USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=38 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 126 CYS SG : rot -56:sc= 0.803 USER MOD Set 1.2: A 127 THR OG1 : rot -79:sc= -1.1! USER MOD Set 2.1: A 79 MET CE :methyl -148:sc= -0.0849 (180deg=-1.95!) USER MOD Set 2.2: A 186 THR OG1 : rot 93:sc= 0.791 USER MOD Set 3.1: A 18 GLN : amide:sc= -3.64! C(o=-3.4!,f=-3.8!) USER MOD Set 3.2: A 22 THR OG1 : rot 107:sc= 0.265 USER MOD Set 4.1: A 16 SER OG : rot 160:sc= -1.76! USER MOD Set 4.2: A 153 GLN : amide:sc= -1.77! K(o=-3.5!,f=1.9) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= -0.12 (180deg=-0.929) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= -0.34 K(o=-0.34,f=-2.4!) USER MOD Single : A 14 THR OG1 : rot -69:sc= 0.751 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -109:sc= -0.347 (180deg=-5.28!) USER MOD Single : A 21 LYS NZ :NH3+ -109:sc= -2.13 (180deg=-4.78!) USER MOD Single : A 28 GLN : amide:sc= -0.816 K(o=-0.82,f=-5!) USER MOD Single : A 32 GLN : amide:sc= -0.812 X(o=-0.81,f=-0.53) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.51) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 169:sc= -0.124 (180deg=-0.433) USER MOD Single : A 60 SER OG : rot -47:sc= 0.647 USER MOD Single : A 62 CYS SG : rot -160:sc= -2.96! USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 132:sc= 0.691 USER MOD Single : A 73 ASN : amide:sc= -0.306 K(o=-0.31,f=-1.5) 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) USER MOD Single : A 85 THR OG1 : rot 15:sc= 0.759 USER MOD Single : A 87 SER OG : rot 106:sc= 0.00137 USER MOD Single : A 99 MET CE :methyl 178:sc= 0 (180deg=-0.00528) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -1.23 K(o=-1.2,f=0.052) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 67:sc= -0.507 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 161:sc= -0.0288 (180deg=-0.38) USER MOD Single : A 128 LYS NZ :NH3+ -159:sc= -0.111 (180deg=-0.617) USER MOD Single : A 135 THR OG1 : rot 90:sc= 1.08 USER MOD Single : A 137 MET CE :methyl 131:sc= 0 (180deg=-0.111) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= -3.52! C(o=-3.5!,f=-2.4!) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot -106:sc= -0.133 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 GLN : amide:sc= 0 X(o=0,f=-0.0096) USER MOD Single : A 172 THR OG1 : rot 180:sc= -0.165 USER MOD Single : A 174 THR OG1 : rot -125:sc= 0.0416 USER MOD Single : A 182 THR OG1 : rot -7:sc= 0.467 USER MOD Single : A 184 SER OG : rot -150:sc= -0.801 USER MOD Single : A 189 LYS NZ :NH3+ -149:sc= -0.142 (180deg=-0.854) USER MOD Single : A 190 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.801 -9.722 -5.216 1.00 17.15 N ATOM 2 CA MET A 1 20.902 -10.744 -4.136 1.00 16.73 C ATOM 3 C MET A 1 22.213 -11.519 -4.286 1.00 16.39 C ATOM 4 O MET A 1 22.987 -11.279 -5.191 1.00 16.40 O ATOM 5 CB MET A 1 19.722 -11.713 -4.238 1.00 16.98 C ATOM 6 CG MET A 1 19.594 -12.214 -5.679 1.00 17.51 C ATOM 7 SD MET A 1 18.265 -13.439 -5.775 1.00 17.69 S ATOM 8 CE MET A 1 18.159 -13.518 -7.580 1.00 17.86 C ATOM 0 H1 MET A 1 19.800 -9.548 -5.437 1.00 17.15 H new ATOM 0 H2 MET A 1 21.244 -8.836 -4.898 1.00 17.15 H new ATOM 0 H3 MET A 1 21.288 -10.067 -6.067 1.00 17.15 H new ATOM 0 HA MET A 1 20.883 -10.249 -3.165 1.00 16.73 H new ATOM 0 HB2 MET A 1 19.870 -12.555 -3.561 1.00 16.98 H new ATOM 0 HB3 MET A 1 18.802 -11.215 -3.932 1.00 16.98 H new ATOM 0 HG2 MET A 1 19.383 -11.380 -6.348 1.00 17.51 H new ATOM 0 HG3 MET A 1 20.535 -12.656 -6.007 1.00 17.51 H new ATOM 0 HE1 MET A 1 17.385 -14.229 -7.868 1.00 17.86 H new ATOM 0 HE2 MET A 1 17.911 -12.532 -7.973 1.00 17.86 H new ATOM 0 HE3 MET A 1 19.117 -13.840 -7.987 1.00 17.86 H new ATOM 20 N ASP A 2 22.466 -12.448 -3.404 1.00 16.24 N ATOM 21 CA ASP A 2 23.725 -13.242 -3.493 1.00 16.07 C ATOM 22 C ASP A 2 24.931 -12.300 -3.407 1.00 15.50 C ATOM 23 O ASP A 2 24.799 -11.096 -3.496 1.00 15.56 O ATOM 24 CB ASP A 2 23.752 -14.005 -4.826 1.00 16.42 C ATOM 25 CG ASP A 2 24.739 -15.173 -4.737 1.00 16.67 C ATOM 26 OD1 ASP A 2 25.919 -14.914 -4.568 1.00 16.88 O ATOM 27 OD2 ASP A 2 24.297 -16.305 -4.840 1.00 16.77 O ATOM 0 H ASP A 2 21.854 -12.692 -2.625 1.00 16.24 H new ATOM 0 HA ASP A 2 23.769 -13.954 -2.669 1.00 16.07 H new ATOM 0 HB2 ASP A 2 22.755 -14.377 -5.063 1.00 16.42 H new ATOM 0 HB3 ASP A 2 24.042 -13.333 -5.634 1.00 16.42 H new ATOM 32 N GLY A 3 26.106 -12.844 -3.238 1.00 15.11 N ATOM 33 CA GLY A 3 27.324 -11.987 -3.150 1.00 14.72 C ATOM 34 C GLY A 3 27.118 -10.896 -2.095 1.00 14.60 C ATOM 35 O GLY A 3 26.487 -11.112 -1.079 1.00 14.88 O ATOM 0 H GLY A 3 26.275 -13.847 -3.157 1.00 15.11 H new ATOM 0 HA2 GLY A 3 28.190 -12.596 -2.892 1.00 14.72 H new ATOM 0 HA3 GLY A 3 27.531 -11.533 -4.119 1.00 14.72 H new ATOM 39 N SER A 4 27.649 -9.726 -2.333 1.00 14.34 N ATOM 40 CA SER A 4 27.491 -8.612 -1.353 1.00 14.41 C ATOM 41 C SER A 4 27.968 -9.062 0.031 1.00 13.79 C ATOM 42 O SER A 4 27.178 -9.397 0.891 1.00 14.02 O ATOM 43 CB SER A 4 26.019 -8.203 -1.275 1.00 14.82 C ATOM 44 OG SER A 4 25.898 -7.043 -0.462 1.00 14.88 O ATOM 0 H SER A 4 28.187 -9.493 -3.167 1.00 14.34 H new ATOM 0 HA SER A 4 28.090 -7.762 -1.680 1.00 14.41 H new ATOM 0 HB2 SER A 4 25.631 -8.003 -2.274 1.00 14.82 H new ATOM 0 HB3 SER A 4 25.425 -9.017 -0.859 1.00 14.82 H new ATOM 0 HG SER A 4 24.956 -6.776 -0.410 1.00 14.88 H new ATOM 50 N GLY A 5 29.255 -9.071 0.253 1.00 13.15 N ATOM 51 CA GLY A 5 29.779 -9.497 1.583 1.00 12.67 C ATOM 52 C GLY A 5 31.211 -8.989 1.760 1.00 12.31 C ATOM 53 O GLY A 5 31.850 -9.243 2.762 1.00 12.37 O ATOM 0 H GLY A 5 29.965 -8.802 -0.428 1.00 13.15 H new ATOM 0 HA2 GLY A 5 29.143 -9.106 2.377 1.00 12.67 H new ATOM 0 HA3 GLY A 5 29.756 -10.584 1.663 1.00 12.67 H new ATOM 57 N GLU A 6 31.723 -8.274 0.796 1.00 12.14 N ATOM 58 CA GLU A 6 33.114 -7.753 0.913 1.00 12.01 C ATOM 59 C GLU A 6 33.366 -6.718 -0.186 1.00 11.53 C ATOM 60 O GLU A 6 34.235 -5.876 -0.071 1.00 11.57 O ATOM 61 CB GLU A 6 34.105 -8.910 0.762 1.00 12.39 C ATOM 62 CG GLU A 6 35.526 -8.407 1.025 1.00 12.94 C ATOM 63 CD GLU A 6 36.489 -9.595 1.060 1.00 13.31 C ATOM 64 OE1 GLU A 6 36.248 -10.550 0.341 1.00 13.55 O ATOM 65 OE2 GLU A 6 37.452 -9.530 1.807 1.00 13.50 O ATOM 0 H GLU A 6 31.238 -8.028 -0.067 1.00 12.14 H new ATOM 0 HA GLU A 6 33.246 -7.285 1.889 1.00 12.01 H new ATOM 0 HB2 GLU A 6 33.856 -9.709 1.461 1.00 12.39 H new ATOM 0 HB3 GLU A 6 34.037 -9.331 -0.241 1.00 12.39 H new ATOM 0 HG2 GLU A 6 35.825 -7.706 0.246 1.00 12.94 H new ATOM 0 HG3 GLU A 6 35.563 -7.867 1.971 1.00 12.94 H new ATOM 72 N GLN A 7 32.616 -6.782 -1.257 1.00 11.25 N ATOM 73 CA GLN A 7 32.804 -5.813 -2.381 1.00 10.97 C ATOM 74 C GLN A 7 31.431 -5.366 -2.906 1.00 10.29 C ATOM 75 O GLN A 7 31.042 -5.749 -3.991 1.00 10.41 O ATOM 76 CB GLN A 7 33.571 -6.505 -3.510 1.00 11.52 C ATOM 77 CG GLN A 7 33.983 -5.471 -4.558 1.00 12.08 C ATOM 78 CD GLN A 7 34.754 -6.165 -5.682 1.00 12.56 C ATOM 79 OE1 GLN A 7 34.493 -5.935 -6.846 1.00 12.91 O ATOM 80 NE2 GLN A 7 35.699 -7.013 -5.380 1.00 12.77 N ATOM 0 H GLN A 7 31.876 -7.469 -1.402 1.00 11.25 H new ATOM 0 HA GLN A 7 33.360 -4.944 -2.029 1.00 10.97 H new ATOM 0 HB2 GLN A 7 34.454 -7.005 -3.111 1.00 11.52 H new ATOM 0 HB3 GLN A 7 32.949 -7.274 -3.968 1.00 11.52 H new ATOM 0 