11.680 12.677 1.00 1.65 C ATOM 1294 NE ARG A 89 -4.929 11.835 13.313 1.00 2.07 N ATOM 1295 CZ ARG A 89 -4.468 13.027 13.582 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -5.180 14.083 13.297 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -3.296 13.162 14.138 1.00 3.10 N ATOM 0 H ARG A 89 -10.042 9.268 10.720 1.00 0.75 H new ATOM 0 HA ARG A 89 -7.268 8.512 10.254 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -8.045 10.813 10.837 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -8.558 10.235 12.410 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -6.215 9.530 12.928 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -5.693 10.072 11.345 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -6.381 12.399 11.866 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -7.052 11.891 13.403 1.00 1.65 H new ATOM 0 HE ARG A 89 -4.373 11.010 13.538 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -6.097 13.978 12.864 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -4.819 15.013 13.508 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -2.740 12.337 14.362 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -2.935 14.093 14.348 1.00 3.10 H new ATOM 1311 N GLU A 90 -8.789 7.446 12.988 1.00 0.65 N ATOM 1312 CA GLU A 90 -8.665 6.420 14.062 1.00 0.65 C ATOM 1313 C GLU A 90 -8.682 5.028 13.424 1.00 0.64 C ATOM 1314 O GLU A 90 -7.905 4.166 13.783 1.00 0.67 O ATOM 1315 CB GLU A 90 -9.843 6.550 15.029 1.00 0.71 C ATOM 1316 CG GLU A 90 -9.750 7.883 15.773 1.00 1.32 C ATOM 1317 CD GLU A 90 -8.584 7.836 16.762 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -8.530 6.896 17.539 1.00 2.78 O ATOM 1319 OE2 GLU A 90 -7.765 8.739 16.727 1.00 2.46 O ATOM 0 H GLU A 90 -9.656 7.983 12.998 1.00 0.65 H new ATOM 0 HA GLU A 90 -7.732 6.566 14.607 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -10.784 6.492 14.482 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -9.836 5.724 15.740 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -9.606 8.698 15.064 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -10.682 8.082 16.302 1.00 1.32 H new ATOM 1326 N VAL A 91 -9.564 4.793 12.489 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.625 3.450 11.845 1.00 0.67 C ATOM 1328 C VAL A 91 -8.351 3.213 11.033 1.00 0.66 C ATOM 1329 O VAL A 91 -7.742 2.164 11.103 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.841 3.388 10.919 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -10.947 1.992 10.303 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -12.108 3.686 11.724 1.00 0.75 C ATOM 0 H VAL A 91 -10.243 5.472 12.145 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.711 2.681 12.613 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.730 4.126 10.125 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -11.814 1.950 9.644 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.045 1.778 9.730 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -11.058 1.252 11.096 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -12.976 3.642 11.066 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -12.217 2.947 12.518 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -12.035 4.681 12.162 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.951 4.179 10.256 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.724 4.018 9.427 1.00 0.65 C ATOM 1344 C PHE A 92 -5.546 3.578 10.302 1.00 0.62 C ATOM 1345 O PHE A 92 -4.813 2.675 9.949 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.388 5.353 8.755 1.00 0.65 C ATOM 1347 CG PHE A 92 -5.086 5.231 7.996 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -5.079 4.710 6.697 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.886 5.641 8.592 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.873 4.598 5.993 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.681 5.529 7.888 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.674 5.007 6.589 1.00 0.73 C ATOM 0 H PHE A 92 -8.423 5.078 10.159 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.905 3.256 8.669 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -7.190 5.641 8.075 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.309 6.139 9.506 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -6.004 4.394 6.237 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -3.891 6.043 9.594 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -3.868 4.196 4.991 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.756 5.846 8.347 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.744 4.920 6.047 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.335 4.211 11.428 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.177 3.813 12.286 1.00 0.57 C ATOM 1364 C PHE A 93 -4.528 2.543 13.064 1.00 0.59 C ATOM 1365 O PHE A 93 -3.677 1.715 13.327 1.00 0.60 O ATOM 1366 CB PHE A 93 -3.835 4.948 13.252 1.00 0.57 C ATOM 1367 CG PHE A 93 -2.660 4.553 14.112 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -1.357 4.803 13.669 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -2.874 3.942 15.354 1.00 1.15 C ATOM 1370 CE1 PHE A 93 -0.266 4.442 14.467 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -1.782 3.581 16.152 1.00 1.07 C ATOM 1372 CZ PHE A 93 -0.478 3.831 15.709 1.00 0.70 C ATOM 0 H PHE A 93 -5.906 4.976 11.787 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.310 3.615 11.656 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.600 5.854 12.694 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -4.697 5.175 13.880 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -1.193 5.275 12.711 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -3.880 3.750 15.696 1.00 1.15 H new ATOM 0 HE1 PHE A 93 0.740 4.635 14.125 1.00 1.58 H new ATOM 0 HE2 PHE A 93 -1.946 3.109 17.110 1.00 1.07 H new ATOM 0 HZ PHE A 93 0.364 3.553 16.325 1.00 0.70 H new ATOM 1382 N ARG A 94 -5.769 2.367 13.419 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.151 1.132 14.158 1.00 0.67 C ATOM 1384 C ARG A 94 -6.028 -0.058 13.209 1.00 0.66 C ATOM 1385 O ARG A 94 -5.452 -1.070 13.555 1.00 0.67 O ATOM 1386 CB ARG A 94 -7.592 1.252 14.668 1.00 0.72 C ATOM 1387 CG ARG A 94 -8.018 -0.028 15.411 1.00 0.89 C ATOM 1388 CD ARG A 94 -7.167 -0.232 16.674 1.00 1.00 C ATOM 1389 NE ARG A 94 -5.922 -0.970 16.324 1.00 1.95 N ATOM 1390 CZ ARG A 94 -4.925 -1.003 17.166 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -5.019 -0.386 18.313 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -3.836 -1.654 16.862 1.00 3.65 N ATOM 0 H ARG A 94 -6.531 3.019 13.232 1.00 0.62 H new ATOM 0 HA ARG A 94 -5.493 0.992 15.015 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -7.676 2.110 15.335 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -8.265 1.432 13.830 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -9.072 0.037 15.683 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -7.912 -0.890 14.752 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -6.918 0.732 17.116 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -7.734 -0.788 17.421 1.00 1.00 H new ATOM 0 HE ARG A 94 -5.848 -1.450 15.427 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -5.871 0.121 18.551 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -4.240 -0.412 18.971 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -3.764 -2.137 15.967 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -3.057 -1.680 17.520 1.00 3.65 H new ATOM 1406 N VAL A 95 -6.558 0.034 12.019 1.00 0.65 N ATOM 1407 CA VAL A 95 -6.456 -1.110 11.074 1.00 0.66 C ATOM 1408 C VAL A 95 -5.002 -1.279 10.624 1.00 0.66 C ATOM 1409 O VAL A 95 -4.471 -2.371 10.611 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.342 -0.809 9.855 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.067 -1.815 8.731 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -8.815 -0.891 10.267 1.00 1.08 C ATOM 0 H VAL A 95 -7.055 0.850 11.663 1.00 0.65 H new ATOM 0 HA VAL A 95 -6.783 -2.029 11.560 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.114 0.193 9.491 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -7.703 -1.587 7.875 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.021 -1.750 8.433 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -7.282 -2.823 9.085 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.446 -0.678 9.404 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.034 -1.892 10.638 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.014 -0.161 11.052 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.356 -0.209 10.247 1.00 0.65 N ATOM 1423 CA ALA A 96 -2.946 -0.324 9.785 1.00 0.68 C ATOM 1424 C ALA A 96 -2.097 -0.978 10.869 1.00 0.70 C ATOM 1425 O ALA A 96 -1.250 -1.810 10.612 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.413 1.075 9.458 1.00 0.69 C ATOM 0 H ALA A 96 -4.743 0.735 10.239 1.00 0.65 H new ATOM 0 HA ALA A 96 -2.899 -0.945 8.891 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.380 1.001 9.118 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -3.022 1.522 8.672 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.457 1.699 10.351 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.341 -0.590 12.093 1.00 0.74 N ATOM 1433 CA ALA A 97 -1.588 -1.148 13.250 1.00 0.78 C ATOM 1434 C ALA A 97 -2.082 -2.559 13.570 1.00 0.79 C ATOM 1435 O ALA A 97 -1.314 -3.418 13.948 1.00 0.83 O ATOM 1436 CB ALA A 97 -1.823 -0.256 14.472 1.00 0.77 C ATOM 0 H ALA A 97 -3.045 0.104 12.342 1.00 0.74 H new ATOM 0 HA ALA A 97 -0.527 -1.185 13.001 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -1.276 -0.656 15.325 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -1.473 0.754 14.258 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -2.888 -0.230 14.704 1.00 0.77 H new ATOM 1442 N ASP A 98 -3.356 -2.810 13.431 1.00 0.78 N ATOM 1443 CA ASP A 98 -3.882 -4.171 13.743 1.00 0.82 C ATOM 1444 C ASP A 98 -3.365 -5.174 12.711 1.00 0.83 C ATOM 1445 O ASP A 98 -2.871 -6.234 13.041 1.00 0.88 O ATOM 1446 CB ASP A 98 -5.411 -4.143 13.701 1.00 0.82 C ATOM 1447 CG ASP A 98 -5.957 -5.507 14.126 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -6.146 -5.702 15.316 1.00 2.19 O ATOM 1449 OD2 ASP A 98 -6.175 -6.333 13.256 1.00 2.13 O ATOM 0 H ASP A 98 -4.053 -2.135 13.116 1.00 0.78 H new ATOM 0 HA ASP A 98 -3.546 -4.470 14.736 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -5.790 -3.365 14.364 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -5.754 -3.899 12.695 1.00 0.82 H new ATOM 1454 N MET A 99 -3.492 -4.838 11.457 1.00 0.81 N ATOM 1455 CA MET A 99 -3.031 -5.751 10.374 1.00 0.85 C ATOM 1456 C MET A 99 -1.602 -6.215 10.638 1.00 0.97 C ATOM 1457 O MET A 99 -1.260 -7.352 10.377 1.00 1.14 O ATOM 1458 CB MET A 99 -3.068 -5.009 9.031 1.00 0.79 C ATOM 1459 CG MET A 99 -4.522 -4.615 8.664 1.00 0.81 C ATOM 1460 SD MET A 99 -4.979 -5.337 7.062 1.00 0.97 S ATOM 1461 CE MET A 99 -4.718 -3.859 6.047 1.00 0.48 C ATOM 0 H MET A 99 -3.900 -3.961 11.134 1.00 0.81 H new ATOM 0 HA MET A 99 -3.691 -6.618 10.347 1.00 0.85 H new ATOM 0 HB2 MET A 99 -2.446 -4.115 9.086 1.00 0.79 H new ATOM 0 HB3 MET A 99 -2.648 -5.641 8.249 1.00 0.79 H new ATOM 0 HG2 MET A 99 -5.207 -4.963 9.437 1.00 0.81 H new ATOM 0 HG3 MET A 99 -4.613 -3.530 8.622 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.947 -4.088 5.006 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.371 -3.059 6.395 1.00 0.48 H new ATOM 0 HE3 MET A 99 -3.679 -3.540 6.129 1.00 0.48 H new ATOM 1471 N PHE A 100 -0.758 -5.341 11.132 1.00 0.98 N ATOM 1472 CA PHE A 100 0.667 -5.723 11.393 1.00 1.14 C ATOM 1473 C PHE A 100 0.975 -5.626 12.886 1.00 1.28 C ATOM 1474 O PHE A 100 1.268 -6.601 13.536 1.00 1.67 O ATOM 1475 CB PHE A 100 1.585 -4.788 10.597 1.00 1.19 C ATOM 1476 CG PHE A 100 0.937 -4.491 9.262 1.00 1.15 C ATOM 1477 CD1 PHE A 100 0.525 -5.547 8.436 1.00 1.64 C ATOM 1478 CD2 PHE A 100 0.732 -3.167 8.856 1.00 1.67 C ATOM 1479 CE1 PHE A 100 -0.087 -5.278 7.209 1.00 1.69 C ATOM 1480 CE2 PHE A 100 0.121 -2.898 7.626 1.00 1.79 C ATOM 1481 CZ PHE A 100 -0.289 -3.954 6.802 1.00 1.38 C ATOM 0 H PHE A 100 -0.995 -4.377 11.366 1.00 0.98 H new ATOM 0 HA PHE A 100 0.834 -6.753 11.078 1.00 1.14 H new ATOM 0 HB2 PHE A 100 1.753 -3.863 11.149 1.00 1.19 H new ATOM 0 HB3 PHE A 100 2.560 -5.252 10.449 1.00 1.19 H new ATOM 0 HD1 PHE A 100 0.681 -6.569 8.749 1.00 1.64 H new ATOM 0 HD2 PHE A 100 1.046 -2.353 9.492 1.00 1.67 H new ATOM 0 HE1 PHE A 100 -0.404 -6.092 6.574 1.00 1.69 H new ATOM 0 HE2 PHE A 100 -0.034 -1.876 7.312 1.00 1.79 H new ATOM 0 HZ PHE A 100 -0.761 -3.747 5.853 1.00 1.38 H new ATOM 1491 N SER A 101 0.970 -4.435 13.422 1.00 1.34 N ATOM 1492 CA SER A 101 1.310 -4.239 14.858 1.00 1.52 C ATOM 1493 C SER A 101 2.791 -4.574 15.034 1.00 1.61 C ATOM 1494 O SER A 101 3.644 -3.721 14.887 1.00 1.99 O ATOM 1495 CB SER A 101 0.429 -5.112 15.767 1.00 1.79 C ATOM 1496 OG SER A 101 0.547 -4.654 17.107 1.00 2.21 O ATOM 0 H SER A 101 0.741 -3.579 12.917 1.00 1.34 H