HG2 GLN A 7 33.101 -4.974 -4.961 1.00 12.08 H new ATOM 0 HG3 GLN A 7 34.602 -4.700 -4.100 1.00 12.08 H new ATOM 0 HE21 GLN A 7 35.918 -7.206 -4.403 1.00 12.77 H new ATOM 0 HE22 GLN A 7 36.219 -7.483 -6.121 1.00 12.77 H new ATOM 89 N PRO A 8 30.727 -4.573 -2.125 1.00 9.81 N ATOM 90 CA PRO A 8 29.391 -4.088 -2.524 1.00 9.37 C ATOM 91 C PRO A 8 29.500 -3.240 -3.800 1.00 9.09 C ATOM 92 O PRO A 8 29.912 -2.098 -3.764 1.00 9.07 O ATOM 93 CB PRO A 8 28.896 -3.247 -1.322 1.00 9.20 C ATOM 94 CG PRO A 8 30.013 -3.278 -0.238 1.00 9.57 C ATOM 95 CD PRO A 8 31.192 -4.101 -0.802 1.00 9.93 C ATOM 0 HA PRO A 8 28.698 -4.898 -2.752 1.00 9.37 H new ATOM 0 HB2 PRO A 8 28.689 -2.222 -1.630 1.00 9.20 H new ATOM 0 HB3 PRO A 8 27.966 -3.655 -0.926 1.00 9.20 H new ATOM 0 HG2 PRO A 8 30.336 -2.266 0.008 1.00 9.57 H new ATOM 0 HG3 PRO A 8 29.640 -3.726 0.683 1.00 9.57 H new ATOM 0 HD2 PRO A 8 32.091 -3.492 -0.893 1.00 9.93 H new ATOM 0 HD3 PRO A 8 31.439 -4.938 -0.148 1.00 9.93 H new ATOM 103 N ARG A 9 29.128 -3.794 -4.924 1.00 9.13 N ATOM 104 CA ARG A 9 29.204 -3.028 -6.205 1.00 9.14 C ATOM 105 C ARG A 9 28.075 -3.482 -7.131 1.00 8.60 C ATOM 106 O ARG A 9 28.285 -4.243 -8.055 1.00 8.68 O ATOM 107 CB ARG A 9 30.551 -3.291 -6.881 1.00 10.09 C ATOM 108 CG ARG A 9 31.661 -2.578 -6.107 1.00 10.67 C ATOM 109 CD ARG A 9 32.984 -2.730 -6.858 1.00 11.51 C ATOM 110 NE ARG A 9 32.911 -1.990 -8.148 1.00 12.05 N ATOM 111 CZ ARG A 9 34.002 -1.733 -8.815 1.00 12.65 C ATOM 112 NH1 ARG A 9 35.156 -2.127 -8.352 1.00 12.79 N ATOM 113 NH2 ARG A 9 33.939 -1.084 -9.945 1.00 13.27 N ATOM 0 H ARG A 9 28.774 -4.747 -5.011 1.00 9.13 H new ATOM 0 HA ARG A 9 29.105 -1.962 -5.998 1.00 9.14 H new ATOM 0 HB2 ARG A 9 30.749 -4.362 -6.916 1.00 10.09 H new ATOM 0 HB3 ARG A 9 30.527 -2.937 -7.912 1.00 10.09 H new ATOM 0 HG2 ARG A 9 31.417 -1.522 -5.989 1.00 10.67 H new ATOM 0 HG3 ARG A 9 31.749 -2.999 -5.105 1.00 10.67 H new ATOM 0 HD2 ARG A 9 33.805 -2.346 -6.252 1.00 11.51 H new ATOM 0 HD3 ARG A 9 33.191 -3.784 -7.043 1.00 11.51 H new ATOM 0 HE ARG A 9 32.008 -1.684 -8.510 1.00 12.05 H new ATOM 0 HH11 ARG A 9 35.205 -2.636 -7.469 1.00 12.79 H new ATOM 0 HH12 ARG A 9 36.010 -1.927 -8.873 1.00 12.79 H new ATOM 0 HH21 ARG A 9 33.036 -0.777 -10.307 1.00 13.27 H new ATOM 0 HH22 ARG A 9 34.793 -0.883 -10.466 1.00 13.27 H new ATOM 127 N GLY A 10 26.878 -3.025 -6.891 1.00 8.29 N ATOM 128 CA GLY A 10 25.740 -3.434 -7.759 1.00 8.00 C ATOM 129 C GLY A 10 24.440 -2.851 -7.207 1.00 7.45 C ATOM 130 O GLY A 10 23.580 -2.410 -7.943 1.00 7.68 O ATOM 0 H GLY A 10 26.639 -2.387 -6.132 1.00 8.29 H new ATOM 0 HA2 GLY A 10 25.903 -3.085 -8.779 1.00 8.00 H new ATOM 0 HA3 GLY A 10 25.674 -4.521 -7.801 1.00 8.00 H new ATOM 134 N GLY A 11 24.296 -2.844 -5.911 1.00 7.01 N ATOM 135 CA GLY A 11 23.059 -2.289 -5.298 1.00 6.74 C ATOM 136 C GLY A 11 23.033 -0.771 -5.479 1.00 5.83 C ATOM 137 O GLY A 11 23.606 -0.241 -6.410 1.00 6.06 O ATOM 0 H GLY A 11 24.985 -3.200 -5.248 1.00 7.01 H new ATOM 0 HA2 GLY A 11 22.179 -2.736 -5.762 1.00 6.74 H new ATOM 0 HA3 GLY A 11 23.022 -2.540 -4.238 1.00 6.74 H new ATOM 141 N GLY A 12 22.357 -0.067 -4.617 1.00 5.12 N ATOM 142 CA GLY A 12 22.280 1.411 -4.769 1.00 4.52 C ATOM 143 C GLY A 12 21.262 1.998 -3.781 1.00 3.52 C ATOM 144 O GLY A 12 21.607 2.863 -3.000 1.00 3.54 O ATOM 0 H GLY A 12 21.855 -0.450 -3.816 1.00 5.12 H new ATOM 0 HA2 GLY A 12 23.261 1.852 -4.595 1.00 4.52 H new ATOM 0 HA3 GLY A 12 21.993 1.664 -5.790 1.00 4.52 H new ATOM 148 N PRO A 13 20.030 1.530 -3.839 1.00 3.15 N ATOM 149 CA PRO A 13 18.977 2.040 -2.940 1.00 2.77 C ATOM 150 C PRO A 13 19.419 1.876 -1.480 1.00 2.05 C ATOM 151 O PRO A 13 19.375 0.788 -0.941 1.00 2.37 O ATOM 152 CB PRO A 13 17.736 1.169 -3.255 1.00 3.47 C ATOM 153 CG PRO A 13 18.088 0.278 -4.480 1.00 3.99 C ATOM 154 CD PRO A 13 19.589 0.475 -4.781 1.00 3.79 C ATOM 0 HA PRO A 13 18.768 3.100 -3.085 1.00 2.77 H new ATOM 0 HB2 PRO A 13 17.472 0.552 -2.396 1.00 3.47 H new ATOM 0 HB3 PRO A 13 16.872 1.797 -3.473 1.00 3.47 H new ATOM 0 HG2 PRO A 13 17.874 -0.769 -4.266 1.00 3.99 H new ATOM 0 HG3 PRO A 13 17.484 0.557 -5.343 1.00 3.99 H new ATOM 0 HD2 PRO A 13 20.147 -0.449 -4.629 1.00 3.79 H new ATOM 0 HD3 PRO A 13 19.748 0.777 -5.816 1.00 3.79 H new ATOM 162 N THR A 14 19.857 2.924 -0.834 1.00 1.59 N ATOM 163 CA THR A 14 20.307 2.773 0.585 1.00 1.24 C ATOM 164 C THR A 14 20.078 4.069 1.364 1.00 1.07 C ATOM 165 O THR A 14 20.340 4.131 2.549 1.00 1.20 O ATOM 166 CB THR A 14 21.804 2.430 0.613 1.00 1.43 C ATOM 167 OG1 THR A 14 22.495 3.274 -0.298 1.00 2.16 O ATOM 168 CG2 THR A 14 22.015 0.968 0.213 1.00 1.78 C ATOM 0 H THR A 14 19.923 3.866 -1.219 1.00 1.59 H new ATOM 0 HA THR A 14 19.729 1.974 1.049 1.00 1.24 H new ATOM 0 HB THR A 14 22.188 2.581 1.622 1.00 1.43 H new ATOM 0 HG1 THR A 14 22.253 3.032 -1.216 1.00 2.16 H new ATOM 0 HG21 THR A 14 23.079 0.735 0.236 1.00 1.78 H new ATOM 0 HG22 THR A 14 21.486 0.320 0.912 1.00 1.78 H new ATOM 0 HG23 THR A 14 21.630 0.807 -0.794 1.00 1.78 H new ATOM 176 N SER A 15 19.592 5.107 0.734 1.00 1.07 N ATOM 177 CA SER A 15 19.361 6.380 1.482 1.00 0.91 C ATOM 178 C SER A 15 17.949 6.346 2.081 1.00 0.75 C ATOM 179 O SER A 15 16.972 6.163 1.382 1.00 0.78 O ATOM 180 CB SER A 15 19.500 7.559 0.514 1.00 0.99 C ATOM 181 OG SER A 15 20.875 7.915 0.433 1.00 1.38 O ATOM 0 H SER A 15 19.347 5.130 -0.256 1.00 1.07 H new ATOM 0 HA SER A 15 20.091 6.493 2.284 1.00 0.91 H new ATOM 0 HB2 SER A 15 19.120 7.288 -0.471 1.00 0.99 H new ATOM 0 HB3 SER A 15 18.909 8.406 0.861 1.00 0.99 H new ATOM 0 HG SER A 15 20.982 8.668 -0.185 1.00 1.38 H new ATOM 187 N SER A 16 17.838 6.509 3.369 1.00 0.72 N ATOM 188 CA SER A 16 16.494 6.474 4.014 1.00 0.82 C ATOM 189 C SER A 16 15.604 7.579 3.440 1.00 0.81 C ATOM 190 O SER A 16 14.450 7.358 3.130 1.00 0.92 O ATOM 191 CB SER A 16 16.653 6.689 5.520 1.00 1.06 C ATOM 192 OG SER A 16 17.557 5.724 6.040 1.00 1.64 O ATOM 0 H SER A 16 18.620 6.665 4.005 1.00 0.72 H new ATOM 0 HA SER A 16 16.031 5.506 3.821 1.00 0.82 H new ATOM 0 HB2 SER A 16 17.023 7.695 5.718 1.00 1.06 H new ATOM 0 HB3 SER A 16 15.686 6.602 6.015 1.00 1.06 H new ATOM 0 HG SER A 16 17.909 6.035 6.900 1.00 1.64 H new ATOM 198 N GLU A 17 16.123 8.767 3.302 1.00 0.80 N ATOM 199 CA GLU A 17 15.295 9.879 2.756 1.00 0.94 C ATOM 200 C GLU A 17 14.879 9.565 1.316 1.00 0.85 C ATOM 201 O GLU A 17 13.833 9.982 0.859 1.00 0.89 O ATOM 202 CB GLU A 17 16.103 11.180 2.781 1.00 1.13 C ATOM 203 CG GLU A 17 15.190 12.364 2.447 1.00 1.71 C ATOM 204 CD GLU A 17 14.213 12.599 3.600 1.00 2.26 C ATOM 205 OE1 GLU A 17 14.623 13.189 4.587 1.00 2.90 O ATOM 206 OE2 GLU A 17 13.072 12.187 3.477 1.00 2.68 O ATOM 0 H GLU A 17 17.082 9.016 3.543 1.00 0.80 H new ATOM 0 HA GLU A 17 14.401 9.991 3.370 1.00 0.94 H new ATOM 0 HB2 GLU A 17 16.552 11.321 3.764 1.00 1.13 H new ATOM 0 HB3 GLU A 17 16.920 11.125 2.062 1.00 1.13 H new ATOM 0 HG2 GLU A 17 15.787 13.259 2.275 1.00 1.71 H new ATOM 0 HG3 GLU A 17 14.641 12.165 1.527 1.00 1.71 H new ATOM 213 N GLN A 18 15.689 8.841 0.592 1.00 0.80 N ATOM 214 CA GLN A 18 15.332 8.517 -0.819 1.00 0.83 C ATOM 215 C GLN A 18 14.248 7.436 -0.839 1.00 0.68 C ATOM 216 O GLN A 18 13.396 7.416 -1.705 1.00 0.69 O ATOM 217 CB GLN A 18 16.582 8.019 -1.561 1.00 0.96 C ATOM 218 CG GLN A 18 16.409 8.211 -3.073 1.00 1.53 C ATOM 219 CD GLN A 18 15.225 7.379 -3.570 1.00 2.23 C ATOM 220 OE1 GLN A 18 15.087 6.225 -3.218 1.00 2.69 O ATOM 221 NE2 GLN A 18 14.359 7.922 -4.381 1.00 3.07 N ATOM 0 H GLN A 18 16.579 8.461 0.915 1.00 0.80 H new ATOM 0 HA GLN A 18 14.953 9.411 -1.314 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.461 8.564 -1.216 1.00 0.96 H new ATOM 0 HB3 GLN A 18 16.752 6.966 -1.337 1.00 0.96 H new ATOM 0 HG2 GLN A 18 16.245 9.265 -3.298 1.00 1.53 H new ATOM 0 HG3 GLN A 18 17.319 7.912 -3.593 1.00 1.53 H new ATOM 0 HE21 GLN A 18 14.475 8.891 -4.677 1.00 3.07 H new ATOM 0 HE22 GLN A 18 13.566 7.377 -4.719 1.00 3.07 H new ATOM 230 N ILE A 19 14.260 6.542 0.113 1.00 0.59 N ATOM 231 CA ILE A 19 13.213 5.486 0.128 1.00 0.58 C ATOM 232 C ILE A 19 11.853 6.163 0.309 1.00 0.52 C ATOM 233 O ILE A 19 10.896 5.845 -0.367 1.00 0.59 O ATOM 234 CB ILE A 19 13.488 4.474 1.253 1.00 0.64 C ATOM 235 CG1 ILE A 19 14.684 3.597 0.869 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.261 3.583 1.486 1.00 0.73 C ATOM 237 CD1 ILE A 19 15.140 2.788 2.087 1.00 0.81 C ATOM 0 H ILE A 19 14.941 6.498 0.871 1.00 0.59 H new ATOM 0 HA ILE A 19 13.220 4.933 -0.811 1.00 0.58 H new ATOM 0 HB ILE A 19 13.707 5.021 2.170 1.00 0.64 H new ATOM 0 HG12 ILE A 19 14.409 2.925 0.056 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.502 4.219 0.506 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.473 2.873 2.285 1.00 0.73 H new ATOM 0 HG22 ILE A 19 11.410 4.203 1.768 1.00 0.73 H new ATOM 0 HG23 ILE A 19 12.027 3.039 0.571 1.00 0.73 H new ATOM 0 HD11 ILE A 19 15.991 2.165 1.812 1.00 0.81 H new ATOM 0 HD12 ILE A 19 15.432 3.468 2.887 1.00 0.81 H new ATOM 0 HD13 ILE A 19 14.322 2.154 2.430 1.00 0.81 H new ATOM 249 N MET A 20 11.751 7.070 1.242 1.00 0.51 N ATOM 250 CA MET A 20 10.430 7.723 1.474 1.00 0.60 C ATOM 251 C MET A 20 10.033 8.541 0.234 1.00 0.55 C ATOM 252 O MET A 20 8.870 8.633 -0.103 1.00 0.59 O ATOM 253 CB MET A 20 10.483 8.589 2.733 1.00 0.82 C ATOM 254 CG MET A 20 9.269 9.522 2.794 1.00 1.07 C ATOM 255 SD MET A 20 7.766 8.597 2.395 1.00 1.43 S ATOM 256 CE MET A 20 7.759 7.492 3.831 1.00 0.93 C ATOM 0 H MET A 20 12.511 7.384 1.845 1.00 0.51 H new ATOM 0 HA MET A 20 9.667 6.961 1.634 1.00 0.60 H new ATOM 0 HB2 MET A 20 10.505 7.953 3.618 1.00 0.82 H new ATOM 0 HB3 MET A 20 11.401 9.176 2.739 1.00 0.82 H new ATOM 0 HG2 MET A 20 9.185 9.960 3.789 1.00 1.07 H new ATOM 0 HG3 MET A 20 9.397 10.347 2.093 1.00 1.07 H new ATOM 0 HE1 MET A 20 8.007 6.480 3.512 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.496 7.834 4.557 1.00 0.93 H new ATOM 0 HE3 MET A 20 6.770 7.496 4.289 1.00 0.93 H new ATOM 266 N LYS A 21 10.973 9.090 -0.476 1.00 0.57 N ATOM 267 CA LYS A 21 10.617 9.842 -1.714 1.00 0.61 C ATOM 268 C LYS A 21 10.193 8.846 -2.802 1.00 0.53 C ATOM 269 O LYS A 21 9.327 9.129 -3.613 1.00 0.51 O ATOM 270 CB LYS A 21 11.819 10.656 -2.196 1.00 0.72 C ATOM 271 CG LYS A 21 11.369 11.634 -3.284 1.00 1.09 C ATOM 272 CD LYS A 21 12.595 12.258 -3.959 1.00 1.24 C ATOM 273 CE LYS A 21 13.452 12.991 -2.918 1.00 1.80 C ATOM 274 NZ LYS A 21 14.338 12.012 -2.226 1.00 2.40 N ATOM 0 H LYS A 21 11.969 9.053 -0.258 1.00 0.57 H new ATOM 0 HA LYS A 21 9.794 10.525 -1.501 1.00 0.61 H new ATOM 0 HB2 LYS A 21 12.261 11.201 -1.362 1.00 0.72 H new ATOM 0 HB3 LYS A 21 12.590 9.991 -2.586 1.00 0.72 H new ATOM 0 HG2 LYS A 21 10.760 11.114 -4.024 1.00 1.09 H new ATOM 0 HG3 LYS A 21 10.745 12.415 -2.849 1.00 1.09 H new ATOM 0 HD2 LYS A 21 13.185 11.483 -4.447 1.00 1.24 H new ATOM 0 HD3 LYS A 21 12.278 12.954 -4.736 1.00 1.24 H new ATOM 0 HE2 LYS A 21 14.052 13.761 -3.402 1.00 1.80 H new ATOM 0 HE3 LYS A 21 12.812 13.494 -2.193 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 14.010 11.878 -1.248 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 14.309 11.102 -2.728 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 15.314 12.372 -2.218 1.00 2.40 H new ATOM 288 N THR A 22 10.772 7.677 -2.827 1.00 0.53 N ATOM 289 CA THR A 22 10.384 6.673 -3.860 1.00 0.52 C ATOM 290 C THR A 22 8.949 6.200 -3.615 1.00 0.45 C ATOM 291 O THR A 22 8.149 6.107 -4.523 1.00 0.48 O ATOM 292 CB THR A 22 11.330 5.473 -3.762 1.00 0.55 C ATOM 293 OG1 THR A 22 12.674 5.925 -3.843 1.00 0.64 O ATOM 294 CG2 THR A 22 11.046 4.500 -4.907 1.00 0.62 C ATOM 0 H THR A 22 11.497 7.373 -2.177 1.00 0.53 H new ATOM 0 HA THR A 22 10.448 7.126 -4.849 1.00 0.52 H new ATOM 0 HB THR A 22 11.174 4.964 -2.811 1.00 0.55 H new ATOM 0 HG1 THR A 22 13.091 5.872 -2.958 1.00 0.64 H new ATOM 0 HG21 THR A 22 11.721 3.647 -4.835 1.00 0.62 H new ATOM 0 HG22 THR A 22 10.015 4.154 -4.843 1.00 0.62 H new ATOM 0 HG23 THR A 22 11.200 5.005 -5.860 1.00 0.62 H new ATOM 302 N GLY A 23 8.622 5.893 -2.392 1.00 0.42 N ATOM 303 CA GLY A 23 7.243 5.418 -2.073 1.00 0.43 C ATOM 304 C GLY A 23 6.214 6.499 -2.404 1.00 0.41 C ATOM 305 O GLY A 23 5.134 6.203 -2.881 1.00 0.47 O ATOM 0 H GLY A 23 9.253 5.950 -1.593 1.00 0.42 H new ATOM 0 HA2 GLY A 23 7.024 4.513 -2.640 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.177 5.156 -1.017 1.00 0.43 H new ATOM 309 N ALA A 24 6.532 7.746 -2.201 1.00 0.40 N ATOM 310 CA ALA A 24 5.567 8.826 -2.554 1.00 0.41 C ATOM 311 C ALA A 24 5.293 8.798 -4.061 1.00 0.41 C ATOM 312 O ALA A 24 4.243 9.197 -4.524 1.00 0.41 O ATOM 313 CB ALA A 24 6.197 10.176 -2.209 1.00 0.42 C ATOM 0 H ALA A 24 7.417 8.065 -1.807 1.00 0.40 H new ATOM 0 HA ALA A 24 4.638 8.678 -2.004 1.00 0.41 H new ATOM 0 HB1 ALA A 24 5.502 10.977 -2.462 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.419 10.212 -1.143 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.119 10.303 -2.776 1.00 0.42 H new ATOM 319 N LEU A 25 6.248 8.328 -4.826 1.00 0.42 N ATOM 320 CA LEU A 25 6.069 8.267 -6.307 1.00 0.44 C ATOM 321 C LEU A 25 5.113 7.117 -6.655 1.00 0.44 C ATOM 322 O LEU A 25 4.187 7.281 -7.423 1.00 0.46 O ATOM 323 CB LEU A 25 7.445 8.055 -6.976 1.00 0.47 C ATOM 324 CG LEU A 25 7.966 9.373 -7.586 1.00 0.77 C ATOM 325 CD1 LEU A 25 7.094 9.789 -8.798 1.00 1.58 C ATOM 326 CD2 LEU A 25 7.974 10.486 -6.513 1.00 1.67 C ATOM 0 H LEU A 25 7.146 7.983 -4.486 1.00 0.42 H new ATOM 0 HA LEU A 25 5.641 9.200 -6.674 1.00 0.44 H new ATOM 0 HB2 LEU A 25 8.158 7.682 -6.241 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.363 7.296 -7.754 1.00 0.47 H new ATOM 0 HG LEU A 25 8.987 9.220 -7.937 1.00 0.77 H new ATOM 0 HD11 LEU A 25 7.474 10.721 -9.217 1.00 1.58 H new ATOM 0 HD12 LEU A 25 7.130 9.008 -9.557 1.00 1.58 H new ATOM 0 HD13 LEU A 25 6.063 9.932 -8.473 1.00 1.58 H new ATOM 0 HD21 LEU A 25 8.343 11.413 -6.953 1.00 1.67 H new ATOM 0 HD22 LEU A 25 6.961 10.639 -6.140 1.00 1.67 H new ATOM 0 HD23 LEU A 25 8.623 10.192 -5.688 1.00 1.67 H new ATOM 338 N LEU A 26 5.355 5.948 -6.125 1.00 0.45 N ATOM 339 CA LEU A 26 4.480 4.786 -6.459 1.00 0.47 C ATOM 340 C LEU A 26 3.010 5.193 -6.346 1.00 0.49 C ATOM 341 O LEU A 26 2.243 5.021 -7.272 1.00 0.52 O ATOM 342 CB LEU A 26 4.771 3.615 -5.515 1.00 0.51 C ATOM 343 CG LEU A 26 6.284 3.403 -5.407 1.00 0.69 C ATOM 344 CD1 LEU A 26 6.571 2.178 -4.534 1.00 1.17 C ATOM 345 CD2 LEU A 26 6.882 3.201 -6.806 1.00 1.35 C ATOM 0 H LEU A 26 6.117 5.747 -5.478 1.00 0.45 H new ATOM 0 HA LEU A 26 4.687 4.472 -7.482 1.00 0.47 H new ATOM 0 HB2 LEU A 26 