new ATOM 0 HA SER A 101 1.121 -3.206 15.149 1.00 1.52 H new ATOM 0 HB2 SER A 101 -0.611 -5.063 15.443 1.00 1.79 H new ATOM 0 HB3 SER A 101 0.735 -6.156 15.698 1.00 1.79 H new ATOM 0 HG SER A 101 -0.014 -5.205 17.692 1.00 2.21 H new ATOM 1502 N ASP A 102 3.105 -5.805 15.330 1.00 1.99 N ATOM 1503 CA ASP A 102 4.534 -6.194 15.500 1.00 2.34 C ATOM 1504 C ASP A 102 4.620 -7.689 15.821 1.00 2.07 C ATOM 1505 O ASP A 102 5.086 -8.079 16.873 1.00 2.62 O ATOM 1506 CB ASP A 102 5.160 -5.384 16.639 1.00 3.15 C ATOM 1507 CG ASP A 102 4.185 -5.331 17.816 1.00 3.78 C ATOM 1508 OD1 ASP A 102 3.578 -6.350 18.103 1.00 4.42 O ATOM 1509 OD2 ASP A 102 4.060 -4.273 18.411 1.00 4.10 O ATOM 0 H ASP A 102 2.432 -6.560 15.462 1.00 1.99 H new ATOM 0 HA ASP A 102 5.077 -5.989 14.577 1.00 2.34 H new ATOM 0 HB2 ASP A 102 6.100 -5.839 16.951 1.00 3.15 H new ATOM 0 HB3 ASP A 102 5.392 -4.375 16.298 1.00 3.15 H new ATOM 1514 N GLY A 103 4.182 -8.531 14.921 1.00 2.05 N ATOM 1515 CA GLY A 103 4.255 -9.997 15.187 1.00 2.45 C ATOM 1516 C GLY A 103 3.440 -10.773 14.147 1.00 2.44 C ATOM 1517 O GLY A 103 2.949 -11.851 14.417 1.00 3.08 O ATOM 0 H GLY A 103 3.780 -8.269 14.021 1.00 2.05 H new ATOM 0 HA2 GLY A 103 5.294 -10.326 15.162 1.00 2.45 H new ATOM 0 HA3 GLY A 103 3.877 -10.210 16.187 1.00 2.45 H new ATOM 1521 N ASN A 104 3.295 -10.248 12.960 1.00 2.29 N ATOM 1522 CA ASN A 104 2.515 -10.980 11.917 1.00 2.55 C ATOM 1523 C ASN A 104 2.680 -10.287 10.561 1.00 2.17 C ATOM 1524 O ASN A 104 1.742 -10.173 9.797 1.00 2.54 O ATOM 1525 CB ASN A 104 1.032 -10.996 12.300 1.00 3.20 C ATOM 1526 CG ASN A 104 0.534 -9.560 12.405 1.00 3.72 C ATOM 1527 OD1 ASN A 104 1.309 -8.667 12.655 1.00 4.05 O ATOM 1528 ND2 ASN A 104 -0.731 -9.296 12.215 1.00 4.31 N ATOM 0 H ASN A 104 3.680 -9.350 12.667 1.00 2.29 H new ATOM 0 HA ASN A 104 2.886 -12.003 11.848 1.00 2.55 H new ATOM 0 HB2 ASN A 104 0.456 -11.541 11.553 1.00 3.20 H new ATOM 0 HB3 ASN A 104 0.893 -11.513 13.249 1.00 3.20 H new ATOM 0 HD21 ASN A 104 -1.066 -8.335 12.277 1.00 4.31 H new ATOM 0 HD22 ASN A 104 -1.383 -10.051 12.004 1.00 4.31 H new ATOM 1535 N PHE A 105 3.863 -9.828 10.250 1.00 1.90 N ATOM 1536 CA PHE A 105 4.076 -9.152 8.936 1.00 1.74 C ATOM 1537 C PHE A 105 3.757 -10.139 7.813 1.00 1.59 C ATOM 1538 O PHE A 105 3.648 -11.327 8.043 1.00 1.88 O ATOM 1539 CB PHE A 105 5.531 -8.697 8.827 1.00 2.03 C ATOM 1540 CG PHE A 105 5.797 -7.636 9.868 1.00 1.75 C ATOM 1541 CD1 PHE A 105 5.301 -6.341 9.684 1.00 2.14 C ATOM 1542 CD2 PHE A 105 6.534 -7.947 11.018 1.00 2.28 C ATOM 1543 CE1 PHE A 105 5.540 -5.356 10.649 1.00 2.60 C ATOM 1544 CE2 PHE A 105 6.774 -6.961 11.983 1.00 2.84 C ATOM 1545 CZ PHE A 105 6.277 -5.666 11.798 1.00 2.84 C ATOM 0 H PHE A 105 4.688 -9.891 10.846 1.00 1.90 H new ATOM 0 HA PHE A 105 3.424 -8.282 8.855 1.00 1.74 H new ATOM 0 HB2 PHE A 105 6.202 -9.544 8.973 1.00 2.03 H new ATOM 0 HB3 PHE A 105 5.728 -8.303 7.830 1.00 2.03 H new ATOM 0 HD1 PHE A 105 4.733 -6.101 8.797 1.00 2.14 H new ATOM 0 HD2 PHE A 105 6.917 -8.947 11.160 1.00 2.28 H new ATOM 0 HE1 PHE A 105 5.156 -4.357 10.507 1.00 2.60 H new ATOM 0 HE2 PHE A 105 7.342 -7.200 12.870 1.00 2.84 H new ATOM 0 HZ PHE A 105 6.462 -4.905 12.542 1.00 2.84 H new ATOM 1555 N ASN A 106 3.581 -9.674 6.604 1.00 1.85 N ATOM 1556 CA ASN A 106 3.242 -10.598 5.484 1.00 1.93 C ATOM 1557 C ASN A 106 3.316 -9.819 4.166 1.00 1.72 C ATOM 1558 O ASN A 106 2.828 -8.713 4.061 1.00 2.31 O ATOM 1559 CB ASN A 106 1.819 -11.122 5.678 1.00 2.62 C ATOM 1560 CG ASN A 106 0.888 -9.954 6.013 1.00 3.11 C ATOM 1561 OD1 ASN A 106 0.530 -9.757 7.158 1.00 3.46 O ATOM 1562 ND2 ASN A 106 0.478 -9.166 5.057 1.00 3.79 N ATOM 0 H ASN A 106 3.658 -8.691 6.344 1.00 1.85 H new ATOM 0 HA ASN A 106 3.940 -11.435 5.465 1.00 1.93 H new ATOM 0 HB2 ASN A 106 1.478 -11.625 4.773 1.00 2.62 H new ATOM 0 HB3 ASN A 106 1.798 -11.860 6.480 1.00 2.62 H new ATOM 0 HD21 ASN A 106 -0.143 -8.385 5.271 1.00 3.79 H new ATOM 0 HD22 ASN A 106 0.778 -9.331 4.096 1.00 3.79 H new ATOM 1569 N TRP A 107 3.926 -10.386 3.159 1.00 1.54 N ATOM 1570 CA TRP A 107 4.038 -9.676 1.849 1.00 1.68 C ATOM 1571 C TRP A 107 2.669 -9.118 1.436 1.00 1.47 C ATOM 1572 O TRP A 107 2.565 -8.252 0.590 1.00 1.49 O ATOM 1573 CB TRP A 107 4.539 -10.661 0.793 1.00 2.30 C ATOM 1574 CG TRP A 107 3.832 -11.969 0.948 1.00 2.32 C ATOM 1575 CD1 TRP A 107 4.265 -13.004 1.707 1.00 2.69 C ATOM 1576 CD2 TRP A 107 2.582 -12.403 0.340 1.00 2.77 C ATOM 1577 NE1 TRP A 107 3.362 -14.047 1.597 1.00 3.12 N ATOM 1578 CE2 TRP A 107 2.309 -13.726 0.764 1.00 3.35 C ATOM 1579 CE3 TRP A 107 1.671 -11.784 -0.533 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 1.172 -14.410 0.333 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 0.526 -12.470 -0.969 1.00 4.29 C ATOM 1582 CH2 TRP A 107 0.278 -13.781 -0.538 1.00 4.80 C ATOM 0 H TRP A 107 4.353 -11.312 3.186 1.00 1.54 H new ATOM 0 HA TRP A 107 4.739 -8.846 1.940 1.00 1.68 H new ATOM 0 HB2 TRP A 107 4.365 -10.259 -0.205 1.00 2.30 H new ATOM 0 HB3 TRP A 107 5.615 -10.804 0.896 1.00 2.30 H new ATOM 0 HD1 TRP A 107 5.167 -13.014 2.301 1.00 2.69 H new ATOM 0 HE1 TRP A 107 3.462 -14.943 2.073 1.00 3.12 H new ATOM 0 HE3 TRP A 107 1.853 -10.774 -0.871 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 0.984 -15.419 0.670 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 -0.168 -11.985 -1.640 1.00 4.29 H new ATOM 0 HH2 TRP A 107 -0.603 -14.304 -0.879 1.00 4.80 H new ATOM 1593 N GLY A 108 1.626 -9.603 2.049 1.00 1.41 N ATOM 1594 CA GLY A 108 0.262 -9.097 1.718 1.00 1.47 C ATOM 1595 C GLY A 108 0.150 -7.650 2.204 1.00 1.05 C ATOM 1596 O GLY A 108 -0.536 -6.833 1.622 1.00 1.02 O ATOM 0 H GLY A 108 1.658 -10.328 2.765 1.00 1.41 H new ATOM 0 HA2 GLY A 108 0.089 -9.150 0.643 1.00 1.47 H new ATOM 0 HA3 GLY A 108 -0.498 -9.717 2.194 1.00 1.47 H new ATOM 1600 N ARG A 109 0.846 -7.331 3.257 1.00 0.86 N ATOM 1601 CA ARG A 109 0.837 -5.945 3.799 1.00 0.87 C ATOM 1602 C ARG A 109 1.127 -4.916 2.707 1.00 0.70 C ATOM 1603 O ARG A 109 0.796 -3.755 2.845 1.00 0.81 O ATOM 1604 CB ARG A 109 1.941 -5.848 4.868 1.00 1.08 C ATOM 1605 CG ARG A 109 3.353 -6.021 4.258 1.00 1.48 C ATOM 1606 CD ARG A 109 4.129 -4.694 4.337 1.00 1.96 C ATOM 1607 NE ARG A 109 5.407 -4.788 3.560 1.00 2.74 N ATOM 1608 CZ ARG A 109 6.265 -5.756 3.757 1.00 3.19 C ATOM 1609 NH1 ARG A 109 6.147 -6.554 4.781 1.00 3.19 N ATOM 1610 NH2 ARG A 109 7.288 -5.881 2.961 1.00 4.08 N ATOM 0 H ARG A 109 1.432 -7.985 3.775 1.00 0.86 H new ATOM 0 HA ARG A 109 -0.149 -5.734 4.214 1.00 0.87 H new ATOM 0 HB2 ARG A 109 1.878 -4.882 5.368 1.00 1.08 H new ATOM 0 HB3 ARG A 109 1.778 -6.612 5.628 1.00 1.08 H new ATOM 0 HG2 ARG A 109 3.895 -6.801 4.792 1.00 1.48 H new ATOM 0 HG3 ARG A 109 3.272 -6.343 3.220 1.00 1.48 H new ATOM 0 HD2 ARG A 109 3.516 -3.883 3.944 1.00 1.96 H new ATOM 0 HD3 ARG A 109 4.346 -4.454 5.378 1.00 1.96 H new ATOM 0 HE ARG A 109 5.614 -4.078 2.858 1.00 2.74 H new ATOM 0 HH11 ARG A 109 5.379 -6.428 5.440 1.00 3.19 H new ATOM 0 HH12 ARG A 109 6.823 -7.305 4.923 1.00 3.19 H new ATOM 0 HH21 ARG A 109 7.417 -5.226 2.189 1.00 4.08 H new ATOM 0 HH22 ARG A 109 7.961 -6.633 3.109 1.00 4.08 H new ATOM 1624 N VAL A 110 1.774 -5.304 1.633 1.00 0.60 N ATOM 1625 CA VAL A 110 2.104 -4.296 0.577 1.00 0.68 C ATOM 1626 C VAL A 110 0.887 -4.013 -0.301 1.00 0.56 C ATOM 1627 O VAL A 110 0.567 -2.868 -0.557 1.00 0.60 O ATOM 1628 CB VAL A 110 3.247 -4.802 -0.308 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.812 -3.649 -1.138 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.353 -5.396 0.558 1.00 1.73 C ATOM 0 H VAL A 110 2.083 -6.258 1.444 1.00 0.60 H new ATOM 0 HA VAL A 110 2.408 -3.377 1.079 1.00 0.68 H new ATOM 0 HB VAL A 110 2.861 -5.572 -0.976 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.625 -4.016 -1.765 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.025 -3.235 -1.769 1.00 1.27 H new ATOM 0 HG13 VAL A 110 4.190 -2.873 -0.473 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.162 -5.753 -0.079 1.00 1.73 H new ATOM 0 HG22 VAL A 110 4.735 -4.632 1.235 1.00 1.73 H new ATOM 0 HG23 VAL A 110 3.954 -6.228 1.138 1.00 1.73 H new ATOM 1640 N VAL A 111 0.208 -5.031 -0.780 1.00 0.51 N ATOM 1641 CA VAL A 111 -0.976 -4.765 -1.665 1.00 0.50 C ATOM 1642 C VAL A 111 -2.227 -4.611 -0.793 1.00 0.46 C ATOM 1643 O VAL A 111 -3.193 -3.985 -1.180 1.00 0.47 O ATOM 1644 CB VAL A 111 -1.154 -5.907 -2.672 1.00 0.58 C ATOM 1645 CG1 VAL A 111 -0.170 -5.746 -3.831 1.00 1.41 C ATOM 1646 CG2 VAL A 111 -0.887 -7.240 -1.965 1.00 1.36 C ATOM 0 H VAL A 111 0.415 -6.014 -0.602 1.00 0.51 H new ATOM 0 HA VAL A 111 -0.815 -3.845 -2.226 1.00 0.50 H new ATOM 0 HB VAL A 111 -2.171 -5.886 -3.064 1.00 0.58 H new ATOM 0 HG11 VAL A 111 -0.306 -6.563 -4.540 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -0.352 -4.796 -4.333 1.00 1.41 H new ATOM 0 HG13 VAL A 111 0.850 -5.764 -3.447 1.00 1.41 H new ATOM 0 HG21 VAL A 111 -1.011 -8.059 -2.674 1.00 1.36 H new ATOM 0 HG22 VAL A 111 0.131 -7.248 -1.576 1.00 1.36 H new ATOM 0 HG23 VAL A 111 -1.591 -7.363 -1.142 1.00 1.36 H new ATOM 1656 N ALA A 112 -2.198 -5.152 0.394 1.00 0.45 N ATOM 1657 CA ALA A 112 -3.366 -5.015 1.311 1.00 0.47 C ATOM 1658 C ALA A 112 -3.472 -3.555 1.770 1.00 0.46 C ATOM 1659 O ALA A 112 -4.555 -3.025 1.918 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.182 -5.932 2.523 1.00 0.53 C ATOM 0 H ALA A 112 -1.414 -5.685 0.770 1.00 0.45 H new ATOM 0 HA ALA A 112 -4.280 -5.301 0.790 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.038 -5.829 3.190 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.106 -6.967 2.188 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.272 -5.654 3.054 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.370 -2.891 1.973 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.434 -1.462 2.395 1.00 0.43 C ATOM 1668 C LEU A 113 -2.763 -0.589 1.171 1.00 0.42 C ATOM 1669 O LEU A 113 -3.686 0.201 1.188 1.00 0.45 O ATOM 1670 CB LEU A 113 -1.067 -1.051 2.985 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.265 -0.026 4.111 1.00 0.51 C ATOM 1672 CD1 LEU A 113 0.090 0.346 4.708 1.00 1.45 C ATOM 1673 CD2 LEU A 113 -1.939 1.229 3.549 1.00 1.27 C ATOM 0 H LEU A 113 -1.430 -3.273 1.866 1.00 0.43 H new ATOM 0 HA LEU A 113 -3.208 -1.327 3.150 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.549 -1.930 3.369 1.00 0.44 H new ATOM 0 HB3 LEU A 113 -0.437 -0.627 2.203 1.00 0.44 H new ATOM 0 HG LEU A 113 -1.896 -0.459 4.887 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -0.052 1.074 5.507 1.00 1.45 H new ATOM 0 HD12 LEU A 113 0.568 -0.547 5.111 1.00 1.45 H new ATOM 0 HD13 LEU A 113 0.723 0.777 3.933 1.00 1.45 H new ATOM 0 HD21 LEU A 113 -2.079 1.956 4.349 1.00 1.27 H new ATOM 0 HD22 LEU A 113 -1.310 1.662 2.771 1.00 1.27 H new ATOM 0 HD23 LEU A 113 -2.908 0.963 3.126 1.00 1.27 H new ATOM 1685 N PHE A 114 -2.013 -0.736 0.113 1.00 0.40 N ATOM 1686 CA PHE A 114 -2.266 0.067 -1.121 1.00 0.40 C ATOM 1687 C PHE A 114 -3.704 -0.122 -1.605 1.00 0.39 C ATOM 1688 O PHE A 114 -4.395 0.825 -1.921 1.00 0.41 O ATOM 1689 CB PHE A 114 -1.296 -0.384 -2.218 1.00 0.41 C ATOM 1690 CG PHE A 114 0.164 -0.235 -1.786 1.00 0.44 C ATOM 1691 CD1 PHE A 114 0.542 0.463 -0.612 1.00 1.29 C ATOM 1692 CD2 PHE A 114 1.160 -0.806 -2.592 1.00 1.27 C ATOM 1693 CE1 PHE A 114 1.894 0.576 -0.270 1.00 1.38 C ATOM 1694 CE2 PHE A 114 2.510 -0.686 -2.241 1.00 1.27 C ATOM 1695 CZ PHE A 114 2.876 0.005 -1.083 1.00 0.68 C ATOM 0 H PHE A 114 -1.228 -1.384 0.049 1.00 0.40 H new ATOM 0 HA PHE A 114 -2.114 1.122 -0.893 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -1.495 -1.425 -2.473 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -1.469 0.203 -3.120 1.00 0.41 H new ATOM 0 HD1 PHE A 114 -0.214 0.908 0.019 1.00 1.29 H new ATOM 0 HD2 PHE A 114 0.884 -1.341 -3.488 1.00 1.27 H new ATOM 0 HE1 PHE A 114 2.180 1.107 0.626 1.00 1.38 H new ATOM 0 HE2 PHE A 114 3.271 -1.129 -2.867 1.00 1.27 H new ATOM 0 HZ PHE A 114 3.918 0.098 -0.816 1.00 0.68 H new ATOM 1705 N TYR A 115 -4.159 -1.341 -1.666 1.00 0.40 N ATOM 1706 CA TYR A 115 -5.551 -1.592 -2.132 1.00 0.41 C ATOM 1707 C TYR A 115 -6.545 -1.005 -1.124 1.00 0.41 C ATOM 1708 O TYR A 115 -7.593 -0.498 -1.485 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.776 -3.103 -2.266 1.00 0.44 C ATOM 1710 CG TYR A 115 -7.009 -3.369 -3.102 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -6.976 -3.144 -4.483 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -8.182 -3.842 -2.498 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -8.113 -3.392 -5.260 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -9.319 -4.089 -3.276 1.00 1.26 C ATOM 1715 CZ TYR A 115 -9.285 -3.864 -4.657 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.405 -4.107 -5.425 1.00 0.70 O ATOM 0 H TYR A 115 -3.628 -2.175 -1.414 1.00 0.40 H new ATOM 0 HA TYR A 115 -5.704 -1.116 -3.101 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.906 -3.569 -2.728 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.892 -3.551 -1.279 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -6.073 -2.779 -4.949 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -8.209 -4.016 -1.432 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -8.086 -3.219 -6.326 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -10.223 -4.453 -2.811 1.00 1.26 H new ATOM 0 HH TYR A 115 -11.131 -4.431 -4.852 1.00 0.70 H new ATOM 1726 N PHE A 116 -6.217 -1.054 0.137 1.00 0.38 N ATOM 1727 CA PHE A 116 -7.136 -0.491 1.163 1.00 0.38 C ATOM 1728 C PHE A 116 -7.224 1.029 0.994 1.00 0.36 C ATOM 1729 O PHE A 116 -8.296 1.605 0.992 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.595 -0.816 2.561 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.432 -0.113 3.612 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.790 -0.428 3.747 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -6.853 0.852 4.450 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -9.567 0.219 4.716 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -7.631 1.498 5.418 1.00 1.37 C ATOM 1736 CZ PHE A 116 -8.988 1.181 5.551 1.00 0.45 C ATOM 0 H PHE A 116 -5.354 -1.459 0.500 1.00 0.38 H new ATOM 0 HA PHE A 116 -8.127 -0.928 1.042 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.615 -1.893 2.727 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.555 -0.501 2.641 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -9.238 -1.170 3.103 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -5.806 1.097 4.348 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -10.614 -0.025 4.819 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -7.184 2.241 6.062 1.00 1.37 H new ATOM 0 HZ PHE A 116 -9.588 1.679 6.298 1.00 0.45 H new ATOM 1746 N ALA A 117 -6.104 1.684 0.842 1.00 0.35 N ATOM 1747 CA ALA A 117 -6.130 3.159 0.666 1.00 0.34 C ATOM 1748 C ALA A 117 -6.782 3.501 -0.675 1.00 0.34 C ATOM 1749 O ALA A 117 -7.434 4.515 -0.816 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.702 3.709 0.698 1.00 0.37 C ATOM 0 H ALA A 117 -5.176 1.260 0.833 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.705 3.609 1.475 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -4.726 4.791 0.569 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -4.241 3.468 1.656 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -4.121 3.260 -0.108 1.00 0.37 H new ATOM 1756 N SER A 118 -6.619 2.661 -1.663 1.00 0.35 N ATOM 1757 CA SER A 118 -7.234 2.944 -2.989 1.00 0.37 C ATOM 1758 C SER A 118 -8.724 3.242 -2.820 1.00 0.36 C ATOM 1759 O SER A 118 -9.256 4.170 -3.396 1.00 0.36 O ATOM 1760 CB SER A 118 -7.064 1.725 -3.897 1.00 0.42 C ATOM 1761 OG SER A 118 -7.538 2.038 -5.200 1.00 1.25 O ATOM 0 H SER A 118 -6.087 1.793 -1.607 1.00 0.35 H new ATOM 0 HA SER A 118 -6.742 3.809 -3.434 1.00 0.37 H new ATOM 0 HB2 SER A 118 -6.015 1.433 -3.940 1.00 0.42 H new ATOM 0 HB3 SER A 118 -7.615 0.876 -3.492 1.00 0.42 H new ATOM 0 HG SER A 118 -7.429 1.259 -5.784 1.00 1.25 H new ATOM 1767 N LYS A 119 -9.391 2.479 -1.996 1.00 0.37 N ATOM 1768 CA LYS A 119 -10.842 2.734 -1.748 1.00 0.39 C ATOM 1769 C LYS A 119 -10.986 4.105 -1.077 1.00 0.36 C ATOM 1770 O LYS A 119 -11.733 4.945 -1.538 1.00 0.38 O ATOM 1771 CB LYS A 119 -11.430 1.641 -0.839 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.928 0.250 -1.261 1.00 1.29 C ATOM 1773 CD LYS A 119 -11.502 -0.127 -2.630 1.00 1.84 C ATOM 1774 CE LYS A 119 -10.942 -1.484 -3.057 1.00 2.48 C ATOM 1775 NZ LYS A 119 -9.467 -1.373 -3.235 1.00 3.36 N ATOM 0 H LYS A 119 -8.995 1.691 -1.484 1.00 0.37 H new ATOM 0 HA LYS A 119 -11.385 2.720 -2.693 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -11.151 1.834 0.197 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -12.519 1.669 -0.886 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.839 0.245 -1.302 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -11.222 -0.492 -0.518 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -12.590 -0.169 -2.582 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -11.245 0.634 -3.367 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -11.174 -2.239 -2.306 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -11.409 -1.807 -3.987 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -9.084 -2.290 -3.542 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -9.257 -0.652 -3.955 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -9.028 -1.099 -2.333 1.00 3.36 H new ATOM 1789 N LEU A 120 -10.266 4.361 -0.022 1.00 0.36 N ATOM 1790 CA LEU A 120 -10.366 5.705 0.624 1.00 0.35 C ATOM 1791 C LEU A 120 -10.154 6.786 -0.447 1.00 0.33 C ATOM 1792 O LEU A 120 -10.858 7.776 -0.501 1.00 0.39 O ATOM 1793 CB LEU A 120 -9.286 5.828 1.702 1.00 0.36 C ATOM 1794 CG LEU A 120 -9.337 4.607 2.630 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -8.329 4.798 3.766 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -10.748 4.452 3.220 1.00 1.28 C ATOM 0 H LEU A 120 -9.618 3.708 0.420 1.00 0.36 H new ATOM 0 HA LEU A 120 -11.347 5.829 1.082 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -8.303 5.903 1.238 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -9.437 6.741 2.278 1.00 0.36 H new ATOM 0 HG LEU A 120 -9.090 3.711 2.060 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -8.360 3.934 4.429 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -7.327 4.900 3.350 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -8.581 5.697 4.329 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -10.774 3.583 3.877 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -11.004 5.345 3.790 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -11.467 4.318 2.412 1.00 1.28 H new ATOM 1808 N VAL A 121 -9.201 6.576 -1.315 1.00 0.33 N ATOM 1809 CA VAL A 121 -8.926 7.542 -2.421 1.00 0.39 C ATOM 1810 C VAL A 121 -10.060 7.496 -3.453 1.00 0.36 C ATOM 1811 O VAL A 121 -10.813 8.436 -3.602 1.00 0.39 O ATOM 1812 CB VAL A 121 -7.605 7.170 -3.100 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -7.341 8.131 -4.262 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -6.464 7.288 -2.084 1.00 1.18 C ATOM 0 H VAL A 121 -8.589 5.760 -1.305 1.00 0.33 H new ATOM 0 HA VAL A 121 -8.860 8.549 -2.009 1.00 0.39 H new ATOM 0 HB VAL A 121 -7.664 6.148 -3.475 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -6.401 7.867 -4.746 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -8.154 8.060 -4.985 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -7.280 9.151 -3.884 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -5.521 7.024 -2.563 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -6.409 8.312 -1.716 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -6.649 6.612 -1.249 1.00 1.18 H new ATOM 1824 N LEU A 122 -10.183 6.414 -4.174 1.00 0.37 N ATOM 1825 CA LEU A 122 -11.265 6.318 -5.199 1.00 0.39 C ATOM 1826 C LEU A 122 -12.605 6.742 -4.579 1.00 0.40 C ATOM 1827 O LEU A 122 -13.298 7.596 -5.102 1.00 0.40 O ATOM 1828 CB LEU A 122 -11.360 4.869 -5.719 1.00 0.42 C ATOM 1829 CG LEU A 122 -10.437 4.676 -6.928 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -8.983 4.888 -6.506 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -10.609 3.256 -7.472 1.00 1.24 C ATOM 0 H LEU A 122 -9.582 5.593 -4.099 1.00 0.37 H new ATOM 0 HA LEU A 122 -11.033 6.981 -6.032 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -11.084 4.172 -4.927 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -12.389 4.642 -5.999 1.00 0.42 H new ATOM 0 HG LEU A 122 -10.695 5.399 -7.701 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -8.330 4.750 -7.368 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -8.861 5.899 -6.116 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -8.720 4.167 -5.732 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -9.955 3.114 -8.332 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -10.350 2.535 -6.696 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -11.645 3.106 -7.776 1.00 1.24 H new ATOM 1843 N LYS A 123 -12.977 6.162 -3.472 1.00 0.51 N ATOM 1844 CA LYS A 123 -14.268 6.548 -2.838 1.00 0.55 C ATOM 1845 C LYS A 123 -14.312 8.070 -2.676 1.00 0.54 C ATOM 1846 O LYS A 123 -15.354 8.682 -2.784 1.00 0.55 O ATOM 1847 CB LYS A 123 -14.397 5.873 -1.470 1.00 0.59 C ATOM 1848 CG LYS A 123 -15.850 5.955 -0.993 1.00 0.97 C ATOM 1849 CD LYS A 123 -15.961 5.367 0.415 1.00 1.37 C ATOM 1850 CE LYS A 123 -17.435 5.158 0.767 1.00 1.74 C ATOM 1851 NZ LYS A 123 -17.969 3.993 0.006 1.00 2.32 N ATOM 0 H LYS A 123 -12.447 5.442 -2.982 1.00 0.51 H new ATOM 0 HA LYS A 123 -15.097 6.225 -3.468 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -14.083 4.831 -1.536 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -13.739 6.359 -0.750 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -16.185 6.992 -0.993 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -16.500 5.410 -1.678 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -15.426 4.419 0.468 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.495 6.037 1.138 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -17.543 4.986 1.838 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -18.007 6.055 0.529 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -18.820 3.629 0.481 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -18.212 4.291 -0.960 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -17.248 3.245 -0.034 1.00 2.32 H new ATOM 1865 N ALA A 124 -13.188 8.684 -2.413 1.00 0.52 N ATOM 1866 CA ALA A 124 -13.166 10.165 -2.238 1.00 0.52 C ATOM 1867 C ALA A 124 -13.234 10.858 -3.602 1.00 0.51 C ATOM 1868 O ALA A 124 -13.712 11.965 -3.733 1.00 0.54 O ATOM 1869 CB ALA A 124 -11.880 10.576 -1.518 1.00 0.51 C ATOM 0 H ALA A 124 -12.284 8.223 -2.312 1.00 0.52 H new ATOM 0 HA ALA A 124 -14.029 10.465 -1.644 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -11.864 11.658 -1.390 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -11.840 10.095 -0.541 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -11.018 10.268 -2.109 1.00 0.51 H new ATOM 1875 N LEU A 125 -12.745 10.207 -4.624 1.00 0.47 N ATOM 1876 CA LEU A 125 -12.768 10.811 -5.976 1.00 0.47 C ATOM 1877 C LEU A 125 -14.206 11.196 -6.339 1.00 0.48 C ATOM 1878 O LEU A 125 -14.453 12.242 -6.904 1.00 0.48 O ATOM 1879 CB LEU A 125 -12.239 9.787 -6.989 1.00 0.51 C ATOM 1880 CG LEU A 125 -11.881 10.503 -8.307 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.399 10.899 -8.310 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -12.157 9.583 -9.502 1.00 1.21 C ATOM 0 H LEU A 125 -12.329 9.277 -4.574 1.00 0.47 H new ATOM 0 HA LEU A 125 -12.142 11.703 -5.993 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -11.360 9.283 -6.587 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -12.991 9.020 -7.173 1.00 0.51 H new ATOM 0 HG LEU A 125 -12.497 11.399 -8.388 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.159 11.404 -9.246 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -10.200 11.570 -7.475 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -9.783 10.005 -8.212 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -11.900 10.100 -10.426 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -11.554 8.679 -9.412 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -13.213 9.314 -9.518 1.00 1.21 H new ATOM 1894 N CYS A 126 -15.155 10.365 -6.006 1.00 0.52 N ATOM 1895 CA CYS A 126 -16.578 10.694 -6.323 1.00 0.57 C ATOM 1896 C CYS A 126 -17.018 11.890 -5.463 1.00 0.57 C ATOM 1897 O CYS A 126 -17.654 12.812 -5.930 1.00 0.68 O ATOM 1898 CB CYS A 126 -17.462 9.479 -6.031 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.929 8.084 -7.056 1.00 1.67 S ATOM 0 H CYS A 126 -15.010 9.475 -5.530 1.00 0.52 H new ATOM 0 HA CYS A 126 -16.675 10.953 -7.377 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -17.397 9.214 -4.976 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -18.506 9.717 -6.237 1.00 0.66 H new ATOM 0 HG CYS A 126 -17.678 7.051 -6.807 1.00 1.67 H new ATOM 1905 N THR A 127 -16.648 11.873 -4.214 1.00 0.57 N ATOM 1906 CA THR A 127 -16.985 12.996 -3.286 1.00 0.60 C ATOM 1907 C THR A 127 -16.363 14.292 -3.797 1.00 0.62 C ATOM 1908 O THR A 127 -16.747 15.378 -3.412 1.00 0.70 O ATOM 1909 CB THR A 127 -16.426 12.649 -1.891 1.00 0.60 C ATOM 1910 OG1 THR A 127 -15.008 12.616 -1.917 1.00 1.14 O ATOM 1911 CG2 THR A 127 -16.995 11.274 -1.553 1.00 1.19 C ATOM 0 H THR A 127 -16.116 11.115 -3.786 1.00 0.57 H new ATOM 0 HA THR A 127 -18.065 13.133 -3.231 1.00 0.60 H new ATOM 0 HB THR A 127 -16.707 13.393 -1.145 1.00 0.60 H new ATOM 0 HG1 THR A 127 -14.701 12.462 -2.835 1.00 1.14 H new ATOM 0 HG21 THR A 127 -16.638 10.964 -0.571 1.00 1.19 H new ATOM 0 HG22 THR A 127 -18.084 11.323 -1.544 1.00 1.19 H new ATOM 0 HG23 THR A 127 -16.671 10.552 -2.302 1.00 1.19 H new ATOM 1919 N LYS A 128 -15.385 14.170 -4.665 1.00 0.60 N ATOM 1920 CA LYS A 128 -14.703 15.374 -5.220 1.00 0.70 C