4.351 3.817 -4.530 1.00 0.51 H new ATOM 0 HB3 LEU A 26 4.293 2.709 -5.886 1.00 0.51 H new ATOM 0 HG LEU A 26 6.739 4.282 -4.950 1.00 0.69 H new ATOM 0 HD11 LEU A 26 7.648 2.029 -4.459 1.00 1.17 H new ATOM 0 HD12 LEU A 26 6.156 2.335 -3.538 1.00 1.17 H new ATOM 0 HD13 LEU A 26 6.113 1.296 -4.983 1.00 1.17 H new ATOM 0 HD21 LEU A 26 7.958 3.051 -6.723 1.00 1.35 H new ATOM 0 HD22 LEU A 26 6.428 2.327 -7.273 1.00 1.35 H new ATOM 0 HD23 LEU A 26 6.685 4.082 -7.417 1.00 1.35 H new ATOM 357 N LEU A 27 2.597 5.717 -5.225 1.00 0.50 N ATOM 358 CA LEU A 27 1.164 6.103 -5.100 1.00 0.56 C ATOM 359 C LEU A 27 0.827 7.154 -6.160 1.00 0.56 C ATOM 360 O LEU A 27 -0.097 6.992 -6.928 1.00 0.60 O ATOM 361 CB LEU A 27 0.869 6.662 -3.704 1.00 0.64 C ATOM 362 CG LEU A 27 1.547 5.804 -2.643 1.00 0.95 C ATOM 363 CD1 LEU A 27 1.173 6.335 -1.258 1.00 1.66 C ATOM 364 CD2 LEU A 27 1.074 4.353 -2.784 1.00 1.42 C ATOM 0 H LEU A 27 3.177 5.892 -4.405 1.00 0.50 H new ATOM 0 HA LEU A 27 0.549 5.216 -5.250 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.224 7.690 -3.633 1.00 0.64 H new ATOM 0 HB3 LEU A 27 -0.207 6.684 -3.532 1.00 0.64 H new ATOM 0 HG LEU A 27 2.629 5.844 -2.770 1.00 0.95 H new ATOM 0 HD11 LEU A 27 1.654 5.726 -0.493 1.00 1.66 H new ATOM 0 HD12 LEU A 27 1.506 7.368 -1.162 1.00 1.66 H new ATOM 0 HD13 LEU A 27 0.091 6.289 -1.131 1.00 1.66 H new ATOM 0 HD21 LEU A 27 1.558 3.737 -2.026 1.00 1.42 H new ATOM 0 HD22 LEU A 27 -0.007 4.308 -2.652 1.00 1.42 H new ATOM 0 HD23 LEU A 27 1.334 3.980 -3.775 1.00 1.42 H new ATOM 376 N GLN A 28 1.566 8.230 -6.208 1.00 0.55 N ATOM 377 CA GLN A 28 1.279 9.294 -7.217 1.00 0.58 C ATOM 378 C GLN A 28 1.042 8.665 -8.596 1.00 0.54 C ATOM 379 O GLN A 28 0.146 9.050 -9.321 1.00 0.58 O ATOM 380 CB GLN A 28 2.476 10.245 -7.300 1.00 0.60 C ATOM 381 CG GLN A 28 2.161 11.379 -8.278 1.00 1.00 C ATOM 382 CD GLN A 28 3.261 12.440 -8.203 1.00 1.40 C ATOM 383 OE1 GLN A 28 4.013 12.485 -7.250 1.00 2.09 O ATOM 384 NE2 GLN A 28 3.386 13.302 -9.175 1.00 1.91 N ATOM 0 H GLN A 28 2.357 8.419 -5.592 1.00 0.55 H new ATOM 0 HA GLN A 28 0.386 9.840 -6.914 1.00 0.58 H new ATOM 0 HB2 GLN A 28 2.699 10.653 -6.314 1.00 0.60 H new ATOM 0 HB3 GLN A 28 3.363 9.703 -7.629 1.00 0.60 H new ATOM 0 HG2 GLN A 28 2.087 10.988 -9.293 1.00 1.00 H new ATOM 0 HG3 GLN A 28 1.195 11.824 -8.037 1.00 1.00 H new ATOM 0 HE21 GLN A 28 2.754 13.264 -9.975 1.00 1.91 H new ATOM 0 HE22 GLN A 28 4.115 14.014 -9.135 1.00 1.91 H new ATOM 393 N GLY A 29 1.857 7.713 -8.968 1.00 0.50 N ATOM 394 CA GLY A 29 1.705 7.068 -10.305 1.00 0.48 C ATOM 395 C GLY A 29 0.547 6.065 -10.289 1.00 0.44 C ATOM 396 O GLY A 29 -0.461 6.261 -10.937 1.00 0.50 O ATOM 0 H GLY A 29 2.624 7.353 -8.401 1.00 0.50 H new ATOM 0 HA2 GLY A 29 1.524 7.829 -11.064 1.00 0.48 H new ATOM 0 HA3 GLY A 29 2.630 6.560 -10.577 1.00 0.48 H new ATOM 400 N PHE A 30 0.689 4.985 -9.566 1.00 0.44 N ATOM 401 CA PHE A 30 -0.399 3.961 -9.523 1.00 0.43 C ATOM 402 C PHE A 30 -1.753 4.651 -9.321 1.00 0.40 C ATOM 403 O PHE A 30 -2.761 4.209 -9.835 1.00 0.43 O ATOM 404 CB PHE A 30 -0.134 2.981 -8.363 1.00 0.47 C ATOM 405 CG PHE A 30 -1.416 2.262 -7.977 1.00 0.47 C ATOM 406 CD1 PHE A 30 -2.040 1.406 -8.893 1.00 1.20 C ATOM 407 CD2 PHE A 30 -1.985 2.466 -6.712 1.00 1.39 C ATOM 408 CE1 PHE A 30 -3.230 0.754 -8.546 1.00 1.21 C ATOM 409 CE2 PHE A 30 -3.173 1.812 -6.365 1.00 1.42 C ATOM 410 CZ PHE A 30 -3.796 0.957 -7.282 1.00 0.58 C ATOM 0 H PHE A 30 1.511 4.767 -9.003 1.00 0.44 H new ATOM 0 HA PHE A 30 -0.417 3.412 -10.464 1.00 0.43 H new ATOM 0 HB2 PHE A 30 0.624 2.255 -8.657 1.00 0.47 H new ATOM 0 HB3 PHE A 30 0.260 3.523 -7.503 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -1.603 1.248 -9.868 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -1.507 3.128 -6.005 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -3.711 0.095 -9.254 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -3.609 1.967 -5.389 1.00 1.42 H new ATOM 0 HZ PHE A 30 -4.713 0.454 -7.014 1.00 0.58 H new ATOM 420 N ILE A 31 -1.793 5.714 -8.569 1.00 0.40 N ATOM 421 CA ILE A 31 -3.097 6.392 -8.342 1.00 0.40 C ATOM 422 C ILE A 31 -3.531 7.133 -9.610 1.00 0.40 C ATOM 423 O ILE A 31 -4.646 6.979 -10.069 1.00 0.43 O ATOM 424 CB ILE A 31 -2.987 7.393 -7.176 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.833 6.629 -5.861 1.00 0.53 C ATOM 426 CG2 ILE A 31 -4.258 8.249 -7.131 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.440 7.604 -4.752 1.00 0.48 C ATOM 0 H ILE A 31 -0.989 6.139 -8.107 1.00 0.40 H new ATOM 0 HA ILE A 31 -3.840 5.635 -8.092 1.00 0.40 H new ATOM 0 HB ILE A 31 -2.118 8.035 -7.320 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.767 6.129 -5.607 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -2.074 5.853 -5.965 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -4.189 8.961 -6.308 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -4.365 8.790 -8.071 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -5.125 7.605 -6.982 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -2.330 7.062 -3.813 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.495 8.084 -5.007 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -3.215 8.363 -4.644 1.00 0.48 H new ATOM 439 N GLN A 32 -2.692 7.969 -10.158 1.00 0.42 N ATOM 440 CA GLN A 32 -3.119 8.740 -11.360 1.00 0.47 C ATOM 441 C GLN A 32 -3.160 7.839 -12.594 1.00 0.50 C ATOM 442 O GLN A 32 -3.898 8.075 -13.529 1.00 0.61 O ATOM 443 CB GLN A 32 -2.139 9.888 -11.610 1.00 0.57 C ATOM 444 CG GLN A 32 -2.233 10.916 -10.473 1.00 1.19 C ATOM 445 CD GLN A 32 -1.595 12.234 -10.917 1.00 1.59 C ATOM 446 OE1 GLN A 32 -1.968 12.791 -11.932 1.00 2.16 O ATOM 447 NE2 GLN A 32 -0.646 12.762 -10.195 1.00 2.21 N ATOM 0 H GLN A 32 -1.743 8.150 -9.832 1.00 0.42 H new ATOM 0 HA GLN A 32 -4.118 9.136 -11.178 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -1.122 9.501 -11.678 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -2.362 10.367 -12.563 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -3.276 11.079 -10.202 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -1.728 10.537 -9.584 1.00 1.19 H new ATOM 0 HE21 GLN A 32 -0.333 12.295 -9.344 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -0.217 13.642 -10.481 1.00 2.21 H new ATOM 456 N ASP A 33 -2.353 6.808 -12.605 1.00 0.49 N ATOM 457 CA ASP A 33 -2.300 5.875 -13.767 1.00 0.58 C ATOM 458 C ASP A 33 -3.620 5.133 -13.935 1.00 0.61 C ATOM 459 O ASP A 33 -4.201 5.111 -15.002 1.00 0.70 O ATOM 460 CB ASP A 33 -1.207 4.838 -13.493 1.00 0.61 C ATOM 461 CG ASP A 33 0.159 5.526 -13.476 1.00 1.10 C ATOM 462 OD1 ASP A 33 0.314 6.509 -14.182 1.00 1.78 O ATOM 463 OD2 ASP A 33 1.026 5.059 -12.757 1.00 1.89 O ATOM 0 H ASP A 33 -1.718 6.571 -11.843 1.00 0.49 H new ATOM 0 HA ASP A 33 -2.099 6.449 -14.671 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -1.390 4.346 -12.538 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -1.226 4.063 -14.260 1.00 0.61 H new ATOM 468 N ARG A 34 -4.087 4.497 -12.895 1.00 0.58 N ATOM 469 CA ARG A 34 -5.356 3.728 -13.007 1.00 0.71 C ATOM 470 C ARG A 34 -6.553 4.635 -12.756 1.00 0.65 C ATOM 471 O ARG A 34 -7.610 4.405 -13.311 1.00 0.85 O ATOM 472 CB ARG A 34 -5.371 2.577 -11.991 1.00 0.85 C ATOM 473 CG ARG A 34 -6.668 1.763 -12.151 1.00 1.25 C ATOM 474 CD ARG A 34 -6.682 0.579 -11.168 1.00 1.31 C ATOM 475 NE ARG A 34 -7.420 -0.578 -11.773 1.00 1.58 N ATOM 476 CZ ARG A 34 -8.590 -0.421 -12.341 1.00 2.09 C ATOM 477 NH1 ARG A 34 -9.227 0.714 -12.253 1.00 2.58 N ATOM 478 NH2 ARG A 34 -9.151 -1.428 -12.953 1.00 2.75 N ATOM 0 H ARG A 34 -3.645 4.477 -11.976 1.00 0.58 H new ATOM 0 HA ARG A 34 -5.420 3.322 -14.017 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -4.505 1.933 -12.143 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -5.301 2.972 -10.978 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -7.531 2.403 -11.971 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -6.751 1.396 -13.174 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -5.661 0.284 -10.926 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -7.158 0.876 -10.234 1.00 1.31 H new ATOM 0 HE ARG A 34 -7.002 -1.508 -11.742 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -8.815 1.492 -11.738 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -10.137 0.824 -12.700 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -8.679 -2.331 -12.987 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -10.062 -1.312 -13.397 1.00 2.75 H new ATOM 492 N ALA A 35 -6.434 5.657 -11.928 1.00 0.59 N ATOM 493 CA ALA A 35 -7.629 6.534 -11.677 1.00 0.66 C ATOM 494 C ALA A 35 -7.521 7.795 -12.536 1.00 0.80 C ATOM 495 O ALA A 35 -8.479 8.225 -13.147 1.00 0.88 O ATOM 496 CB ALA A 35 -7.694 6.906 -10.193 1.00 0.94 C ATOM 0 H ALA A 35 -5.583 5.915 -11.428 1.00 0.59 H new ATOM 0 HA ALA A 35 -8.540 5.998 -11.943 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -8.561 7.542 -10.015 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -7.779 5.999 -9.594 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -6.787 7.442 -9.912 1.00 0.94 H new ATOM 502 N GLY A 36 -6.360 8.395 -12.588 1.00 1.15 N ATOM 503 CA GLY A 36 -6.187 9.629 -13.403 1.00 1.62 C ATOM 504 C GLY A 36 -6.197 9.284 -14.893 1.00 1.54 C ATOM 505 O GLY A 36 -6.283 10.144 -15.746 1.00 2.10 O ATOM 0 H GLY A 36 -5.522 8.080 -12.098 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -6.987 10.335 -13.181 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -5.248 10.117 -13.142 1.00 1.62 H new ATOM 509 N ARG A 37 -6.096 8.018 -15.204 1.00 2.07 N ATOM 510 CA ARG A 37 -6.089 7.589 -16.631 1.00 2.87 C ATOM 511 C ARG A 37 -4.825 8.126 -17.316 1.00 3.46 C ATOM 512 O ARG A 37 -3.757 8.143 -16.736 1.00 4.10 O ATOM 513 CB ARG A 37 -7.347 8.129 -17.332 1.00 3.63 C ATOM 514 CG ARG A 37 -7.726 7.217 -18.506 1.00 4.34 C ATOM 515 CD ARG A 37 -8.713 7.940 -19.424 1.00 5.18 C ATOM 516 NE ARG A 37 -9.792 8.557 -18.605 1.00 5.74 N ATOM 517 CZ ARG A 37 -10.566 9.468 -19.128 1.00 6.53 C ATOM 518 NH1 ARG A 37 -10.390 9.838 -20.367 1.00 6.88 N ATOM 519 NH2 ARG A 37 -11.514 10.008 -18.413 1.00 7.21 N ATOM 0 H ARG A 37 -6.018 7.260 -14.526 1.00 2.07 H new ATOM 0 HA ARG A 37 -6.090 6.501 -16.692 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -8.173 8.185 -16.623 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -7.166 9.142 -17.691 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -6.833 6.938 -19.065 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -8.170 6.294 -18.133 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -8.195 8.707 -20.000 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -9.141 7.238 -20.140 1.00 5.18 H new ATOM 0 HE ARG A 37 -9.926 8.268 -17.636 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -9.648 9.415 -20.925 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -10.994 10.550 -20.777 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -11.650 9.718 -17.445 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -12.119 10.720 -18.822 1.00 7.21 H new ATOM 533 N MET A 38 -4.939 8.567 -18.544 1.00 3.74 N ATOM 534 CA MET A 38 -3.747 9.108 -19.270 1.00 4.68 C ATOM 535 C MET A 38 -4.170 10.320 -20.104 1.00 4.70 C ATOM 536 O MET A 38 -5.311 10.443 -20.504 1.00 5.17 O ATOM 537 CB MET A 38 -3.170 8.029 -20.194 1.00 5.62 C ATOM 538 CG MET A 38 -4.275 7.465 -21.092 1.00 5.93 C ATOM 539 SD MET A 38 -3.543 6.350 -22.317 1.00 6.79 S ATOM 540 CE MET A 38 -3.668 4.827 -21.348 1.00 7.04 C ATOM 0 H MET A 38 -5.809 8.576 -19.077 1.00 3.74 H new ATOM 0 HA MET A 38 -2.987 9.406 -18.547 1.00 4.68 H new ATOM 0 HB2 MET A 38 -2.372 8.451 -20.806 1.00 5.62 H new ATOM 0 HB3 MET A 38 -2.728 7.229 -19.601 1.00 5.62 H new ATOM 0 HG2 MET A 38 -5.010 6.930 -20.491 1.00 5.93 H new ATOM 0 HG3 MET A 38 -4.802 8.277 -21.592 1.00 5.93 H new ATOM 0 HE1 MET A 38 -3.265 3.995 -21.925 1.00 7.04 H new ATOM 0 HE2 MET A 38 -3.101 4.936 -20.424 1.00 7.04 H new ATOM 0 HE3 MET A 38 -4.714 4.632 -21.111 1.00 7.04 H new ATOM 550 N GLY A 39 -3.259 11.217 -20.370 1.00 4.57 N ATOM 551 CA GLY A 39 -3.613 12.419 -21.177 1.00 4.85 C ATOM 552 C GLY A 39 -2.393 13.335 -21.301 1.00 4.67 C ATOM 553 O GLY A 39 -1.504 13.091 -22.093 1.00 4.95 O ATOM 0 H GLY A 39 -2.287 11.169 -20.064 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -3.955 12.117 -22.167 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -4.436 12.956 -20.706 1.00 4.85 H new ATOM 557 N GLY A 40 -2.339 14.387 -20.531 1.00 4.58 N ATOM 558 CA GLY A 40 -1.171 15.310 -20.616 1.00 4.69 C ATOM 559 C GLY A 40 -1.295 16.397 -19.547 1.00 4.20 C ATOM 560 O GLY A 40 -0.519 17.331 -19.504 1.00 4.34 O ATOM 0 H GLY A 40 -3.051 14.647 -19.848 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -0.244 14.753 -20.477 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -1.125 15.764 -21.606 1.00 4.69 H new ATOM 564 N GLU A 41 -2.265 16.279 -18.683 1.00 4.01 N ATOM 565 CA GLU A 41 -2.447 17.299 -17.610 1.00 3.88 C ATOM 566 C GLU A 41 -3.186 16.648 -16.436 1.00 3.63 C ATOM 567 O GLU A 41 -3.756 15.583 -16.567 1.00 4.16 O ATOM 568 CB GLU A 41 -3.253 18.489 -18.159 1.00 4.26 C ATOM 569 CG GLU A 41 -4.270 17.998 -19.194 1.00 4.51 C ATOM 570 CD GLU A 41 -5.158 16.920 -18.571 1.00 4.90 C ATOM 571 OE1 GLU A 41 -6.113 17.281 -17.903 1.00 5.28 O ATOM 572 OE2 GLU A 41 -4.868 15.753 -18.773 1.00 5.19 O ATOM 0 H GLU A 41 -2.943 15.517 -18.673 1.00 4.01 H new ATOM 0 HA GLU A 41 -1.479 17.666 -17.270 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -3.768 18.998 -17.344 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -2.580 19.216 -18.614 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -4.881 18.831 -19.541 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -3.752 17.598 -20.066 1.00 4.51 H new ATOM 579 N ALA A 42 -3.177 17.269 -15.288 1.00 3.19 N ATOM 580 CA ALA A 42 -3.870 16.679 -14.107 1.00 3.24 C ATOM 581 C ALA A 42 -3.907 17.733 -12.986 1.00 2.77 C ATOM 582 O ALA A 42 -3.024 17.751 -12.152 1.00 3.06 O ATOM 583 CB ALA A 42 -3.080 15.467 -13.613 1.00 4.08 C ATOM 0 H ALA A 42 -2.718 18.163 -15.116 1.00 3.19 H new ATOM 0 HA ALA A 42 -4.880 16.375 -14.381 1.00 3.24 H new ATOM 0 HB1 ALA A 42 -3.583 15.032 -12.749 1.00 4.08 H new ATOM 0 HB2 ALA A 42 -3.018 14.724 -14.408 1.00 4.08 H new ATOM 0 HB3 ALA A 42 -2.075 15.779 -13.328 1.00 4.08 H new ATOM 589 N PRO A 43 -4.894 18.606 -12.999 1.00 2.70 N ATOM 590 CA PRO A 43 -4.977 19.672 -11.983 1.00 3.03 C ATOM 591 C PRO A 43 -5.083 19.075 -10.570 1.00 2.67 C ATOM 592 O PRO A 43 -5.099 19.794 -9.591 1.00 2.87 O ATOM 593 CB PRO A 43 -6.237 20.484 -12.356 1.00 3.84 C ATOM 594 CG PRO A 43 -6.829 19.863 -13.654 1.00 3.86 C ATOM 595 CD PRO A 43 -5.987 18.614 -13.998 1.00 3.12 C ATOM 0 HA PRO A 43 -4.087 20.301 -11.971 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -6.967 20.450 -11.548 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -5.984 21.532 -12.514 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -7.874 19.592 -13.507 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -6.798 20.583 -14.472 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -6.585 17.705 -13.937 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -5.594 18.669 -15.013 1.00 3.12 H new ATOM 603 N GLU A 44 -5.156 17.777 -10.449 1.00 2.45 N ATOM 604 CA GLU A 44 -5.261 17.175 -9.089 1.00 2.23 C ATOM 605 C GLU A 44 -3.915 17.304 -8.371 1.00 1.75 C ATOM 606 O GLU A 44 -3.405 18.391 -8.188 1.00 2.00 O ATOM 607 CB GLU A 44 -5.676 15.693 -9.196 1.00 2.55 C ATOM 608 CG GLU A 44 -7.189 15.594 -9.189 1.00 2.70 C ATOM 609 CD GLU A 44 -7.778 16.432 -10.325 1.00 3.17 C ATOM 610 OE1 GLU A 44 -7.819 15.937 -11.439 1.00 3.77 O ATOM 611 OE2 GLU A 44 -8.181 17.553 -10.061 1.00 3.42 O ATOM 0 H GLU A 44 -5.148 17.114 -11.224 1.00 2.45 H new ATOM 0 HA GLU A 44 -6.022 17.704 -8.516 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -5.276 15.257 -10.111 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -5.259 15.126 -8.364 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -7.493 14.553 -9.300 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -7.579 15.940 -8.232 1.00 2.70 H new ATOM 618 N LEU A 45 -3.337 16.211 -7.952 1.00 1.80 N ATOM 619 CA LEU A 45 -2.044 16.287 -7.244 1.00 1.80 C ATOM 620 C LEU A 45 -1.084 17.133 -8.076 1.00 2.29 C ATOM 621 O LEU A 45 -0.191 17.778 -7.561 1.00 3.01 O ATOM 622 CB LEU A 45 -1.475 14.871 -7.050 1.00 2.23 C ATOM 623 CG LEU A 45 -2.613 13.884 -6.668 1.00 2.52 C ATOM 624 CD1 LEU A 45 -3.086 13.108 -7.906 1.00 3.22 C ATOM 625 CD2 LEU A 45 -2.109 12.881 -5.622 1.00 3.00 C ATOM 0 H LEU A 45 -3.712 15.270 -8.074 1.00 1.80 H new ATOM 0 HA LEU A 45 -2.178 16.743 -6.263 1.00 1.80 H new ATOM 0 HB2 LEU A 45 -0.987 14.538 -7.966 1.00 2.23 H new ATOM 0 HB3 LEU A 45 -0.714 14.880 -6.269 1.00 2.23 H new ATOM 0 HG LEU A 45 -3.443 14.461 -6.260 1.00 2.52 H new ATOM 0 HD11 LEU A 45 -3.883 12.421 -7.622 1.00 3.22 H new ATOM 0 HD12 LEU A 45 -3.459 13.808 -8.653 1.00 3.22 H new ATOM 0 HD13 LEU A 45 -2.252 12.544 -8.322 1.00 3.22 H new ATOM 0 HD21 LEU A 45 -2.913 12.193 -5.360 1.00 3.00 H new ATOM 0 HD22 LEU A 45 -1.270 12.319 -6.032 1.00 3.00 H new ATOM 0 HD23 LEU A 45 -1.786 13.417 -4.730 1.00 3.00 H new ATOM 637 N ALA A 46 -1.268 17.125 -9.368 1.00 2.46 N ATOM 638 CA ALA A 46 -0.369 17.919 -10.255 1.00 3.15 C ATOM 639 C ALA A 46 1.091 17.586 -9.930 1.00 2.91 C ATOM 640 O ALA A 46 1.623 16.587 -10.371 1.00 3.07 O ATOM 641 CB ALA A 46 -0.613 19.413 -10.028 1.00 4.05 C ATOM 0 H ALA A 46 -2.001 16.603 -9.848 1.00 2.46 H new ATOM 0 HA ALA A 46 -0.577 17.672 -11.296 1.00 3.15 H new ATOM 0 HB1 ALA A 46 0.045 19.992 -10.677 1.00 4.05 H new ATOM 0 HB2 ALA A 46 -1.651 19.651 -10.258 1.00 4.05 H new ATOM 0 HB3 ALA A 46 -0.406 19.661 -8.987 1.00 4.05 H new ATOM 647 N LEU A 47 1.741 18.417 -9.159 1.00 3.18 N ATOM 648 CA LEU A 47 3.165 18.151 -8.802 1.00 3.43 C ATOM 649 C LEU A 47 4.007 18.082 -10.082 1.00 3.14 C ATOM 650 O LEU A 47 5.026 17.424 -10.132 1.00 3.51 O ATOM 651 CB LEU A 47 3.257 16.817 -8.035 1.00 4.05 C ATOM 652 CG LEU A 47 4.518 16.794 -7.142 1.00 4.77 C ATOM 653 CD1 LEU A 47 4.225 17.464 -5.794 1.00 5.26 C ATOM 654 CD2 LEU A 47 4.946 15.344 -6.889 1.00 5.35 C ATOM 0 H LEU A 47 1.347 19.269 -8.761 1.00 3.18 H new ATOM 0 HA LEU A 47 3.544 18.954 -8.170 1.00 3.43 H new ATOM 0 HB2 LEU A 47 2.367 16.681 -7.421 1.00 4.05 H new ATOM 0 HB3 LEU A 47 3.288 15.986 -8.740 1.00 4.05 H new ATOM 0 HG LEU A 47 5.315 17.335 -7.652 1.00 4.77 H new ATOM 0 HD11 LEU A 47 5.121 17.441 -5.174 1.00 5.26 H new ATOM 0 HD12 LEU A 47 3.924 18.499 -5.960 1.00 5.26 H new ATOM 0 HD13 LEU A 47 3.421 16.929 -5.289 1.00 5.26 H new ATOM 0 HD21 LEU A 47 5.835 15.332 -6.259 1.00 5.35 H new ATOM 0 HD22 LEU A 47 4.139 14.809 -6.388 1.00 5.35 H new ATOM 0 HD23 LEU A 47 5.168 14.859 -7.840 1.00 5.35 H new ATOM 666 N ASP A 48 3.579 18.765 -11.112 1.00 3.02 N ATOM 667 CA ASP A 48 4.332 18.764 -12.403 1.00 3.07 C ATOM 668 C ASP A 48 4.416 17.323 -12.960 1.00 2.77 C ATOM 669 O ASP A 48 4.519 16.389 -12.190 1.00 2.85 O ATOM 670 CB ASP A 48 5.749 19.304 -12.173 1.00 3.61 C ATOM 671 CG ASP A 48 5.686 20.538 -11.271 1.00 4.22 C ATOM 672 OD1 ASP A 48 5.383 21.605 -11.781 1.00 4.69 O ATOM 673 OD2 ASP A 48 5.942 20.396 -10.087 1.00 4.68 O ATOM 0 H ASP A 48 2.730 19.330 -11.114 1.00 3.02 H new ATOM 0 HA ASP A 48 3.812 19.399 -13.120 1.00 3.07 H new ATOM 0 HB2 ASP A 48 6.372 18.536 -11.714 1.00 3.61 H new ATOM 0 HB3 ASP A 48 6.211 19.561 -13.126 1.00 3.61 H new ATOM 678 N PRO A 49 4.386 17.163 -14.275 1.00 3.11 N ATOM 679 CA PRO A 49 4.480 15.818 -14.882 1.00 3.40 C ATOM 680 C PRO A 49 5.813 15.164 -14.488 1.00 3.08 C ATOM 681 O PRO A 49 6.864 15.552 -14.959 1.00 3.32 O ATOM 682 CB PRO A 49 4.408 16.060 -16.409 1.00 4.36 C ATOM 683 CG PRO A 49 4.365 17.598 -16.637 1.00 4.66 C ATOM 684 CD PRO A 49 4.258 18.270 -15.251 1.00 3.86 C ATOM 0 HA PRO A 49 3.688 15.148 -14.548 1.00 3.40 H new ATOM 0 HB2 PRO A 49 5.273 15.623 -16.908 1.00 4.36 H new ATOM 0 HB3 PRO A 49 3.522 15.585 -16.831 1.00 4.36 H new ATOM 0 HG2 PRO A 49 5.262 17.934 -17.158 1.00 4.66 H new ATOM 0 HG3 PRO A 49 3.514 17.869 -17.261 1.00 4.66 H new ATOM 0 HD2 PRO A 49 5.044 19.012 -15.111 1.00 3.86 H new ATOM 0 HD3 PRO A 49 3.306 18.788 -15.137 1.00 3.86 H new ATOM 692 N VAL A 50 5.781 14.178 -13.631 1.00 3.08 N ATOM 693 CA VAL A 50 7.050 13.511 -13.216 1.00 3.10 C ATOM 694 C VAL A 50 7.411 12.423 -14.254 1.00 2.75 C ATOM 695 O VAL A 50 6.554 11.633 -14.598 1.00 2.91 O ATOM 696 CB VAL A 50 6.837 12.852 -11.852 1.00 3.88 C ATOM 697 CG1 VAL A 50 8.190 12.437 -11.271 1.00 4.44 C ATOM 698 CG2 VAL A 50 6.166 13.853 -10.907 1.00 4.50 C ATOM 0 H VAL A 50 4.934 13.806 -13.201 1.00 3.08 H new ATOM 0 HA VAL A 50 7.855 14.243 -13.155 1.00 3.10 H new ATOM 0 HB VAL A 50 6.204 11.972 -11.966 1.00 3.88 H new ATOM 0 HG11 VAL A 50 8.040 11.967 -10.299 1.00 4.44 H new ATOM 0 HG12 VAL A 50 8.674 11.730 -11.945 1.00 4.44 H new ATOM 0 HG13 VAL A 50 8.822 13.318 -11.155 1.00 4.44 H new ATOM 0 HG21 VAL A 50 6.012 13.387 -9.933 1.00 4.50 H new ATOM 0 HG22 VAL A 50 6.804 14.730 -10.793 1.00 4.50 H new ATOM 0 HG23 VAL A 50 5.204 14.155 -11.321 1.00 4.50 H new ATOM 708 N PRO A 51 8.643 12.379 -14.735 1.00 2.91 N ATOM 709 CA PRO A 51 9.029 11.350 -15.724 1.00 3.22 C ATOM 710 C PRO A 51 8.770 9.946 -15.153 1.00 2.93 C ATOM 711 O PRO A 51 9.013 9.683 -13.992 1.00 3.37 O ATOM 712 CB PRO A 51 10.534 11.588 -15.986 1.00 4.09 C ATOM 713 CG PRO A 51 10.970 12.816 -15.136 1.00 4.27 C ATOM 714 CD PRO A 51 9.730 13.312 -14.359 1.00 3.50 C ATOM 0 HA PRO A 51 8.453 11.417 -16.647 1.00 3.22 H new ATOM 0 HB2 PRO A 51 11.115 10.707 -15.712 1.00 4.09 H new ATOM 0 HB3 PRO A 51 10.714 11.772 -17.045 1.00 4.09 H new ATOM 0 HG2 PRO A 51 11.768 12.540 -14.447 1.00 4.27 H new ATOM 0 HG3 PRO A 51 11.361 13.606 -15.777 1.00 4.27 H new ATOM 0 HD2 PRO