ATOM 1921 C LYS A 128 -14.179 16.226 -4.070 1.00 0.61 C ATOM 1922 O LYS A 128 -14.755 17.247 -3.748 1.00 0.60 O ATOM 1923 CB LYS A 128 -15.675 16.202 -6.071 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.995 15.461 -7.371 1.00 1.12 C ATOM 1925 CD LYS A 128 -17.063 16.238 -8.146 1.00 1.43 C ATOM 1926 CE LYS A 128 -17.247 15.615 -9.531 1.00 1.83 C ATOM 1927 NZ LYS A 128 -16.030 15.863 -10.354 1.00 2.47 N ATOM 0 H LYS A 128 -15.031 13.279 -5.012 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.876 15.052 -5.853 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -16.593 16.387 -5.513 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -15.237 17.175 -6.296 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -15.094 15.357 -7.975 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -16.349 14.454 -7.151 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -18.007 16.222 -7.601 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -16.769 17.283 -8.242 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -17.424 14.543 -9.439 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -18.123 16.042 -10.020 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -16.272 15.789 -11.363 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -15.665 16.816 -10.155 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -15.303 15.158 -10.120 1.00 2.47 H new ATOM 1941 N VAL A 129 -13.099 15.828 -3.436 1.00 0.60 N ATOM 1942 CA VAL A 129 -12.555 16.637 -2.299 1.00 0.53 C ATOM 1943 C VAL A 129 -11.013 16.628 -2.367 1.00 0.53 C ATOM 1944 O VAL A 129 -10.386 15.855 -1.671 1.00 0.56 O ATOM 1945 CB VAL A 129 -13.006 15.999 -0.984 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -12.652 16.922 0.180 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -14.518 15.770 -1.018 1.00 1.22 C ATOM 0 H VAL A 129 -12.574 14.982 -3.656 1.00 0.60 H new ATOM 0 HA VAL A 129 -12.918 17.663 -2.359 1.00 0.53 H new ATOM 0 HB VAL A 129 -12.499 15.043 -0.853 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -12.974 16.466 1.116 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -11.574 17.079 0.205 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -13.155 17.880 0.051 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -14.838 15.315 -0.081 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -15.028 16.724 -1.151 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -14.767 15.107 -1.847 1.00 1.22 H new ATOM 1957 N PRO A 130 -10.435 17.468 -3.211 1.00 0.62 N ATOM 1958 CA PRO A 130 -8.963 17.521 -3.364 1.00 0.73 C ATOM 1959 C PRO A 130 -8.293 17.873 -2.025 1.00 0.65 C ATOM 1960 O PRO A 130 -7.102 17.701 -1.851 1.00 0.64 O ATOM 1961 CB PRO A 130 -8.702 18.578 -4.456 1.00 1.00 C ATOM 1962 CG PRO A 130 -10.088 19.135 -4.903 1.00 1.00 C ATOM 1963 CD PRO A 130 -11.176 18.419 -4.068 1.00 0.75 C ATOM 0 HA PRO A 130 -8.538 16.560 -3.655 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -8.071 19.380 -4.072 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -8.175 18.135 -5.301 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -10.135 20.213 -4.748 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -10.245 18.959 -5.967 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -11.745 19.130 -3.469 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -11.888 17.900 -4.709 1.00 0.75 H new ATOM 1971 N GLU A 131 -9.056 18.306 -1.073 1.00 0.73 N ATOM 1972 CA GLU A 131 -8.493 18.611 0.269 1.00 0.82 C ATOM 1973 C GLU A 131 -8.221 17.304 1.014 1.00 0.72 C ATOM 1974 O GLU A 131 -7.285 17.177 1.781 1.00 0.73 O ATOM 1975 CB GLU A 131 -9.548 19.411 1.051 1.00 1.09 C ATOM 1976 CG GLU A 131 -9.589 20.847 0.496 1.00 1.55 C ATOM 1977 CD GLU A 131 -10.539 21.705 1.328 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -11.670 21.293 1.514 1.00 2.52 O ATOM 1979 OE2 GLU A 131 -10.117 22.765 1.763 1.00 2.86 O ATOM 0 H GLU A 131 -10.059 18.465 -1.164 1.00 0.73 H new ATOM 0 HA GLU A 131 -7.566 19.175 0.171 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -10.527 18.941 0.955 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -9.303 19.423 2.113 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -8.589 21.280 0.511 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -9.915 20.834 -0.544 1.00 1.55 H new ATOM 1986 N LEU A 132 -9.052 16.319 0.766 1.00 0.71 N ATOM 1987 CA LEU A 132 -8.904 14.987 1.417 1.00 0.69 C ATOM 1988 C LEU A 132 -7.909 14.126 0.632 1.00 0.58 C ATOM 1989 O LEU A 132 -6.956 13.626 1.193 1.00 0.59 O ATOM 1990 CB LEU A 132 -10.275 14.293 1.454 1.00 0.80 C ATOM 1991 CG LEU A 132 -10.180 12.934 2.167 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -9.778 13.126 3.641 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -11.545 12.239 2.093 1.00 0.77 C ATOM 0 H LEU A 132 -9.842 16.389 0.125 1.00 0.71 H new ATOM 0 HA LEU A 132 -8.529 15.118 2.432 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -10.996 14.929 1.968 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -10.643 14.151 0.438 1.00 0.80 H new ATOM 0 HG LEU A 132 -9.421 12.324 1.678 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -9.715 12.154 4.131 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -8.808 13.621 3.692 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -10.525 13.739 4.145 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -11.489 11.274 2.596 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -12.296 12.860 2.581 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -11.821 12.089 1.049 1.00 0.77 H new ATOM 2005 N ILE A 133 -8.106 13.947 -0.651 1.00 0.52 N ATOM 2006 CA ILE A 133 -7.145 13.111 -1.442 1.00 0.46 C ATOM 2007 C ILE A 133 -5.707 13.476 -1.063 1.00 0.43 C ATOM 2008 O ILE A 133 -4.895 12.625 -0.760 1.00 0.46 O ATOM 2009 CB ILE A 133 -7.349 13.362 -2.935 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -8.815 13.092 -3.296 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -6.442 12.420 -3.732 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -9.072 13.474 -4.755 1.00 1.19 C ATOM 0 H ILE A 133 -8.883 14.339 -1.183 1.00 0.52 H new ATOM 0 HA ILE A 133 -7.325 12.059 -1.220 1.00 0.46 H new ATOM 0 HB ILE A 133 -7.100 14.396 -3.175 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -9.049 12.039 -3.140 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -9.471 13.664 -2.640 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -6.583 12.595 -4.799 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -5.401 12.608 -3.468 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -6.695 11.386 -3.497 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -10.115 13.279 -5.004 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -8.857 14.533 -4.897 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -8.428 12.882 -5.405 1.00 1.19 H new ATOM 2024 N ARG A 134 -5.402 14.745 -1.050 1.00 0.42 N ATOM 2025 CA ARG A 134 -4.034 15.188 -0.661 1.00 0.43 C ATOM 2026 C ARG A 134 -3.765 14.755 0.783 1.00 0.40 C ATOM 2027 O ARG A 134 -2.684 14.311 1.120 1.00 0.39 O ATOM 2028 CB ARG A 134 -3.967 16.718 -0.752 1.00 0.51 C ATOM 2029 CG ARG A 134 -2.535 17.187 -0.491 1.00 1.26 C ATOM 2030 CD ARG A 134 -2.444 18.702 -0.697 1.00 1.57 C ATOM 2031 NE ARG A 134 -1.065 19.160 -0.361 1.00 2.30 N ATOM 2032 CZ ARG A 134 -0.655 20.342 -0.736 1.00 2.86 C ATOM 2033 NH1 ARG A 134 -1.452 21.128 -1.406 1.00 2.98 N ATOM 2034 NH2 ARG A 134 0.554 20.735 -0.441 1.00 3.71 N ATOM 0 H ARG A 134 -6.046 15.498 -1.294 1.00 0.42 H new ATOM 0 HA ARG A 134 -3.290 14.744 -1.323 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -4.294 17.048 -1.738 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -4.645 17.165 -0.025 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -2.237 16.930 0.525 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -1.846 16.676 -1.164 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -2.683 18.956 -1.730 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -3.173 19.211 -0.067 1.00 1.57 H new ATOM 0 HE ARG A 134 -0.440 18.548 0.163 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -2.396 20.820 -1.637 1.00 2.98 H new ATOM 0 HH12 ARG A 134 -1.131 22.051 -1.698 1.00 2.98 H new ATOM 0 HH21 ARG A 134 1.177 20.119 0.082 1.00 3.71 H new ATOM 0 HH22 ARG A 134 0.876 21.658 -0.733 1.00 3.71 H new ATOM 2048 N THR A 135 -4.741 14.887 1.639 1.00 0.41 N ATOM 2049 CA THR A 135 -4.533 14.491 3.059 1.00 0.41 C ATOM 2050 C THR A 135 -4.381 12.975 3.189 1.00 0.39 C ATOM 2051 O THR A 135 -3.780 12.475 4.118 1.00 0.52 O ATOM 2052 CB THR A 135 -5.717 14.944 3.911 1.00 0.42 C ATOM 2053 OG1 THR A 135 -5.818 16.358 3.849 1.00 0.89 O ATOM 2054 CG2 THR A 135 -5.496 14.515 5.366 1.00 0.88 C ATOM 0 H THR A 135 -5.668 15.250 1.418 1.00 0.41 H new ATOM 0 HA THR A 135 -3.619 14.972 3.408 1.00 0.41 H new ATOM 0 HB THR A 135 -6.634 14.490 3.535 1.00 0.42 H new ATOM 0 HG1 THR A 135 -6.294 16.616 3.033 1.00 0.89 H new ATOM 0 HG21 THR A 135 -6.341 14.839 5.973 1.00 0.88 H new ATOM 0 HG22 THR A 135 -5.408 13.430 5.416 1.00 0.88 H new ATOM 0 HG23 THR A 135 -4.581 14.971 5.745 1.00 0.88 H new ATOM 2062 N ILE A 136 -4.914 12.238 2.243 1.00 0.35 N ATOM 2063 CA ILE A 136 -4.797 10.754 2.292 1.00 0.36 C ATOM 2064 C ILE A 136 -3.354 10.376 1.967 1.00 0.35 C ATOM 2065 O ILE A 136 -2.602 9.982 2.836 1.00 0.51 O ATOM 2066 CB ILE A 136 -5.750 10.138 1.255 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -7.216 10.495 1.609 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -5.564 8.616 1.215 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.804 9.487 2.604 1.00 0.64 C ATOM 0 H ILE A 136 -5.425 12.605 1.440 1.00 0.35 H new ATOM 0 HA ILE A 136 -5.062 10.380 3.281 1.00 0.36 H new ATOM 0 HB ILE A 136 -5.520 10.544 0.270 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -7.257 11.497 2.035 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -7.820 10.509 0.701 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -6.242 8.186 0.478 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -4.535 8.382 0.941 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -5.782 8.197 2.197 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -8.833 9.762 2.835 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -7.784 8.489 2.166 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.213 9.493 3.520 1.00 0.64 H new ATOM 2081 N MET A 137 -2.965 10.476 0.718 1.00 0.35 N ATOM 2082 CA MET A 137 -1.569 10.117 0.321 1.00 0.33 C ATOM 2083 C MET A 137 -0.575 10.616 1.375 1.00 0.31 C ATOM 2084 O MET A 137 0.495 10.074 1.561 1.00 0.34 O ATOM 2085 CB MET A 137 -1.259 10.755 -1.040 1.00 0.36 C ATOM 2086 CG MET A 137 -2.162 10.135 -2.123 1.00 0.67 C ATOM 2087 SD MET A 137 -2.485 11.355 -3.424 1.00 1.13 S ATOM 2088 CE MET A 137 -0.799 11.495 -4.070 1.00 0.67 C ATOM 0 H MET A 137 -3.560 10.793 -0.047 1.00 0.35 H new ATOM 0 HA MET A 137 -1.477 9.033 0.247 1.00 0.33 H new ATOM 0 HB2 MET A 137 -1.419 11.832 -0.992 1.00 0.36 H new ATOM 0 HB3 MET A 137 -0.211 10.600 -1.295 1.00 0.36 H new ATOM 0 HG2 MET A 137 -1.682 9.254 -2.549 1.00 0.67 H new ATOM 0 HG3 MET A 137 -3.102 9.804 -1.681 1.00 0.67 H new ATOM 0 HE1 MET A 137 -0.813 12.053 -5.006 1.00 0.67 H new ATOM 0 HE2 MET A 137 -0.174 12.018 -3.346 1.00 0.67 H new ATOM 0 HE3 MET A 137 -0.393 10.499 -4.247 1.00 0.67 H new ATOM 2098 N GLY A 138 -0.957 11.651 2.076 1.00 0.31 N ATOM 2099 CA GLY A 138 -0.094 12.223 3.149 1.00 0.33 C ATOM 2100 C GLY A 138 0.054 11.195 4.273 1.00 0.33 C ATOM 2101 O GLY A 138 1.140 10.928 4.747 1.00 0.34 O ATOM 0 H GLY A 138 -1.847 12.132 1.947 1.00 0.31 H new ATOM 0 HA2 GLY A 138 0.885 12.483 2.746 1.00 0.33 H new ATOM 0 HA3 GLY A 138 -0.534 13.142 3.536 1.00 0.33 H new ATOM 2105 N TRP A 139 -1.035 10.611 4.693 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.966 9.589 5.777 1.00 0.37 C ATOM 2107 C TRP A 139 -0.284 8.319 5.254 1.00 0.35 C ATOM 2108 O TRP A 139 0.292 7.562 6.008 1.00 0.39 O ATOM 2109 CB TRP A 139 -2.371 9.240 6.275 1.00 0.43 C ATOM 2110 CG TRP A 139 -3.078 10.460 6.789 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -2.518 11.678 6.999 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -4.479 10.587 7.167 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -3.490 12.538 7.482 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -4.715 11.911 7.602 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -5.558 9.685 7.172 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -5.978 12.326 8.029 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -6.829 10.099 7.600 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -7.039 11.416 8.028 1.00 0.78 C ATOM 0 H TRP A 139 -1.971 10.797 4.332 1.00 0.34 H new ATOM 0 HA TRP A 139 -0.388 10.002 6.604 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -2.948 8.795 5.464 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -2.305 8.493 7.066 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -1.484 11.934 6.819 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -3.322 13.515 7.720 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -5.408 8.667 6.844 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -6.134 13.343 8.358 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -7.650 9.398 7.599 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -8.019 11.728 8.357 1.00 0.78 H new ATOM 2129 N THR A 140 -0.335 8.081 3.971 1.00 0.34 N ATOM 2130 CA THR A 140 0.324 6.862 3.419 1.00 0.36 C ATOM 2131 C THR A 140 1.842 7.063 3.438 1.00 0.34 C ATOM 2132 O THR A 140 2.571 6.309 4.051 1.00 0.39 O ATOM 2133 CB THR A 140 -0.156 6.624 1.985 1.00 0.38 C ATOM 2134 OG1 THR A 140 0.251 7.709 1.163 1.00 1.20 O ATOM 2135 CG2 THR A 140 -1.681 6.513 1.972 1.00 1.17 C ATOM 0 H THR A 140 -0.802 8.674 3.285 1.00 0.34 H new ATOM 0 HA THR A 140 0.066 5.994 4.026 1.00 0.36 H new ATOM 0 HB THR A 140 0.278 5.700 1.603 1.00 0.38 H new ATOM 0 HG1 THR A 140 0.089 8.554 1.632 1.00 1.20 H new ATOM 0 HG21 THR A 140 -2.025 6.344 0.952 1.00 1.17 H new ATOM 0 HG22 THR A 140 -1.991 5.679 2.602 1.00 1.17 H new ATOM 0 HG23 THR A 140 -2.116 7.437 2.353 1.00 1.17 H new ATOM 2143 N LEU A 141 2.320 8.088 2.786 1.00 0.33 N ATOM 2144 CA LEU A 141 3.788 8.359 2.781 1.00 0.34 C ATOM 2145 C LEU A 141 4.263 8.599 4.217 1.00 0.33 C ATOM 2146 O LEU A 141 5.397 8.326 4.555 1.00 0.33 O ATOM 2147 CB LEU A 141 4.086 9.586 1.913 1.00 0.35 C ATOM 2148 CG LEU A 141 3.898 9.237 0.419 1.00 0.41 C ATOM 2149 CD1 LEU A 141 3.507 10.494 -0.365 1.00 0.99 C ATOM 2150 CD2 LEU A 141 5.205 8.676 -0.155 1.00 0.80 C ATOM 0 H LEU A 141 1.756 8.752 2.255 1.00 0.33 H new ATOM 0 HA LEU A 141 4.317 7.501 2.367 1.00 0.34 H new ATOM 0 HB2 LEU A 141 3.423 10.406 2.189 1.00 0.35 H new ATOM 0 HB3 LEU A 141 5.106 9.927 2.089 1.00 0.35 H new ATOM 0 HG LEU A 141 3.109 8.490 0.330 1.00 0.41 H new ATOM 0 HD11 LEU A 141 3.376 10.241 -1.417 1.00 0.99 H new ATOM 0 HD12 LEU A 141 2.573 10.894 0.031 1.00 0.99 H new ATOM 0 HD13 LEU A 141 4.293 11.243 -0.267 1.00 0.99 H new ATOM 0 HD21 LEU A 141 5.065 8.432 -1.208 1.00 0.80 H new ATOM 0 HD22 LEU A 141 5.995 9.421 -0.057 1.00 0.80 H new ATOM 0 HD23 LEU A 141 5.486 7.776 0.392 1.00 0.80 H new ATOM 2162 N ASP A 142 3.408 9.088 5.067 1.00 0.36 N ATOM 2163 CA ASP A 142 3.820 9.317 6.481 1.00 0.37 C ATOM 2164 C ASP A 142 4.077 7.962 7.144 1.00 0.37 C ATOM 2165 O ASP A 142 5.109 7.733 7.744 1.00 0.42 O ATOM 2166 CB ASP A 142 2.701 10.041 7.231 1.00 0.37 C ATOM 2167 CG ASP A 142 3.167 10.354 8.654 1.00 0.78 C ATOM 2168 OD1 ASP A 142 4.297 10.787 8.804 1.00 1.32 O ATOM 2169 OD2 ASP A 142 2.386 10.153 9.570 1.00 1.59 O ATOM 0 H ASP A 142 2.444 9.339 4.847 1.00 0.36 H new ATOM 0 HA ASP A 142 4.724 9.926 6.508 1.00 0.37 H new ATOM 0 HB2 ASP A 142 2.436 10.962 6.712 1.00 0.37 H new ATOM 0 HB3 ASP A 142 1.805 9.421 7.257 1.00 0.37 H new ATOM 2174 N PHE A 143 3.138 7.061 7.032 1.00 0.41 N ATOM 2175 CA PHE A 143 3.305 5.711 7.642 1.00 0.43 C ATOM 2176 C PHE A 143 4.385 4.932 6.887 1.00 0.43 C ATOM 2177 O PHE A 143 5.194 4.251 7.485 1.00 0.45 O ATOM 2178 CB PHE A 143 1.976 4.953 7.561 1.00 0.44 C ATOM 2179 CG PHE A 143 2.108 3.615 8.250 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.553 2.499 7.531 1.00 1.29 C ATOM 2181 CD2 PHE A 143 1.780 3.489 9.605 1.00 1.16 C ATOM 2182 CE1 PHE A 143 2.672 1.257 8.168 1.00 1.35 C ATOM 2183 CE2 PHE A 143 1.898 2.247 10.242 1.00 1.22 C ATOM 2184 CZ PHE A 143 2.344 1.131 9.523 1.00 0.72 C ATOM 0 H PHE A 143 2.256 7.204 6.540 1.00 0.41 H new ATOM 0 HA PHE A 143 3.604 5.818 8.685 1.00 0.43 H new ATOM 0 HB2 PHE A 143 1.184 5.537 8.030 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.692 4.809 6.519 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.805 2.596 6.485 1.00 1.29 H new ATOM 0 HD2 PHE A 143 1.436 4.350 10.159 1.00 1.16 H new ATOM 0 HE1 PHE A 143 3.017 0.397 7.614 1.00 1.35 H new ATOM 0 HE2 PHE A 143 1.645 2.150 11.287 1.00 1.22 H new ATOM 0 HZ PHE A 143 2.435 0.173 10.014 1.00 0.72 H new ATOM 2194 N LEU A 144 4.411 5.016 5.584 1.00 0.45 N ATOM 2195 CA LEU A 144 5.451 4.261 4.823 1.00 0.47 C ATOM 2196 C LEU A 144 6.823 4.815 5.220 1.00 0.47 C ATOM 2197 O LEU A 144 7.709 4.078 5.608 1.00 0.49 O ATOM 2198 CB LEU A 144 5.191 4.418 3.318 1.00 0.49 C ATOM 2199 CG LEU A 144 6.149 3.552 2.471 1.00 0.64 C ATOM 2200 CD1 LEU A 144 5.631 2.097 2.432 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.208 4.163 1.061 1.00 1.01 C ATOM 0 H LEU A 144 3.766 5.567 5.018 1.00 0.45 H new ATOM 0 HA LEU A 144 5.418 3.197 5.055 1.00 0.47 H new ATOM 0 HB2 LEU A 144 4.160 4.140 3.097 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.306 5.465 3.038 1.00 0.49 H new ATOM 0 HG LEU A 144 7.151 3.534 2.901 1.00 0.64 H new ATOM 0 HD11 LEU A 144 6.307 1.486 1.834 1.00 1.31 H new ATOM 0 HD12 LEU A 144 5.584 1.700 3.446 1.00 1.31 H new ATOM 0 HD13 LEU A 144 4.636 2.077 1.988 1.00 1.31 H new ATOM 0 HD21 LEU A 144 6.878 3.573 0.436 1.00 1.01 H new ATOM 0 HD22 LEU A 144 5.210 4.164 0.623 1.00 1.01 H new ATOM 0 HD23 LEU A 144 6.577 5.187 1.123 1.00 1.01 H new ATOM 2213 N ARG A 145 6.999 6.094 5.155 1.00 0.47 N ATOM 2214 CA ARG A 145 8.299 6.692 5.563 1.00 0.48 C ATOM 2215 C ARG A 145 8.602 6.363 7.038 1.00 0.49 C ATOM 2216 O ARG A 145 9.750 6.265 7.427 1.00 0.50 O ATOM 2217 CB ARG A 145 8.228 8.211 5.389 1.00 0.49 C ATOM 2218 CG ARG A 145 9.626 8.802 5.577 1.00 0.69 C ATOM 2219 CD ARG A 145 9.541 10.331 5.623 1.00 0.68 C ATOM 2220 NE ARG A 145 10.906 10.930 5.437 1.00 1.56 N ATOM 2221 CZ ARG A 145 11.929 10.551 6.165 1.00 2.10 C ATOM 2222 NH1 ARG A 145 11.761 9.784 7.205 1.00 2.12 N ATOM 2223 NH2 ARG A 145 13.121 11.002 5.889 1.00 3.16 N ATOM 0 H ARG A 145 6.297 6.761 4.835 1.00 0.47 H new ATOM 0 HA ARG A 145 9.092 6.279 4.939 1.00 0.48 H new ATOM 0 HB2 ARG A 145 7.845 8.459 4.399 1.00 0.49 H new ATOM 0 HB3 ARG A 145 7.537 8.641 6.115 1.00 0.49 H new ATOM 0 HG2 ARG A 145 10.069 8.425 6.499 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.276 8.489 4.760 1.00 0.69 H new ATOM 0 HD2 ARG A 145 8.869 10.689 4.843 1.00 0.68 H new ATOM 0 HD3 ARG A 145 9.122 10.651 6.577 1.00 0.68 H new ATOM 0 HE ARG A 145 11.041 11.650 4.727 1.00 1.56 H new ATOM 0 HH11 ARG A 145 10.825 9.471 7.462 1.00 2.12 H new ATOM 0 HH12 ARG A 145 12.566 9.497 7.762 1.00 2.12 H new ATOM 0 HH21 ARG A 145 13.255 11.647 5.110 1.00 3.16 H new ATOM 0 HH22 ARG A 145 13.920 10.710 6.452 1.00 3.16 H new ATOM 2237 N GLU A 146 7.606 6.255 7.876 1.00 0.49 N ATOM 2238 CA GLU A 146 7.882 6.003 9.333 1.00 0.51 C ATOM 2239 C GLU A 146 8.042 4.507 9.669 1.00 0.53 C ATOM 2240 O GLU A 146 8.943 4.158 10.407 1.00 0.55 O ATOM 2241 CB GLU A 146 6.747 6.591 10.176 1.00 0.52 C ATOM 2242 CG GLU A 146 6.853 8.115 10.203 1.00 0.96 C ATOM 2243 CD GLU A 146 5.640 8.690 10.938 1.00 1.48 C ATOM 2244 OE1 GLU A 146 4.956 7.925 11.598 1.00 2.22 O ATOM 2245 OE2 GLU A 146 5.415 9.883 10.826 1.00 2.03 O ATOM 0 H GLU A 146 6.620 6.328 7.625 1.00 0.49 H new ATOM 0 HA GLU A 146 8.831 6.487 9.564 1.00 0.51 H new ATOM 0 HB2 GLU A 146 5.784 6.292 9.763 1.00 0.52 H new ATOM 0 HB3 GLU A 146 6.795 6.197 11.191 1.00 0.52 H new ATOM 0 HG2 GLU A 146 7.773 8.419 10.702 1.00 0.96 H new ATOM 0 HG3 GLU A 146 6.897 8.507 9.187 1.00 0.96 H new ATOM 2252 N ARG A 147 7.180 3.625 9.220 1.00 0.59 N ATOM 2253 CA ARG A 147 7.321 2.179 9.636 1.00 0.62 C ATOM 2254 C ARG A 147 7.956 1.309 8.540 1.00 0.58 C ATOM 2255 O ARG A 147 8.829 0.504 8.797 1.00 0.62 O ATOM 2256 CB ARG A 147 5.920 1.645 9.959 1.00 0.63 C ATOM 2257 CG ARG A 147 5.432 2.228 11.306 1.00 0.73 C ATOM 2258 CD ARG A 147 5.833 1.299 12.458 1.00 1.11 C ATOM 2259 NE ARG A 147 5.085 0.017 12.330 1.00 1.75 N ATOM 2260 CZ ARG A 147 5.448 -1.027 13.021 1.00 2.40 C ATOM 2261 NH1 ARG A 147 6.464 -0.951 13.836 1.00 2.71 N ATOM 2262 NH2 ARG A 147 4.793 -2.149 12.896 1.00 3.30 N ATOM 0 H ARG A 147 6.399 3.830 8.597 1.00 0.59 H new ATOM 0 HA ARG A 147 7.982 2.132 10.502 1.00 0.62 H new ATOM 0 HB2 ARG A 147 5.226 1.915 9.163 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.939 0.556 10.010 1.00 0.63 H new ATOM 0 HG2 ARG A 147 5.862 3.218 11.460 1.00 0.73 H new ATOM 0 HG3 ARG A 147 4.349 2.350 11.287 1.00 0.73 H new ATOM 0 HD2 ARG A 147 6.907 1.112 12.435 1.00 1.11 H new ATOM 0 HD3 ARG A 147 5.612 1.770 13.416 1.00 1.11 H new ATOM 0 HE ARG A 147 4.286 -0.044 11.699 1.00 1.75 H new ATOM 0 HH11 ARG A 147 6.975 -0.074 13.933 1.00 2.71 H new ATOM 0 HH12 ARG A 147 6.747 -1.769 14.376 1.00 2.71 H new ATOM 0 HH21 ARG A 147 3.999 -2.208 12.259 1.00 3.30 H new ATOM 0 HH22 ARG A 147 5.075 -2.967 13.436 1.00 3.30 H new ATOM 2276 N LEU A 148 7.485 1.435 7.333 1.00 0.53 N ATOM 2277 CA LEU A 148 7.999 0.595 6.209 1.00 0.57 C ATOM 2278 C LEU A 148 9.193 1.235 5.502 1.00 0.67 C ATOM 2279 O LEU A 148 9.372 1.049 4.315 1.00 1.61 O ATOM 2280 CB LEU A 148 6.868 0.426 5.191 1.00 0.59 C ATOM 2281 CG LEU A 148 5.668 -0.277 5.859 1.00 0.70 C ATOM 2282 CD1 LEU A 148 4.410 -0.083 5.006 1.00 1.29 C ATOM 2283 CD2 LEU A 148 5.943 -1.783 6.004 1.00 1.34 C ATOM 0 H LEU A 148 6.753 2.095 7.070 1.00 0.53 H new ATOM 0 HA LEU A 148 8.329 -0.359 6.620 1.00 0.57 H new ATOM 0 HB2 LEU A 148 6.564 1.399 4.806 1.00 0.59 H new ATOM 0 HB3 LEU A 148 7.216 -0.159 4.340 1.00 0.59 H new ATOM 0 HG LEU A 148 5.519 0.161 6.846 1.00 0.70 H new ATOM 0 HD11 LEU A 148 3.566 -0.582 5.483 1.00 1.29 H new ATOM 0 HD12 LEU A 148 4.196 0.981 4.911 1.00 1.29 H new ATOM 0 HD13 LEU A 148 4.572 -0.511 4.016 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.087 -2.265 6.477 1.00 1.34 H new ATOM 0 HD22 LEU A 148 6.107 -2.219 5.019 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.830 -1.933 6.619 1.00 1.34 H new ATOM 2295 N LEU A 149 10.015 1.982 6.197 1.00 0.67 N ATOM 2296 CA LEU A 149 11.201 2.615 5.527 1.00 0.57 C ATOM 2297 C LEU A 149 12.469 1.845 5.904 1.00 0.56 C ATOM 2298 O LEU A 149 13.198 1.390 5.046 1.00 0.58 O ATOM 2299 CB LEU A 149 11.323 4.078 5.959 1.00 0.54 C ATOM 2300 CG LEU A 149 12.417 4.790 5.149 1.00 0.59 C ATOM 2301 CD1 LEU A 149 11.998 4.929 3.672 1.00 0.83 C ATOM 2302 CD2 LEU A 149 12.652 6.180 5.751 1.00 1.21 C ATOM 0 H LEU A 149 9.920 2.182 7.193 1.00 0.67 H new ATOM 0 HA LEU A 149 11.069 2.580 4.446 1.00 0.57 H new ATOM 0 HB2 LEU A 149 10.369 4.586 5.817 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.557 4.131 7.022 1.00 0.54 H new ATOM 0 HG LEU A 149 13.333 4.201 5.191 1.00 0.59 H new ATOM 0 HD11 LEU A 149 12.787 5.436 3.116 1.00 0.83 H new ATOM 0 HD12 LEU A 149 11.832 3.939 3.246 1.00 0.83 H new ATOM 0 HD13 LEU A 149 11.078 5.510 3.608 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.427 6.696 5.184 1.00 1.21 H new ATOM 0 HD22 LEU A 149 11.728 6.756 5.709 1.00 1.21 H new ATOM 0 HD23 LEU A 149 12.969 6.078 6.789 1.00 1.21 H new ATOM 2314 N GLY A 150 12.752 1.695 7.164 1.00 0.56 N ATOM 2315 CA GLY A 150 13.987 0.956 7.555 1.00 0.58 C ATOM 2316 C GLY A 150 13.887 -0.511 7.115 1.00 0.62 C ATOM 2317 O GLY A 150 14.881 -1.153 6.833 1.00 0.70 O ATOM 0 H GLY A 150 12.189 2.048 7.938 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.859 1.422 7.097 1.00 0.58 H new ATOM 0 HA3 GLY A 150 14.126 1.011 8.635 1.00 0.58 H new ATOM 2321 N TRP A 151 12.701 -1.056 7.083 1.00 0.63 N ATOM 2322 CA TRP A 151 12.548 -2.492 6.698 1.00 0.69 C ATOM 2323 C TRP A 151 12.694 -2.676 5.183 1.00 0.70 C ATOM 2324 O TRP A 151 13.205 -3.679 4.723 1.00 0.72 O ATOM 2325 CB TRP A 151 11.163 -2.987 7.141 1.00 0.73 C ATOM 2326 CG TRP A 151 11.167 -4.481 7.241 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.445 -5.181 8.365 1.00 2.17 C ATOM 2328 CD2 TRP A 151 10.889 -5.466 6.203 1.00 1.86 C ATOM 2329 NE1 TRP A 151 11.356 -6.532 8.084 1.00 2.65 N ATOM 2330 CE2 TRP A 151 11.016 -6.759 6.765 1.00 2.43 C ATOM 2331 CE3 TRP A 151 10.543 -5.365 4.844 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 10.808 -7.910 6.005 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 10.332 -6.522 4.076 1.00 3.62 C ATOM 2334 CH2 TRP A 151 10.464 -7.792 4.656 1.00 3.67 C ATOM 0 H TRP A 151 11.832 -0.571 7.306 1.00 0.63 H new ATOM 0 HA TRP A 151 13.331 -3.069 7.190 1.00 0.69 H new ATOM 0 HB2 TRP A 151 10.901 -2.550 8.104 1.00 0.73 H new ATOM 0 HB3 TRP A 151 10.405 -2.663 6.427 1.00 0.73 H new ATOM 0 HD1 TRP A 151 11.696 -4.754 9.325 1.00 2.17 H new ATOM 0 HE1 TRP A 151 11.521 -7.271 8.768 1.00 2.65 H new ATOM 0 HE3 TRP A 151 10.439 -4.392 4.388 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 10.912 -8.886 6.456 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 10.067 -6.433 3.033 1.00 3.62 H new ATOM 0 HH2 TRP A 151 10.300 -8.678 4.060 1.00 3.67 H new ATOM 2345 N ILE A 152 12.255 -1.728 4.400 1.00 0.73 N ATOM 2346 CA ILE A 152 12.384 -1.892 2.922 1.00 0.76 C ATOM 2347 C ILE A 152 13.856 -1.756 2.539 1.00 0.79 C ATOM 2348 O ILE A 152 14.386 -2.540 1.777 1.00 0.89 O ATOM 2349 CB ILE A 152 11.540 -0.838 2.194 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.058 -1.128 2.465 1.00 0.83 C ATOM 2351 CG2 ILE A 152 11.814 -0.907 0.682 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.182 -0.081 1.773 1.00 0.94 C ATOM 0 H ILE A 152 11.819 -0.860 4.712 1.00 0.73 H new ATOM 0 HA ILE A 152 12.020 -2.876 2.628 1.00 0.76 H new ATOM 0 HB ILE A 152 11.797 0.159 2.553 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.802 -2.124 2.103 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.868 -1.120 3.538 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.213 -0.157 0.169 1.00 0.92 H new ATOM 0 HG22 ILE A 152 12.871 -0.715 0.495 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.553 -1.898 0.310 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.132 -0.296 1.972 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.428 0.910 2.155 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.361 -0.110 0.698 1.00 0.94 H new ATOM 2364 N GLN A 153 14.525 -0.772 3.077 1.00 0.77 N ATOM 2365 CA GLN A 153 15.970 -0.589 2.762 1.00 0.80 C ATOM 2366 C GLN A 153 16.691 -1.924 2.989 1.00 0.81 C ATOM 2367 O GLN A 153 17.504 -2.337 2.186 1.00 0.82 O ATOM 2368 CB GLN A 153 16.553 0.520 3.663 1.00 0.82 C ATOM 2369 CG GLN A 153 17.518 1.412 2.876 1.00 1.09 C ATOM 2370 CD GLN A 153 17.978 2.562 3.774 1.00 1.98 C ATOM 2371 OE1 GLN A 153 17.561 2.665 4.910 1.00 2.66 O ATOM 2372 NE2 GLN A 153 18.830 3.434 3.310 1.00 2.77 N ATOM 0 H GLN A 153 14.132 -0.086 3.722 1.00 0.77 H new ATOM 0 HA GLN A 153 16.104 -0.287 1.723 1.00 0.80 H new ATOM 0 HB2 GLN A 153 15.744 1.125 4.072 1.00 0.82 H new ATOM 0 HB3 GLN A 153 17.074 0.071 4.509 1.00 0.82 H new ATOM 0 HG2 GLN A 153 18.377 0.832 2.538 1.00 1.09 H new ATOM 0 HG3 GLN A 153 17.027 1.803 1.985 1.00 1.09 H new ATOM 0 HE21 GLN A 153 19.180 3.347 2.356 1.00 2.77 H new ATOM 0 HE22 GLN A 153 19.146 4.203 3.901 1.00 2.77 H new ATOM 2381 N ASP A 154 16.406 -2.606 4.061 1.00 0.83 N ATOM 2382 CA ASP A 154 17.088 -3.908 4.293 1.00 0.86 C ATOM 2383 C ASP A 154 16.658 -4.902 3.208 1.00 0.85 C ATOM 2384 O ASP A 154 17.284 -5.923 3.004 1.00 0.94 O ATOM 2385 CB ASP A 154 16.708 -4.454 5.669 1.00 0.90 C ATOM 2386 CG ASP A 154 17.492 -5.739 5.941 1.00 1.28 C ATOM 2387 OD1 ASP A 154 18.598 -5.852 5.439 1.00 1.84 O ATOM 2388 OD2 ASP A 154 16.972 -6.588 6.647 1.00 1.99 O ATOM 0 H ASP A 154 15.739 -2.323 4.779 1.00 0.83 H new ATOM 0 HA ASP A 154 18.168 -3.765 4.253 1.00 0.86 H new ATOM 0 HB2 ASP A 154 16.925 -3.713 6.439 1.00 0.90 H new ATOM 0 HB3 ASP A 154 15.637 -4.653 5.710 1.00 0.90 H new ATOM 2393 N GLN A 155 15.596 -4.603 2.505 1.00 0.79 N ATOM 2394 CA GLN A 155 15.117 -5.517 1.426 1.00 0.79 C ATOM 2395 C GLN A 155 15.880 -5.227 0.127 1.00 0.72 C ATOM 2396 O GLN A 155 15.592 -5.781 -0.915 1.00 1.03 O ATOM 2397 CB GLN A 155 13.610 -5.290 1.209 1.00 0.90 C ATOM 2398 CG GLN A 155 12.983 -6.530 0.560 1.00 1.37 C ATOM 2399 CD GLN A 155 11.571 -6.198 0.074 1.00 2.01 C ATOM 2400 OE1 GLN A 155 11.358 -5.187 -0.565 1.00 2.72 O ATOM 2401 NE2 GLN A 155 10.590 -7.014 0.350 1.00 2.54 N ATOM 0 H GLN A 155 15.037 -3.760 2.633 1.00 0.79 H new ATOM 0 HA GLN A 155 15.293 -6.553 1.715 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.124 -5.083 2.162 1.00 0.90 H new ATOM 0 HB3 GLN A 155 13.452 -4.418 0.574 1.00 0.90 H new ATOM 0 HG2 GLN A 155 13.597 -6.865 -0.276 1.00 1.37 H new ATOM 0 HG3 GLN A 155 12.948 -7.350 1.278 1.00 1.37 H new ATOM 0 HE21 GLN A 155 10.768 -7.863 0.886 1.00 2.54 H new ATOM 0 HE22 GLN A 155 9.645 -6.803 0.029 1.00 2.54 H new ATOM 2410 N GLY A 156 16.864 -4.374 0.191 1.00 0.63 N ATOM 2411 CA GLY A 156 17.668 -4.053 -1.024 1.00 0.72 C ATOM 2412 C GLY A 156 16.893 -3.121 -1.964 1.00 0.87 C ATOM 2413 O GLY A 156 17.339 -2.844 -3.060 1.00 1.38 O ATOM 0 H GLY A 156 17.148 -3.882 1.038 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.606 -3.581 -0.730 1.00 0.72 H new ATOM 0 HA3 GLY A 156 17.925 -4.973 -1.549 1.00 0.72 H new ATOM 2417 N GLY A 157 15.756 -2.614 -1.548 1.00 0.81 N ATOM 2418 CA GLY A 157 14.976 -1.675 -2.425 1.00 1.10 C ATOM 2419 C GLY A 157 13.713 -2.356 -2.960 1.00 0.84 C ATOM 2420 O GLY A 157 13.392 -3.476 -2.615 1.00 0.88 O ATOM 0 H GLY A 157 15.333 -2.808 -0.640 1.00 0.81 H new ATOM 0 HA2 GLY A 157 14.703 -0.784 -1.860 1.00 1.10 H new ATOM 0 HA3 GLY A 157 15.598 -1.346 -3.257 1.00 1.10 H new ATOM 2424 N TRP A 158 12.981 -1.652 -3.784 1.00 0.67 N ATOM 2425 CA TRP A 158 11.712 -2.203 -4.342 1.00 0.50 C ATOM 2426 C TRP A 158 11.986 -3.426 -5.219 1.00 0.51 C ATOM 2427 O TRP A 158 11.064 -4.103 -5.630 1.00 0.53 O ATOM 2428 CB TRP A 158 11.022 -1.136 -5.195 1.00 0.51 C ATOM 2429 CG TRP A 158 10.586 0.004 -4.333 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.344 1.082 -4.031 1.00 0.59 C ATOM 2431 CD2 TRP A 158 9.305 0.205 -3.665 1.00 0.46 C ATOM 2432 NE1 TRP A 158 10.613 1.930 -3.220 1.00 0.55 N ATOM 2433 CE2 TRP A 158 9.351 1.434 -2.966 1.00 0.47 C ATOM 2434 CE3 TRP A 158 8.121 -0.552 -3.598 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 8.262 1.897 -2.227 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 7.023 -0.089 -2.855 1.00 0.84 C ATOM 2437 CH2 TRP A 158 7.093 1.133 -2.171 1.00 0.78 C ATOM 0 H TRP A 158 13.212 -0.709 -4.097 1.00 0.67 H new ATOM 0 HA TRP A 158 11.074 -2.497 -3.508 1.00 0.50 H new ATOM 0 HB2 TRP A 158 11.704 -0.779 -5.967 1.00 0.51 H new ATOM 0 HB3 TRP A 158 10.161 -1.567 -5.705 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.356 1.253 -4.368 1.00 0.59 H new ATOM 0 HE1 TRP A 158 10.964 2.815 -2.854 1.00 0.55 H new ATOM 0 HE3 TRP A 158 8.056 -1.495 -4.121 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 8.322 2.839 -1.702 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 6.119 -0.678 -2.810 1.00 0.84 H new ATOM 0 HH2 TRP A 158 6.245 1.483 -1.602 1.00 0.78 H new ATOM 2448 N ASP A 159 13.216 -3.726 -5.539 1.00 0.50 N ATOM 2449 CA ASP A 159 13.462 -4.907 -6.415 1.00 0.51 C ATOM 2450 C ASP A 159 13.040 -6.178 -5.677 1.00 0.51 C ATOM 2451 O ASP A 159 12.510 -7.100 -6.264 1.00 0.51 O ATOM 2452 CB ASP A 159 14.950 -4.974 -6.771 1.00 0.54 C ATOM 2453 CG ASP A 159 15.220 -6.199 -7.644 1.00 1.66 C ATOM 2454 OD1 ASP A 159 14.293 -6.657 -8.291 1.00 2.46 O ATOM 2455 OD2 ASP A 159 16.350 -6.658 -7.652 1.00 2.37 O ATOM 0 H ASP A 159 14.047 -3.216 -5.239 1.00 0.50 H new ATOM 0 HA ASP A 159 12.881 -4.816 -7.333 1.00 0.51 H new ATOM 0 HB2 ASP A 159 15.248 -4.068 -7.298 1.00 0.54 H new ATOM 0 HB3 ASP A 159 15.549 -5.025 -5.862 1.00 0.54 H new ATOM 2460 N GLY A 160 13.257 -6.228 -4.390 1.00 0.52 N ATOM 2461 CA GLY A 160 12.851 -7.435 -3.615 1.00 0.54 C ATOM 2462 C GLY A 160 11.329 -7.556 -3.665 1.00 0.53 C ATOM 2463 O GLY A 160 10.776 -8.639 -3.647 1.00 0.54 O ATOM 0 H GLY A 160 13.697 -5.487 -3.844 1.00 0.52 H new ATOM 0 HA2 GLY A 160 13.316 -8.328 -4.034 1.00 0.54 H new ATOM 0 HA3 GLY A 160 13.190 -7.354 -2.582 1.00 0.54 H new ATOM 2467 N LEU A 161 10.652 -6.447 -3.752 1.00 0.54 N ATOM 2468 CA LEU A 161 9.168 -6.475 -3.829 1.00 0.56 C ATOM 2469 C LEU A 161 8.746 -7.306 -5.041 1.00 0.56 C ATOM 2470 O LEU A 161 8.013 -8.269 -4.936 1.00 0.62 O ATOM 2471 CB LEU A 161 8.656 -5.022 -3.994 1.00 0.58 C ATOM 2472 CG LEU A 161 7.308 -4.831 -3.251 1.00 0.74 C ATOM 2473 CD1 LEU A 161 6.272 -5.831 -3.791 1.00 1.63 C ATOM 2474 CD2 LEU A 161 7.492 -5.030 -1.722 1.00 1.56 C ATOM 0 H LEU A 161 11.067 -5.516 -3.773 1.00 0.54 H new ATOM 0 HA LEU A 161 8.749 -6.916 -2.924 1.00 0.56 H new ATOM 0 HB2 LEU A 161 9.395 -4.323 -3.603 1.00 0.58 H new ATOM 0 HB3 LEU A 161 8.530 -4.793 -5.052 1.00 0.58 H new ATOM 0 HG LEU A 161 6.954 -3.815 -3.425 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.326 -5.694 -3.267 1.00 1.63 H new ATOM 0 HD12 LEU A 161 6.124 -5.661 -4.857 1.00 1.63 H new ATOM 0 HD13 LEU A 161 6.631 -6.848 -3.632 1.00 1.63 H new ATOM 0 HD21 LEU A 161 6.535 -4.892 -1.219 1.00 1.56 H new ATOM 0 HD22 LEU A 161 7.862 -6.037 -1.528 1.00 1.56 H new ATOM 0 HD23 LEU A 161 8.209 -4.301 -1.344 1.00 1.56 H new ATOM 2486 N LEU A 162 9.207 -6.909 -6.201 1.00 0.53 N ATOM 2487 CA LEU A 162 8.852 -7.629 -7.453 1.00 0.56 C ATOM 2488 C LEU A 162 9.504 -9.012 -7.430 1.00 0.55 C ATOM 2489 O LEU A 162 8.989 -9.954 -7.999 1.00 0.57 O ATOM 2490 CB LEU A 162 9.348 -6.799 -8.655 1.00 0.61 C ATOM 2491 CG LEU A 162 9.298 -7.610 -9.956 1.00 0.80 C ATOM 2492 CD1 LEU A 162 7.855 -8.026 -10.251 1.00 1.56 C ATOM 2493 CD2 LEU A 162 9.820 -6.744 -11.107 1.00 1.33 C ATOM 0 H LEU A 162 9.822 -6.106 -6.331 1.00 0.53 H new ATOM 0 HA LEU A 162 7.773 -7.758 -7.538 1.00 0.56 H new ATOM 0 HB2 LEU A 162 8.734 -5.904 -8.759 1.00 0.61 H new ATOM 0 HB3 LEU A 162 10.369 -6.465 -8.472 1.00 0.61 H new ATOM 0 HG LEU A 162 9.916 -8.502 -9.852 1.00 0.80 H new ATOM 0 HD11 LEU A 162 7.824 -8.602 -11.176 1.00 1.56 H new ATOM 0 HD12 LEU A 162 7.477 -8.637 -9.431 1.00 1.56 H new ATOM 0 HD13 LEU A 162 7.234 -7.136 -10.357 1.00 1.56 H new ATOM 0 HD21 LEU A 162 9.787 -7.314 -12.035 1.00 1.33 H new ATOM 0 HD22 LEU A 162 9.197 -5.855 -11.205 1.00 1.33 H new ATOM 0 HD23 LEU A 162 10.848 -6.446 -10.901 1.00 1.33 H new ATOM 2505 N SER A 163 10.624 -9.152 -6.782 1.00 0.54 N ATOM 2506 CA SER A 163 11.282 -10.485 -6.736 1.00 0.56 C ATOM 2507 C SER A 163 10.344 -11.494 -6.066 1.00 0.53 C ATOM 2508 O SER A 163 10.468 -12.688 -6.253 1.00 0.60 O ATOM 2509 CB SER A 163 12.580 -10.385 -5.936 1.00 0.63 C ATOM 2510 OG SER A 163 13.363 -11.548 -6.167 1.00 1.32 O ATOM 0 H SER A 163 11.110 -8.406 -6.285 1.00 0.54 H new ATOM 0 HA SER A 163 11.506 -10.816 -7.750 1.00 0.56 H new ATOM 0 HB2 SER A 163 13.135 -9.494 -6.231 1.00 0.63 H new ATOM 0 HB3 SER A 163 12.359 -10.286 -4.873 1.00 0.63 H new ATOM 0 HG SER A 163 14.197 -11.487 -5.657 1.00 1.32 H new ATOM 2516 N TYR A 164 9.406 -11.025 -5.284 1.00 0.59 N ATOM 2517 CA TYR A 164 8.464 -11.961 -4.601 1.00 0.64 C ATOM 2518 C TYR A 164 7.298 -12.301 -5.536 1.00 0.63 C ATOM 2519 O TYR A 164 6.796 -13.408 -5.533 1.00 0.68 O ATOM 2520 CB TYR A 164 7.913 -11.302 -3.328 1.00 0.69 C ATOM 2521 CG TYR A 164 6.793 -12.156 -2.767 1.00 0.72 C ATOM 2522 CD1 TYR A 164 7.084 -13.408 -2.212 1.00 1.50 C ATOM 2523 CD2 TYR A 164 5.466 -11.706 -2.821 1.00 1.34 C ATOM 2524 CE1 TYR A 164 6.052 -14.210 -1.713 1.00 1.57 C ATOM 2525 CE2 TYR A 164 4.434 -12.508 -2.318 1.00 1.35 C ATOM 2526 CZ TYR A 164 4.728 -13.760 -1.765 1.00 0.87 C ATOM 2527 OH TYR A 164 3.712 -14.555 -1.278 1.00 0.97 O ATOM 0 H TYR A 164 9.252 -10.036 -5.089 1.00 0.59 H new ATOM 0 HA TYR A 164 8.999 -12.874 -4.340 1.00 0.64 H new ATOM 0 HB2 TYR A 164 8.707 -11.191 -2.589 1.00 0.69 H new ATOM 0 HB3 TYR A 164 7.545 -10.301 -3.553 1.00 0.69 H new ATOM 0 HD1 TYR A 164 8.106 -13.755 -2.169 1.00 1.50 H new ATOM 0 HD2 TYR A 164 5.240 -10.741 -3.250 1.00 1.34 H new ATOM 0 HE1 TYR A 164 6.277 -15.177 -1.288 1.00 1.57 H new ATOM 0 HE2 TYR A 164 3.412 -12.161 -2.357 1.00 1.35 H new ATOM 0 HH TYR A 164 3.456 -14.247 -0.384 1.00 0.97 H new ATOM 2537 N PHE A 165 6.856 -11.364 -6.327 1.00 0.64 N ATOM 2538 CA PHE A 165 5.716 -11.649 -7.241 1.00 0.72 C ATOM 2539 C PHE A 165 6.194 -12.506 -8.417 1.00 0.82 C ATOM 2540 O PHE A 165 6.067 -12.127 -9.564 1.00 1.56 O ATOM 2541 CB PHE A 165 5.132 -10.325 -7.762 1.00 0.74 C ATOM 2542 CG PHE A 165 4.197 -9.733 -6.725 1.00 0.84 C ATOM 2543 CD1 PHE A 165 2.997 -10.386 -6.416 1.00 1.65 C ATOM 2544 CD2 PHE A 165 4.527 -8.535 -6.075 1.00 1.42 C ATOM 2545 CE1 PHE A 165 2.128 -9.845 -5.461 1.00 1.96 C ATOM 2546 CE2 PHE A 165 3.657 -7.994 -5.119 1.00 1.71 C ATOM 2547 CZ PHE A 165 2.458 -8.649 -4.813 1.00 1.66 C ATOM 0 H PHE A 165 7.233 -10.418 -6.380 1.00 0.64 H new ATOM 0 HA PHE A 165 4.944 -12.194 -6.697 1.00 0.72 H new ATOM 0 HB2 PHE A 165 5.937 -9.624 -7.982 1.00 0.74 H new ATOM 0 HB3 PHE A 165 4.594 -10.496 -8.695 1.00 0.74 H new ATOM 0 HD1 PHE A 165 2.742 -11.309 -6.916 1.00 1.65 H new ATOM 0 HD2 PHE A 165 5.452 -8.029 -6.311 1.00 1.42 H new ATOM 0 HE1 PHE A 165 1.203 -10.350 -5.224 1.00 1.96 H new ATOM 0 HE2 PHE A 165 3.911 -7.072 -4.618 1.00 1.71 H new ATOM 0 HZ PHE A 165 1.787 -8.231 -4.077 1.00 1.66 H new ATOM 2557 N GLY A 166 6.744 -13.659 -8.144 1.00 0.94 N ATOM 2558 CA GLY A 166 7.225 -14.534 -9.252 1.00 1.01 C ATOM 2559 C GLY A 166 6.020 -15.025 -10.053 1.00 1.23 C ATOM 2560 O GLY A 166 5.518 -14.340 -10.921 1.00 1.85 O ATOM 0 H GLY A 166 6.881 -14.032 -7.204 1.00 0.94 H new ATOM 0 HA2 GLY A 166 7.908 -13.983 -9.898 1.00 1.01 H new ATOM 0 HA3 GLY A 166 7.781 -15.381 -8.849 1.00 1.01 H new ATOM 2564 N THR A 167 5.536 -16.200 -9.750 1.00 1.51 N ATOM 2565 CA THR A 167 4.343 -16.731 -10.468 1.00 2.01 C ATOM 2566 C THR A 167 3.543 -17.657 -9.536 1.00 1.65 C ATOM 2567 O THR A 167 3.233 -18.771 -9.909 1.00 2.06 O ATOM 2568 CB THR A 167 4.802 -17.520 -11.696 1.00 3.10 C ATOM 2569 OG1 THR A 167 5.724 -18.523 -11.293 1.00 3.65 O ATOM 2570 CG2 THR A 167 5.478 -16.573 -12.690 1.00 3.92 C ATOM 0 H THR A 167 5.918 -16.817 -9.033 1.00 1.51 H new ATOM 0 HA THR A 167 3.710 -15.900 -10.779 1.00 2.01 H new ATOM 0 HB THR A 167 3.940 -17.987 -12.172 1.00 3.10 H new ATOM 0 HG1 THR A 167 6.018 -19.031 -12.078 1.00 3.65 H new ATOM 0 HG21 THR A 167 5.805 -17.136 -13.564 1.00 3.92 H new ATOM 0 HG22 THR A 167 4.771 -15.803 -12.998 1.00 3.92 H new ATOM 0 HG23 THR A 167 6.341 -16.105 -12.217 1.00 3.92 H new ATOM 2578 N PRO A 168 3.217 -17.176 -8.348 1.00 1.84 N ATOM 2579 CA PRO A 168 2.440 -17.977 -7.379 1.00 2.36 C ATOM 2580 C PRO A 168 1.051 -18.292 -7.953 1.00 1.79 C ATOM 2581 O PRO A 168 0.734 -17.940 -9.072 1.00 2.00 O ATOM 2582 CB PRO A 168 2.327 -17.081 -6.121 1.00 3.35 C ATOM 2583 CG PRO A 168 2.955 -15.702 -6.471 1.00 3.48 C ATOM 2584 CD PRO A 168 3.587 -15.822 -7.874 1.00 2.53 C ATOM 0 HA PRO A 168 2.912 -18.933 -7.152 1.00 2.36 H new ATOM 0 HB2 PRO A 168 1.284 -16.964 -5.826 1.00 3.35 H new ATOM 0 HB3 PRO A 168 2.847 -17.536 -5.278 1.00 3.35 H new ATOM 0 HG2 PRO A 168 2.195 -14.921 -6.458 1.00 3.48 H new ATOM 0 HG3 PRO A 168 3.709 -15.426 -5.734 1.00 3.48 H new ATOM 0 HD2 PRO A 168 3.207 -15.052 -8.545 1.00 2.53 H new ATOM 0 HD3 PRO A 168 4.669 -15.701 -7.831 1.00 2.53 H new ATOM 2592 N THR A 169 0.222 -18.944 -7.184 1.00 1.73 N ATOM 2593 CA THR A 169 -1.149 -19.275 -7.670 1.00 1.33 C ATOM 2594 C THR A 169 -2.007 -18.006 -7.619 1.00 1.05 C ATOM 2595 O THR A 169 -1.726 -17.086 -6.875 1.00 1.06 O ATOM 2596 CB THR A 169 -1.782 -20.378 -6.783 1.00 1.53 C ATOM 2597 OG1 THR A 169 -2.933 -19.866 -6.121 1.00 1.94 O ATOM 2598 CG2 THR A 169 -0.775 -20.860 -5.733 1.00 2.40 C ATOM 0 H THR A 169 0.435 -19.262 -6.239 1.00 1.73 H new ATOM 0 HA THR A 169 -1.095 -19.647 -8.693 1.00 1.33 H new ATOM 0 HB THR A 169 -2.065 -21.214 -7.422 1.00 1.53 H new ATOM 0 HG1 THR A 169 -3.329 -20.568 -5.563 1.00 1.94 H new ATOM 0 HG21 THR A 169 -1.233 -21.634 -5.118 1.00 2.40 H new ATOM 0 HG22 THR A 169 0.105 -21.267 -6.232 1.00 2.40 H new ATOM 0 HG23 THR A 169 -0.479 -20.022 -5.101 1.00 2.40 H new ATOM 2606 N TRP A 170 -3.050 -17.947 -8.404 1.00 1.04 N ATOM 2607 CA TRP A 170 -3.923 -16.736 -8.401 1.00 1.01 C ATOM 2608 C TRP A 170 -4.978 -16.861 -7.298 1.00 0.92 C ATOM 2609 O TRP A 170 -5.181 -15.953 -6.516 1.00 0.95 O ATOM 2610 CB TRP A 170 -4.622 -16.613 -9.756 1.00 1.32 C ATOM 2611 CG TRP A 170 -3.599 -16.578 -10.845 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -2.628 -15.643 -10.970 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -3.427 -17.497 -11.962 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -1.873 -15.930 -12.093 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -2.326 -17.063 -12.738 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -4.114 -18.653 -12.374 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -1.921 -17.753 -13.882 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -3.709 -19.350 -13.524 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -2.614 -18.900 -14.276 1.00 4.64 C ATOM 0 H TRP A 170 -3.335 -18.685 -9.047 1.00 1.04 H new ATOM 0 HA TRP A 170 -3.312 -15.852 -8.219 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -5.299 -17.454 -9.905 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -5.228 -15.708 -9.783 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -2.469 -14.809 -10.302 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -1.078 -15.372 -12.406 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -4.959 -19.007 -11.802 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -1.078 -17.402 -14.458 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -4.243 -20.237 -13.831 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -2.307 -19.440 -15.159 1.00 4.64 H new ATOM 2630 N GLN A 171 -5.654 -17.977 -7.230 1.00 0.88 N ATOM 2631 CA GLN A 171 -6.699 -18.153 -6.180 1.00 0.84 C ATOM 2632 C GLN A 171 -6.064 -18.054 -4.793 1.00 0.75 C ATOM 2633 O GLN A 171 -6.743 -17.822 -3.815 1.00 0.75 O ATOM 2634 CB GLN A 171 -7.365 -19.523 -6.331 1.00 0.88 C ATOM 2635 CG GLN A 171 -8.080 -19.606 -7.681 1.00 1.57 C ATOM 2636 CD GLN A 171 -7.050 -19.774 -8.799 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -7.072 -19.049 -9.775 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -6.142 -20.706 -8.699 1.00 2.34 N ATOM 0 H GLN A 171 -5.528 -18.773 -7.855 1.00 0.88 H new ATOM 0 HA GLN A 171 -7.448 -17.369 -6.295 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -6.616 -20.312 -6.257 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -8.077 -19.682 -5.522 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -8.775 -20.446 -7.684 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -8.669 -18.704 -7.848 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -6.123 -21.314 -7.880 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -5.451 -20.826 -9.439 1.00 2.34 H new ATOM 2647 N THR A 172 -4.772 -18.191 -4.688 1.00 0.67 N ATOM 2648 CA THR A 172 -4.134 -18.062 -3.348 1.00 0.60 C ATOM 2649 C THR A 172 -4.003 -16.567 -3.043 1.00 0.59 C ATOM 2650 O THR A 172 -4.671 -16.055 -2.167 1.00 0.74 O ATOM 2651 CB THR A 172 -2.765 -18.754 -3.362 1.00 0.59 C ATOM 2652 OG1 THR A 172 -2.965 -20.160 -3.304 1.00 0.81 O ATOM 2653 CG2 THR A 172 -1.930 -18.318 -2.155 1.00 0.92 C ATOM 0 H THR A 172 -4.136 -18.384 -5.462 1.00 0.67 H new ATOM 0 HA THR A 172 -4.734 -18.541 -2.574 1.00 0.60 H new ATOM 0 HB THR A 172 -2.235 -18.479 -4.274 1.00 0.59 H new ATOM 0 HG1 THR A 172 -2.097 -20.615 -3.314 1.00 0.81 H new ATOM 0 HG21 THR A 172 -0.962 -18.819 -2.182 1.00 0.92 H new ATOM 0 HG22 THR A 172 -1.781 -17.239 -2.187 1.00 0.92 H new ATOM 0 HG23 THR A 172 -2.452 -18.585 -1.236 1.00 0.92 H new ATOM 2661 N VAL A 173 -3.138 -15.865 -3.727 1.00 0.59 N ATOM 2662 CA VAL A 173 -2.963 -14.406 -3.451 1.00 0.58 C ATOM 2663 C VAL A 173 -4.327 -13.726 -3.262 1.00 0.57 C ATOM 2664 O VAL A 173 -4.439 -12.737 -2.566 1.00 0.60 O ATOM 2665 CB VAL A 173 -2.232 -13.775 -4.641 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -2.162 -12.256 -4.473 1.00 1.13 C ATOM 2667 CG2 VAL A 173 -0.814 -14.343 -4.717 1.00 1.01 C ATOM 0 H VAL A 173 -2.543 -16.239 -4.467 1.00 0.59 H new ATOM 0 HA VAL A 173 -2.386 -14.274 -2.536 1.00 0.58 H new ATOM 0 HB VAL A 173 -2.775 -14.005 -5.558 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -1.640 -11.819 -5.325 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -3.172 -11.849 -4.418 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -1.624 -12.016 -3.556 1.00 1.13 H new ATOM 0 HG21 VAL A 173 -0.289 -13.898 -5.562 1.00 1.01 H new ATOM 0 HG22 VAL A 173 -0.280 -14.113 -3.795 1.00 1.01 H new ATOM 0 HG23 VAL A 173 -0.862 -15.424 -4.848 1.00 1.01 H new ATOM 2677 N THR A 174 -5.360 -14.234 -3.875 1.00 0.55 N ATOM 2678 CA THR A 174 -6.702 -13.596 -3.723 1.00 0.56 C ATOM 2679 C THR A 174 -7.310 -13.980 -2.364 1.00 0.53 C ATOM 2680 O THR A 174 -7.941 -13.171 -1.713 1.00 0.55 O ATOM 2681 CB THR A 174 -7.617 -14.081 -4.859 1.00 0.59 C ATOM 2682 OG1 THR A 174 -6.851 -14.220 -6.048 1.00 1.37 O ATOM 2683 CG2 THR A 174 -8.742 -13.070 -5.095 1.00 1.27 C ATOM 0 H THR A 174 -5.336 -15.060 -4.473 1.00 0.55 H new ATOM 0 HA THR A 174 -6.601 -12.512 -3.770 1.00 0.56 H new ATOM 0 HB THR A 174 -8.054 -15.041 -4.584 1.00 0.59 H new ATOM 0 HG1 THR A 174 -6.550 -15.148 -6.136 1.00 1.37 H new ATOM 0 HG21 THR A 174 -9.385 -13.423 -5.902 1.00 1.27 H new ATOM 0 HG22 THR A 174 -9.330 -12.961 -4.184 1.00 1.27 H new ATOM 0 HG23 THR A 174 -8.313 -12.106 -5.368 1.00 1.27 H new ATOM 2691 N ILE A 175 -7.136 -15.199 -1.931 1.00 0.51 N ATOM 2692 CA ILE A 175 -7.717 -15.615 -0.617 1.00 0.50 C ATOM 2693 C ILE A 175 -6.799 -15.135 0.512 1.00 0.49 C ATOM 2694 O ILE A 175 -7.192 -15.035 1.657 1.00 0.49 O ATOM 2695 CB ILE A 175 -7.796 -17.141 -0.589 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -8.776 -17.631 -1.662 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -8.259 -17.640 0.783 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -8.558 -19.128 -1.906 1.00 0.89 C ATOM 0 H ILE A 175 -6.619 -15.925 -2.427 1.00 0.51 H new ATOM 0 HA ILE A 175 -8.709 -15.183 -0.486 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.800 -17.536 -0.788 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -9.802 -17.449 -1.343 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -8.627 -17.075 -2.588 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -8.307 -18.729 0.777 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -7.554 -17.312 1.546 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -9.246 -17.235 1.003 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -9.254 -19.478 -2.669 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -7.535 -19.296 -2.244 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -8.729 -19.676 -0.980 1.00 0.89 H new ATOM 2710 N PHE A 176 -5.575 -14.830 0.177 1.00 0.48 N ATOM 2711 CA PHE A 176 -4.595 -14.341 1.189 1.00 0.49 C ATOM 2712 C PHE A 176 -4.895 -12.877 1.527 1.00 0.49 C ATOM 2713 O PHE A 176 -5.325 -12.548 2.615 1.00 0.56 O ATOM 2714 CB PHE A 176 -3.197 -14.418 0.564 1.00 0.51 C ATOM 2715 CG PHE A 176 -2.148 -14.219 1.640 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -1.959 -15.200 2.623 1.00 1.41 C ATOM 2717 CD2 PHE A 176 -1.359 -13.062 1.649 1.00 1.23 C ATOM 2718 CE1 PHE A 176 -0.984 -15.022 3.612 1.00 1.52 C ATOM 2719 CE2 PHE A 176 -0.382 -12.886 2.635 1.00 1.22 C ATOM 2720 CZ PHE A 176 -0.195 -13.865 3.618 1.00 0.76 C ATOM 0 H PHE A 176 -5.207 -14.900 -0.772 1.00 0.48 H new ATOM 0 HA PHE A 176 -4.656 -14.945 2.094 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -3.057 -15.384 0.079 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -3.090 -13.656 -0.208 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -2.566 -16.094 2.618 1.00 1.41 H new ATOM 0 HD2 PHE A 176 -1.505 -12.304 0.893 1.00 1.23 H new ATOM 0 HE1 PHE A 176 -0.840 -15.777 4.371 1.00 1.52 H new ATOM 0 HE2 PHE A 176 0.228 -11.995 2.638 1.00 1.22 H new ATOM 0 HZ PHE A 176 0.557 -13.728 4.381 1.00 0.76 H new ATOM 2730 N VAL A 177 -4.642 -11.998 0.594 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.874 -10.541 0.821 1.00 0.48 C ATOM 2732 C VAL A 177 -6.343 -10.287 1.176 1.00 0.44 C ATOM 2733 O VAL A 177 -6.643 -9.491 2.044 1.00 0.57 O ATOM 2734 CB VAL A 177 -4.517 -9.793 -0.471 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -4.915 -8.319 -0.359 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -3.008 -9.899 -0.717 1.00 1.24 C ATOM 0 H VAL A 177 -4.279 -12.232 -0.330 1.00 0.46 H new ATOM 0 HA VAL A 177 -4.255 -10.191 1.647 1.00 0.48 H new ATOM 0 HB VAL A 177 -5.060 -10.241 -1.303 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -4.656 -7.801 -1.282 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -5.989 -8.244 -0.190 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -4.384 -7.861 0.475 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -2.751 -9.369 -1.634 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -2.471 -9.456 0.121 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -2.728 -10.948 -0.814 1.00 1.24 H new ATOM 2746 N ALA A 178 -7.260 -10.947 0.531 1.00 0.45 N ATOM 2747 CA ALA A 178 -8.697 -10.721 0.862 1.00 0.43 C ATOM 2748 C ALA A 178 -8.986 -11.228 2.280 1.00 0.40 C ATOM 2749 O ALA A 178 -9.671 -10.585 3.050 1.00 0.40 O ATOM 2750 CB ALA A 178 -9.576 -11.475 -0.136 1.00 0.46 C ATOM 0 H ALA A 178 -7.082 -11.629 -0.206 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.915 -9.655 0.807 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -10.626 -11.310 0.106 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -9.375 -11.113 -1.144 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -9.355 -12.541 -0.083 1.00 0.46 H new ATOM 2756 N GLY A 179 -8.481 -12.380 2.625 1.00 0.41 N ATOM 2757 CA GLY A 179 -8.740 -12.932 3.987 1.00 0.43 C ATOM 2758 C GLY A 179 -8.138 -12.014 5.053 1.00 0.43 C ATOM 2759 O GLY A 179 -8.576 -11.996 6.187 1.00 0.48 O ATOM 0 H GLY A 179 -7.900 -12.964 2.024 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -9.813 -13.033 4.148 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -8.309 -13.930 4.071 1.00 0.43 H new ATOM 2763 N VAL A 180 -7.128 -11.264 4.708 1.00 0.42 N ATOM 2764 CA VAL A 180 -6.492 -10.366 5.711 1.00 0.45 C ATOM 2765 C VAL A 180 -7.277 -9.057 5.844 1.00 0.45 C ATOM 2766 O VAL A 180 -7.424 -8.520 6.924 1.00 0.43 O ATOM 2767 CB VAL A 180 -5.044 -10.066 5.297 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -4.445 -8.982 6.203 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -4.207 -11.341 5.420 1.00 1.41 C ATOM 0 H VAL A 180 -6.716 -11.235 3.775 1.00 0.42 H new ATOM 0 HA VAL A 180 -6.496 -10.870 6.677 1.00 0.45 H new ATOM 0 HB VAL A 180 -5.038 -9.713 4.266 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -3.418 -8.779 5.898 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -5.035 -8.070 6.118 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -4.455 -9.326 7.237 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -3.178 -11.131 5.127 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -4.226 -11.690 6.452 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -4.620 -12.111 4.769 1.00 1.41 H new ATOM 2779 N LEU A 181 -7.771 -8.523 4.757 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.518 -7.237 4.852 1.00 0.50 C ATOM 2781 C LEU A 181 -9.832 -7.468 5.608 1.00 0.49 C ATOM 2782 O LEU A 181 -10.309 -6.618 6.332 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.802 -6.711 3.419 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.103 -5.363 3.157 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -8.485 -4.326 4.237 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -6.580 -5.571 3.119 1.00 1.20 C ATOM 0 H LEU A 181 -7.690 -8.917 3.820 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.928 -6.497 5.393 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -8.462 -7.445 2.688 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -9.877 -6.596 3.280 1.00 0.56 H new ATOM 0 HG LEU A 181 -8.434 -4.976 2.193 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -7.979 -3.383 4.031 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -9.564 -4.170 4.226 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -8.182 -4.693 5.217 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -6.087 -4.617 2.934 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -6.244 -5.974 4.075 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -6.328 -6.270 2.322 1.00 1.20 H new ATOM 2798 N THR A 182 -10.423 -8.617 5.420 1.00 0.49 N ATOM 2799 CA THR A 182 -11.711 -8.917 6.098 1.00 0.51 C ATOM 2800 C THR A 182 -11.472 -9.155 7.588 1.00 0.48 C ATOM 2801 O THR A 182 -12.291 -8.818 8.420 1.00 0.51 O ATOM 2802 CB THR A 182 -12.340 -10.164 5.472 1.00 0.54 C ATOM 2803 OG1 THR A 182 -11.409 -11.236 5.516 1.00 1.16 O ATOM 2804 CG2 THR A 182 -12.716 -9.871 4.018 1.00 1.07 C ATOM 0 H THR A 182 -10.065 -9.362 4.823 1.00 0.49 H new ATOM 0 HA THR A 182 -12.386 -8.070 5.977 1.00 0.51 H new ATOM 0 HB THR A 182 -13.236 -10.439 6.029 1.00 0.54 H new ATOM 0 HG1 THR A 182 -10.831 -11.200 4.726 1.00 1.16 H new ATOM 0 HG21 THR A 182 -13.164 -10.759 3.572 1.00 1.07 H new ATOM 0 HG22 THR A 182 -13.431 -9.049 3.986 1.00 1.07 H new ATOM 0 HG23 THR A 182 -11.821 -9.596 3.459 1.00 1.07 H new ATOM 2812 N ALA A 183 -10.360 -9.749 7.932 1.00 0.45 N ATOM 2813 CA ALA A 183 -10.083 -10.022 9.369 1.00 0.44 C ATOM 2814 C ALA A 183 -10.022 -8.699 10.132 1.00 0.44 C ATOM 2815 O ALA A 183 -10.426 -8.607 11.274 1.00 0.50 O ATOM 2816 CB ALA A 183 -8.745 -10.753 9.498 1.00 0.46 C ATOM 0 H ALA A 183 -9.636 -10.055 7.282 1.00 0.45 H new ATOM 0 HA ALA A 183 -10.876 -10.644 9.785 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -8.540 -10.954 10.550 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -8.791 -11.695 8.951 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -7.950 -10.132 9.086 1.00 0.46 H new ATOM 2822 N SER A 184 -9.518 -7.671 9.501 1.00 0.47 N ATOM 2823 CA SER A 184 -9.424 -6.343 10.170 1.00 0.51 C ATOM 2824 C SER A 184 -10.779 -5.633 10.110 1.00 0.54 C ATOM 2825 O SER A 184 -11.229 -5.056 11.076 1.00 0.56 O ATOM 2826 CB SER A 184 -8.372 -5.491 9.458 1.00 0.62 C ATOM 2827 OG SER A 184 -8.853 -5.126 8.171 1.00 1.55 O ATOM 0 H SER A 184 -9.165 -7.696 8.544 1.00 0.47 H new ATOM 0 HA SER A 184 -9.139 -6.485 11.213 1.00 0.51 H new ATOM 0 HB2 SER A 184 -8.154 -4.598 10.044 1.00 0.62 H new ATOM 0 HB3 SER A 184 -7.439 -6.047 9.366 1.00 0.62 H new ATOM 0 HG SER A 184 -9.204 -5.920 7.716 1.00 1.55 H new ATOM 2833 N LEU A 185 -11.437 -5.671 8.988 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.762 -4.998 8.888 1.00 0.69 C ATOM 2835 C LEU A 185 -13.751 -5.676 9.834 1.00 0.69 C ATOM 2836 O LEU A 185 -14.715 -5.087 10.281 1.00 0.79 O ATOM 2837 CB LEU A 185 -13.277 -5.110 7.450 1.00 0.71 C ATOM 2838 CG LEU A 185 -12.429 -4.222 6.522 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -12.813 -4.510 5.069 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -12.667 -2.727 6.828 1.00 1.18 C ATOM 0 H LEU A 185 -11.118 -6.136 8.138 1.00 0.58 H new ATOM 0 HA LEU A 185 -12.660 -3.948 9.162 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -13.232 -6.147 7.117 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -14.323 -4.806 7.404 1.00 0.71 H new ATOM 0 HG LEU A 185 -11.375 -4.446 6.686 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -12.217 -3.885 4.404 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -12.626 -5.560 4.844 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -13.870 -4.291 4.922 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -12.058 -2.118 6.161 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.720 -2.488 6.678 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -12.392 -2.519 7.862 1.00 1.18 H new ATOM 2852 N THR A 186 -13.513 -6.925 10.130 1.00 0.62 N ATOM 2853 CA THR A 186 -14.419 -7.684 11.037 1.00 0.68 C ATOM 2854 C THR A 186 -13.947 -7.560 12.486 1.00 0.62 C ATOM 2855 O THR A 186 -14.706 -7.837 13.394 1.00 0.64 O ATOM 2856 CB THR A 186 -14.457 -9.157 10.618 1.00 0.73 C ATOM 2857 OG1 THR A 186 -14.596 -9.240 9.208 1.00 0.89 O ATOM 2858 CG2 THR A 186 -15.634 -9.867 11.288 1.00 1.00 C ATOM 0 H THR A 186 -12.718 -7.458 9.777 1.00 0.62 H new ATOM 0 HA THR A 186 -15.423 -7.266 10.963 1.00 0.68 H new ATOM 0 HB THR A 186 -13.530 -9.640 10.928 1.00 0.73 H new ATOM 0 HG1 THR A 186 -13.763 -9.575 8.816 1.00 0.89 H new ATOM 0 HG21 THR A 186 -15.650 -10.913 10.982 1.00 1.00 H new ATOM 0 HG22 THR A 186 -15.526 -9.807 12.371 1.00 1.00 H new ATOM 0 HG23 THR A 186 -16.566 -9.387 10.989 1.00 1.00 H new ATOM 2866 N ILE A 187 -12.724 -7.155 12.749 1.00 0.64 N ATOM 2867 CA ILE A 187 -12.308 -7.054 14.188 1.00 0.66 C ATOM 2868 C ILE A 187 -12.856 -5.729 14.732 1.00 0.66 C ATOM 2869 O ILE A 187 -13.129 -5.600 15.909 1.00 0.75 O ATOM 2870 CB ILE A 187 -10.775 -7.131 14.308 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -10.394 -7.674 15.689 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -10.152 -5.737 14.129 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -8.869 -7.676 15.833 1.00 0.87 C ATOM 0 H ILE A 187 -12.019 -6.898 12.058 1.00 0.64 H new ATOM 0 HA ILE A 187 -12.709 -7.883 14.772 1.00 0.66 H new ATOM 0 HB ILE A 187 -10.399 -7.794 13.529 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -10.843 -7.060 16.470 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -10.783 -8.684 15.815 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.068 -5.809 14.217 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -10.411 -5.346 13.145 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -10.534 -5.066 14.898 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -8.597 -8.062 16.815 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -8.431 -8.308 15.060 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -8.492 -6.659 15.726 1.00 0.87 H new ATOM 2885 N TRP A 188 -12.994 -4.736 13.894 1.00 0.64 N ATOM 2886 CA TRP A 188 -13.496 -3.418 14.371 1.00 0.70 C ATOM 2887 C TRP A 188 -14.999 -3.505 14.641 1.00 0.81 C ATOM 2888 O TRP A 188 -15.531 -2.796 15.473 1.00 1.06 O ATOM 2889 CB TRP A 188 -13.226 -2.375 13.282 1.00 0.85 C ATOM 2890 CG TRP A 188 -13.786 -1.051 13.687 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -14.840 -0.443 13.097 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -13.337 -0.159 14.747 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -15.072 0.764 13.733 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -14.171 0.984 14.757 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -12.298 -0.232 15.692 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -13.980 2.018 15.674 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -12.103 0.808 16.615 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -12.943 1.930 16.606 1.00 1.71 C ATOM 0 H TRP A 188 -12.780 -4.783 12.898 1.00 0.64 H new ATOM 0 HA TRP A 188 -12.989 -3.136 15.294 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -12.153 -2.287 13.110 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -13.674 -2.696 12.342 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -15.408 -0.835 12.266 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -15.817 1.412 13.477 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -11.646 -1.093 15.708 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -14.630 2.881 15.663 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -11.301 0.743 17.336 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -12.789 2.726 17.319 1.00 1.71 H new ATOM 2909 N LYS A 189 -15.688 -4.372 13.953 1.00 0.95 N ATOM 2910 CA LYS A 189 -17.152 -4.507 14.176 1.00 1.23 C ATOM 2911 C LYS A 189 -17.404 -5.137 15.551 1.00 1.53 C ATOM 2912 O LYS A 189 -18.114 -6.115 15.674 1.00 2.02 O ATOM 2913 CB LYS A 189 -17.742 -5.401 13.081 1.00 1.90 C ATOM 2914 CG LYS A 189 -19.252 -5.169 12.978 1.00 2.68 C ATOM 2915 CD LYS A 189 -19.859 -6.133 11.942 1.00 3.60 C ATOM 2916 CE LYS A 189 -21.132 -5.525 11.352 1.00 4.51 C ATOM 2917 NZ LYS A 189 -22.083 -5.196 12.451 1.00 5.09 N ATOM 0 H LYS A 189 -15.298 -4.994 13.245 1.00 0.95 H new ATOM 0 HA LYS A 189 -17.625 -3.525 14.141 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -17.266 -5.183 12.125 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -17.540 -6.448 13.306 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -19.720 -5.324 13.950 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -19.452 -4.137 12.689 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -19.138 -6.330 11.149 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -20.086 -7.090 12.412 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -20.889 -4.626 10.786 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -21.593 -6.225 10.656 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -23.035 -5.059 12.056 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -22.102 -5.976 13.139 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -21.776 -4.323 12.926 1.00 5.09 H new ATOM 2931 N LYS A 190 -16.827 -4.587 16.584 1.00 2.36 N ATOM 2932 CA LYS A 190 -17.034 -5.159 17.945 1.00 3.37 C ATOM 2933 C LYS A 190 -18.487 -4.931 18.380 1.00 3.71 C ATOM 2934 O LYS A 190 -19.383 -5.639 17.965 1.00 4.35 O ATOM 2935 CB LYS A 190 -16.074 -4.483 18.930 1.00 4.30 C ATOM 2936 CG LYS A 190 -16.130 -5.203 20.280 1.00 5.08 C ATOM 2937 CD LYS A 190 -15.277 -4.443 21.298 1.00 5.78 C ATOM 2938 CE LYS A 190 -15.102 -5.294 22.558 1.00 6.76 C ATOM 2939 NZ LYS A 190 -16.435 -5.761 23.032 1.00 7.40 N ATOM 0 H LYS A 190 -16.222 -3.767 16.545 1.00 2.36 H new ATOM 0 HA LYS A 190 -16.834 -6.230 17.930 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -15.058 -4.506 18.536 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -16.344 -3.434 19.055 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -17.161 -5.266 20.628 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -15.766 -6.225 20.175 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -14.304 -4.207 20.868 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -15.752 -3.495 21.550 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -14.460 -6.149 22.346 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -14.611 -4.712 23.337 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -16.363 -6.068 24.023 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -17.121 -4.983 22.959 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -16.752 -6.559 22.445 1.00 7.40 H new ATOM 2953 N MET A 191 -18.734 -3.951 19.209 1.00 3.81 N ATOM 2954 CA MET A 191 -20.131 -3.690 19.659 1.00 4.63 C ATOM 2955 C MET A 191 -20.922 -3.038 18.522 1.00 4.97 C ATOM 2956 O MET A 191 -21.102 -1.837 18.488 1.00 5.27 O ATOM 2957 CB MET A 191 -20.106 -2.751 20.867 1.00 5.48 C ATOM 2958 CG MET A 191 -21.514 -2.636 21.456 1.00 5.71 C ATOM 2959 SD MET A 191 -21.461 -1.614 22.950 1.00 7.00 S ATOM 2960 CE MET A 191 -21.768 -0.018 22.153 1.00 7.52 C ATOM 0 H MET A 191 -18.029 -3.321 19.593 1.00 3.81 H new ATOM 0 HA MET A 191 -20.606 -4.631 19.937 1.00 4.63 H new ATOM 0 HB2 MET A 191 -19.415 -3.129 21.621 1.00 5.48 H new ATOM 0 HB3 MET A 191 -19.744 -1.767 20.568 1.00 5.48 H new ATOM 0 HG2 MET A 191 -22.191 -2.195 20.724 1.00 5.71 H new ATOM 0 HG3 MET A 191 -21.903 -3.626 21.693 1.00 5.71 H new ATOM 0 HE1 MET A 191 -21.777 0.769 22.907 1.00 7.52 H new ATOM 0 HE2 MET A 191 -20.981 0.183 21.427 1.00 7.52 H new ATOM 0 HE3 MET A 191 -22.732 -0.044 21.645 1.00 7.52 H new ATOM 2970 N GLY A 192 -21.396 -3.820 17.590 1.00 5.37 N ATOM 2971 CA GLY A 192 -22.174 -3.243 16.458 1.00 6.15 C ATOM 2972 C GLY A 192 -23.518 -2.724 16.971 1.00 6.68 C ATOM 2973 O GLY A 192 -24.432 -3.524 17.094 1.00 7.01 O ATOM 2974 OXT GLY A 192 -23.612 -1.536 17.233 1.00 7.06 O ATOM 0 H GLY A 192 -21.278 -4.833 17.564 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -21.613 -2.432 15.994 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -22.334 -4.000 15.690 1.00 6.15 H new TER 2978 GLY A 192