A 51 9.907 13.299 -13.284 1.00 3.50 H new ATOM 0 HD3 PRO A 51 9.480 14.338 -14.628 1.00 3.50 H new ATOM 722 N GLN A 52 8.277 9.044 -15.964 1.00 2.70 N ATOM 723 CA GLN A 52 8.000 7.660 -15.475 1.00 2.85 C ATOM 724 C GLN A 52 9.263 6.804 -15.596 1.00 2.14 C ATOM 725 O GLN A 52 9.508 6.181 -16.610 1.00 2.38 O ATOM 726 CB GLN A 52 6.886 7.033 -16.318 1.00 3.67 C ATOM 727 CG GLN A 52 5.591 7.826 -16.133 1.00 4.37 C ATOM 728 CD GLN A 52 5.037 7.578 -14.728 1.00 5.22 C ATOM 729 OE1 GLN A 52 5.359 8.294 -13.801 1.00 5.74 O ATOM 730 NE2 GLN A 52 4.210 6.588 -14.530 1.00 5.74 N ATOM 0 H GLN A 52 8.054 9.207 -16.946 1.00 2.70 H new ATOM 0 HA GLN A 52 7.691 7.706 -14.431 1.00 2.85 H new ATOM 0 HB2 GLN A 52 7.173 7.026 -17.370 1.00 3.67 H new ATOM 0 HB3 GLN A 52 6.734 5.995 -16.022 1.00 3.67 H new ATOM 0 HG2 GLN A 52 5.779 8.890 -16.279 1.00 4.37 H new ATOM 0 HG3 GLN A 52 4.858 7.527 -16.882 1.00 4.37 H new ATOM 0 HE21 GLN A 52 3.939 5.986 -15.308 1.00 5.74 H new ATOM 0 HE22 GLN A 52 3.834 6.416 -13.597 1.00 5.74 H new ATOM 739 N ASP A 53 10.061 6.761 -14.565 1.00 1.78 N ATOM 740 CA ASP A 53 11.303 5.937 -14.610 1.00 1.30 C ATOM 741 C ASP A 53 10.947 4.477 -14.906 1.00 1.07 C ATOM 742 O ASP A 53 9.841 4.031 -14.674 1.00 1.19 O ATOM 743 CB ASP A 53 12.027 6.023 -13.265 1.00 1.65 C ATOM 744 CG ASP A 53 12.334 7.487 -12.942 1.00 2.27 C ATOM 745 OD1 ASP A 53 13.324 7.990 -13.447 1.00 2.91 O ATOM 746 OD2 ASP A 53 11.573 8.079 -12.194 1.00 2.80 O ATOM 0 H ASP A 53 9.906 7.262 -13.690 1.00 1.78 H new ATOM 0 HA ASP A 53 11.954 6.316 -15.398 1.00 1.30 H new ATOM 0 HB2 ASP A 53 11.409 5.588 -12.479 1.00 1.65 H new ATOM 0 HB3 ASP A 53 12.951 5.446 -13.300 1.00 1.65 H new ATOM 751 N ALA A 54 11.887 3.738 -15.433 1.00 0.91 N ATOM 752 CA ALA A 54 11.636 2.307 -15.772 1.00 0.84 C ATOM 753 C ALA A 54 11.487 1.476 -14.496 1.00 0.76 C ATOM 754 O ALA A 54 10.791 0.479 -14.476 1.00 0.75 O ATOM 755 CB ALA A 54 12.819 1.772 -16.583 1.00 0.95 C ATOM 0 H ALA A 54 12.828 4.069 -15.645 1.00 0.91 H new ATOM 0 HA ALA A 54 10.716 2.234 -16.352 1.00 0.84 H new ATOM 0 HB1 ALA A 54 12.644 0.726 -16.835 1.00 0.95 H new ATOM 0 HB2 ALA A 54 12.925 2.353 -17.499 1.00 0.95 H new ATOM 0 HB3 ALA A 54 13.732 1.855 -15.993 1.00 0.95 H new ATOM 761 N SER A 55 12.128 1.870 -13.432 1.00 0.75 N ATOM 762 CA SER A 55 12.012 1.091 -12.165 1.00 0.71 C ATOM 763 C SER A 55 10.615 1.286 -11.576 1.00 0.66 C ATOM 764 O SER A 55 9.953 0.342 -11.193 1.00 0.66 O ATOM 765 CB SER A 55 13.059 1.585 -11.168 1.00 0.76 C ATOM 766 OG SER A 55 14.356 1.389 -11.715 1.00 1.37 O ATOM 0 H SER A 55 12.726 2.695 -13.383 1.00 0.75 H new ATOM 0 HA SER A 55 12.176 0.033 -12.370 1.00 0.71 H new ATOM 0 HB2 SER A 55 12.900 2.641 -10.949 1.00 0.76 H new ATOM 0 HB3 SER A 55 12.964 1.046 -10.226 1.00 0.76 H new ATOM 0 HG SER A 55 15.031 1.706 -11.079 1.00 1.37 H new ATOM 772 N THR A 56 10.166 2.507 -11.493 1.00 0.65 N ATOM 773 CA THR A 56 8.817 2.771 -10.921 1.00 0.62 C ATOM 774 C THR A 56 7.740 2.373 -11.932 1.00 0.59 C ATOM 775 O THR A 56 6.647 1.990 -11.567 1.00 0.57 O ATOM 776 CB THR A 56 8.677 4.267 -10.617 1.00 0.67 C ATOM 777 OG1 THR A 56 9.222 5.017 -11.694 1.00 1.09 O ATOM 778 CG2 THR A 56 9.418 4.619 -9.328 1.00 1.06 C ATOM 0 H THR A 56 10.677 3.336 -11.798 1.00 0.65 H new ATOM 0 HA THR A 56 8.697 2.190 -10.007 1.00 0.62 H new ATOM 0 HB THR A 56 7.621 4.507 -10.493 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.133 5.974 -11.504 1.00 1.09 H new ATOM 0 HG21 THR A 56 9.310 5.684 -9.125 1.00 1.06 H new ATOM 0 HG22 THR A 56 8.999 4.048 -8.500 1.00 1.06 H new ATOM 0 HG23 THR A 56 10.475 4.376 -9.438 1.00 1.06 H new ATOM 786 N LYS A 57 8.028 2.481 -13.200 1.00 0.61 N ATOM 787 CA LYS A 57 6.999 2.129 -14.215 1.00 0.59 C ATOM 788 C LYS A 57 6.620 0.653 -14.078 1.00 0.54 C ATOM 789 O LYS A 57 5.480 0.278 -14.273 1.00 0.52 O ATOM 790 CB LYS A 57 7.539 2.410 -15.621 1.00 0.65 C ATOM 791 CG LYS A 57 6.528 1.932 -16.672 1.00 1.20 C ATOM 792 CD LYS A 57 6.808 2.619 -18.013 1.00 1.33 C ATOM 793 CE LYS A 57 8.235 2.303 -18.466 1.00 1.94 C ATOM 794 NZ LYS A 57 8.402 2.702 -19.892 1.00 2.73 N ATOM 0 H LYS A 57 8.924 2.795 -13.574 1.00 0.61 H new ATOM 0 HA LYS A 57 6.109 2.737 -14.052 1.00 0.59 H new ATOM 0 HB2 LYS A 57 7.726 3.477 -15.742 1.00 0.65 H new ATOM 0 HB3 LYS A 57 8.492 1.901 -15.763 1.00 0.65 H new ATOM 0 HG2 LYS A 57 6.593 0.850 -16.787 1.00 1.20 H new ATOM 0 HG3 LYS A 57 5.514 2.157 -16.343 1.00 1.20 H new ATOM 0 HD2 LYS A 57 6.094 2.279 -18.763 1.00 1.33 H new ATOM 0 HD3 LYS A 57 6.678 3.697 -17.915 1.00 1.33 H new ATOM 0 HE2 LYS A 57 8.953 2.835 -17.842 1.00 1.94 H new ATOM 0 HE3 LYS A 57 8.438 1.239 -18.349 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 9.372 2.488 -20.201 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 7.726 2.175 -20.481 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 8.225 3.722 -19.990 1.00 2.73 H new ATOM 808 N LYS A 58 7.554 -0.199 -13.745 1.00 0.55 N ATOM 809 CA LYS A 58 7.210 -1.646 -13.604 1.00 0.53 C ATOM 810 C LYS A 58 6.483 -1.839 -12.266 1.00 0.48 C ATOM 811 O LYS A 58 5.491 -2.537 -12.190 1.00 0.46 O ATOM 812 CB LYS A 58 8.503 -2.479 -13.675 1.00 0.56 C ATOM 813 CG LYS A 58 8.292 -3.906 -13.143 1.00 0.78 C ATOM 814 CD LYS A 58 7.210 -4.620 -13.955 1.00 0.96 C ATOM 815 CE LYS A 58 7.096 -6.068 -13.480 1.00 0.85 C ATOM 816 NZ LYS A 58 6.630 -6.084 -12.065 1.00 1.75 N ATOM 0 H LYS A 58 8.529 0.040 -13.566 1.00 0.55 H new ATOM 0 HA LYS A 58 6.554 -1.978 -14.409 1.00 0.53 H new ATOM 0 HB2 LYS A 58 8.851 -2.523 -14.707 1.00 0.56 H new ATOM 0 HB3 LYS A 58 9.285 -1.987 -13.096 1.00 0.56 H new ATOM 0 HG2 LYS A 58 9.226 -4.464 -13.199 1.00 0.78 H new ATOM 0 HG3 LYS A 58 8.004 -3.871 -12.092 1.00 0.78 H new ATOM 0 HD2 LYS A 58 6.254 -4.110 -13.837 1.00 0.96 H new ATOM 0 HD3 LYS A 58 7.457 -4.592 -15.016 1.00 0.96 H new ATOM 0 HE2 LYS A 58 6.397 -6.617 -14.112 1.00 0.85 H new ATOM 0 HE3 LYS A 58 8.061 -6.568 -13.563 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 6.373 -7.055 -11.795 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 7.392 -5.743 -11.445 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 5.800 -5.466 -11.966 1.00 1.75 H new ATOM 830 N LEU A 59 6.964 -1.238 -11.211 1.00 0.50 N ATOM 831 CA LEU A 59 6.287 -1.410 -9.891 1.00 0.47 C ATOM 832 C LEU A 59 4.865 -0.832 -9.978 1.00 0.43 C ATOM 833 O LEU A 59 3.985 -1.186 -9.216 1.00 0.42 O ATOM 834 CB LEU A 59 7.108 -0.681 -8.795 1.00 0.53 C ATOM 835 CG LEU A 59 7.640 -1.677 -7.752 1.00 0.71 C ATOM 836 CD1 LEU A 59 8.780 -2.501 -8.353 1.00 1.07 C ATOM 837 CD2 LEU A 59 8.165 -0.907 -6.537 1.00 1.34 C ATOM 0 H LEU A 59 7.790 -0.640 -11.204 1.00 0.50 H new ATOM 0 HA LEU A 59 6.224 -2.467 -9.634 1.00 0.47 H new ATOM 0 HB2 LEU A 59 7.942 -0.149 -9.253 1.00 0.53 H new ATOM 0 HB3 LEU A 59 6.484 0.066 -8.305 1.00 0.53 H new ATOM 0 HG LEU A 59 6.832 -2.343 -7.449 1.00 0.71 H new ATOM 0 HD11 LEU A 59 9.152 -3.205 -7.608 1.00 1.07 H new ATOM 0 HD12 LEU A 59 8.414 -3.050 -9.220 1.00 1.07 H new ATOM 0 HD13 LEU A 59 9.587 -1.836 -8.659 1.00 1.07 H new ATOM 0 HD21 LEU A 59 8.543 -1.611 -5.796 1.00 1.34 H new ATOM 0 HD22 LEU A 59 8.970 -0.241 -6.848 1.00 1.34 H new ATOM 0 HD23 LEU A 59 7.357 -0.320 -6.101 1.00 1.34 H new ATOM 849 N SER A 60 4.637 0.031 -10.929 1.00 0.43 N ATOM 850 CA SER A 60 3.279 0.619 -11.107 1.00 0.42 C ATOM 851 C SER A 60 2.369 -0.421 -11.769 1.00 0.39 C ATOM 852 O SER A 60 1.191 -0.501 -11.481 1.00 0.41 O ATOM 853 CB SER A 60 3.382 1.840 -12.023 1.00 0.47 C ATOM 854 OG SER A 60 3.633 1.410 -13.352 1.00 1.36 O ATOM 0 H SER A 60 5.338 0.356 -11.595 1.00 0.43 H new ATOM 0 HA SER A 60 2.871 0.911 -10.139 1.00 0.42 H new ATOM 0 HB2 SER A 60 2.458 2.417 -11.984 1.00 0.47 H new ATOM 0 HB3 SER A 60 4.183 2.497 -11.684 1.00 0.47 H new ATOM 0 HG SER A 60 4.353 0.745 -13.350 1.00 1.36 H new ATOM 860 N GLU A 61 2.905 -1.210 -12.664 1.00 0.38 N ATOM 861 CA GLU A 61 2.066 -2.236 -13.356 1.00 0.38 C ATOM 862 C GLU A 61 1.639 -3.315 -12.350 1.00 0.38 C ATOM 863 O GLU A 61 0.554 -3.856 -12.436 1.00 0.41 O ATOM 864 CB GLU A 61 2.860 -2.850 -14.511 1.00 0.39 C ATOM 865 CG GLU A 61 2.023 -3.917 -15.214 1.00 1.06 C ATOM 866 CD GLU A 61 2.771 -4.405 -16.456 1.00 1.67 C ATOM 867 OE1 GLU A 61 3.991 -4.423 -16.419 1.00 2.40 O ATOM 868 OE2 GLU A 61 2.113 -4.750 -17.423 1.00 2.25 O ATOM 0 H GLU A 61 3.885 -1.189 -12.946 1.00 0.38 H new ATOM 0 HA GLU A 61 1.169 -1.769 -13.762 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.144 -2.073 -15.221 1.00 0.39 H new ATOM 0 HB3 GLU A 61 3.783 -3.290 -14.134 1.00 0.39 H new ATOM 0 HG2 GLU A 61 1.833 -4.751 -14.538 1.00 1.06 H new ATOM 0 HG3 GLU A 61 1.053 -3.508 -15.496 1.00 1.06 H new ATOM 875 N CYS A 62 2.452 -3.593 -11.372 1.00 0.37 N ATOM 876 CA CYS A 62 2.060 -4.590 -10.332 1.00 0.39 C ATOM 877 C CYS A 62 0.813 -4.063 -9.612 1.00 0.38 C ATOM 878 O CYS A 62 -0.210 -4.718 -9.568 1.00 0.44 O ATOM 879 CB CYS A 62 3.204 -4.750 -9.328 1.00 0.41 C ATOM 880 SG CYS A 62 2.870 -6.167 -8.252 1.00 1.62 S ATOM 0 H CYS A 62 3.373 -3.174 -11.245 1.00 0.37 H new ATOM 0 HA CYS A 62 1.850 -5.557 -10.789 1.00 0.39 H new ATOM 0 HB2 CYS A 62 4.147 -4.895 -9.855 1.00 0.41 H new ATOM 0 HB3 CYS A 62 3.308 -3.844 -8.732 1.00 0.41 H new ATOM 0 HG CYS A 62 3.582 -6.066 -7.169 1.00 1.62 H new ATOM 886 N LEU A 63 0.871 -2.874 -9.093 1.00 0.35 N ATOM 887 CA LEU A 63 -0.322 -2.275 -8.426 1.00 0.36 C ATOM 888 C LEU A 63 -1.475 -2.149 -9.434 1.00 0.36 C ATOM 889 O LEU A 63 -2.621 -2.007 -9.056 1.00 0.41 O ATOM 890 CB LEU A 63 0.063 -0.889 -7.902 1.00 0.38 C ATOM 891 CG LEU A 63 1.312 -1.011 -7.016 1.00 0.69 C ATOM 892 CD1 LEU A 63 1.673 0.364 -6.451 1.00 1.39 C ATOM 893 CD2 LEU A 63 1.044 -1.987 -5.856 1.00 1.11 C ATOM 0 H LEU A 63 1.701 -2.281 -9.100 1.00 0.35 H new ATOM 0 HA LEU A 63 -0.648 -2.910 -7.602 1.00 0.36 H new ATOM 0 HB2 LEU A 63 0.258 -0.214 -8.735 1.00 0.38 H new ATOM 0 HB3 LEU A 63 -0.761 -0.461 -7.332 1.00 0.38 H new ATOM 0 HG LEU A 63 2.139 -1.390 -7.617 1.00 0.69 H new ATOM 0 HD11 LEU A 63 2.559 0.278 -5.822 1.00 1.39 H new ATOM 0 HD12 LEU A 63 1.876 1.053 -7.271 1.00 1.39 H new ATOM 0 HD13 LEU A 63 0.842 0.743 -5.856 1.00 1.39 H new ATOM 0 HD21 LEU A 63 1.936 -2.066 -5.234 1.00 1.11 H new ATOM 0 HD22 LEU A 63 0.213 -1.618 -5.254 1.00 1.11 H new ATOM 0 HD23 LEU A 63 0.793 -2.969 -6.257 1.00 1.11 H new ATOM 905 N LYS A 64 -1.192 -2.196 -10.710 1.00 0.35 N ATOM 906 CA LYS A 64 -2.289 -2.075 -11.720 1.00 0.37 C ATOM 907 C LYS A 64 -2.905 -3.455 -11.998 1.00 0.39 C ATOM 908 O LYS A 64 -4.109 -3.611 -12.041 1.00 0.43 O ATOM 909 CB LYS A 64 -1.727 -1.496 -13.019 1.00 0.38 C ATOM 910 CG LYS A 64 -2.882 -1.071 -13.925 1.00 0.82 C ATOM 911 CD LYS A 64 -2.328 -0.392 -15.177 1.00 1.35 C ATOM 912 CE LYS A 64 -3.489 0.125 -16.025 1.00 1.38 C ATOM 913 NZ LYS A 64 -2.956 0.833 -17.223 1.00 2.09 N ATOM 0 H LYS A 64 -0.255 -2.312 -11.096 1.00 0.35 H new ATOM 0 HA LYS A 64 -3.061 -1.413 -11.328 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -1.086 -0.641 -12.802 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -1.108 -2.238 -13.523 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -3.478 -1.940 -14.204 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -3.544 -0.389 -13.392 1.00 0.82 H new ATOM 0 HD2 LYS A 64 -1.671 0.432 -14.898 1.00 1.35 H new ATOM 0 HD3 LYS A 64 -1.728 -1.097 -15.752 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -4.125 -0.705 -16.333 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -4.110 0.801 -15.437 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -3.747 1.184 -17.799 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -2.367 1.634 -16.919 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 -2.382 0.175 -17.788 1.00 2.09 H new ATOM 927 N ARG A 65 -2.085 -4.452 -12.194 1.00 0.43 N ATOM 928 CA ARG A 65 -2.604 -5.827 -12.478 1.00 0.47 C ATOM 929 C ARG A 65 -3.379 -6.372 -11.271 1.00 0.50 C ATOM 930 O ARG A 65 -4.408 -7.002 -11.418 1.00 0.54 O ATOM 931 CB ARG A 65 -1.411 -6.753 -12.775 1.00 0.45 C ATOM 932 CG ARG A 65 -1.010 -6.633 -14.252 1.00 0.94 C ATOM 933 CD ARG A 65 0.154 -7.582 -14.556 1.00 1.55 C ATOM 934 NE ARG A 65 0.193 -7.858 -16.019 1.00 1.86 N ATOM 935 CZ ARG A 65 1.255 -8.394 -16.552 1.00 2.39 C ATOM 936 NH1 ARG A 65 2.283 -8.684 -15.803 1.00 2.94 N ATOM 937 NH2 ARG A 65 1.288 -8.641 -17.832 1.00 2.92 N ATOM 0 H ARG A 65 -1.068 -4.375 -12.170 1.00 0.43 H new ATOM 0 HA ARG A 65 -3.278 -5.785 -13.334 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -0.567 -6.489 -12.138 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -1.674 -7.785 -12.544 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -1.861 -6.872 -14.889 1.00 0.94 H new ATOM 0 HG3 ARG A 65 -0.722 -5.606 -14.477 1.00 0.94 H new ATOM 0 HD2 ARG A 65 1.095 -7.137 -14.233 1.00 1.55 H new ATOM 0 HD3 ARG A 65 0.034 -8.513 -14.001 1.00 1.55 H new ATOM 0 HE ARG A 65 -0.611 -7.628 -16.603 1.00 1.86 H new ATOM 0 HH11 ARG A 65 2.255 -8.491 -14.802 1.00 2.94 H new ATOM 0 HH12 ARG A 65 3.115 -9.103 -16.219 1.00 2.94 H new ATOM 0 HH21 ARG A 65 0.483 -8.415 -18.416 1.00 2.92 H new ATOM 0 HH22 ARG A 65 2.119 -9.060 -18.249 1.00 2.92 H new ATOM 951 N ILE A 66 -2.896 -6.140 -10.084 1.00 0.49 N ATOM 952 CA ILE A 66 -3.605 -6.650 -8.875 1.00 0.53 C ATOM 953 C ILE A 66 -4.883 -5.833 -8.660 1.00 0.54 C ATOM 954 O ILE A 66 -5.964 -6.375 -8.538 1.00 0.60 O ATOM 955 CB ILE A 66 -2.673 -6.515 -7.659 1.00 0.52 C ATOM 956 CG1 ILE A 66 -1.625 -7.637 -7.693 1.00 1.22 C ATOM 957 CG2 ILE A 66 -3.472 -6.611 -6.352 1.00 1.29 C ATOM 958 CD1 ILE A 66 -0.499 -7.336 -6.695 1.00 1.25 C ATOM 0 H ILE A 66 -2.040 -5.619 -9.897 1.00 0.49 H new ATOM 0 HA ILE A 66 -3.874 -7.698 -9.006 1.00 0.53 H new ATOM 0 HB ILE A 66 -2.183 -5.542 -7.702 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -2.093 -8.590 -7.448 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -1.215 -7.732 -8.698 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -2.795 -6.513 -5.504 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -4.213 -5.812 -6.319 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -3.977 -7.576 -6.304 1.00 1.29 H new ATOM 0 HD11 ILE A 66 0.239 -8.137 -6.727 1.00 1.25 H new ATOM 0 HD12 ILE A 66 -0.022 -6.392 -6.959 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -0.914 -7.264 -5.689 1.00 1.25 H new ATOM 970 N GLY A 67 -4.771 -4.538 -8.637 1.00 0.52 N ATOM 971 CA GLY A 67 -5.978 -3.681 -8.457 1.00 0.55 C ATOM 972 C GLY A 67 -7.080 -4.105 -9.427 1.00 0.53 C ATOM 973 O GLY A 67 -8.210 -4.333 -9.032 1.00 0.63 O ATOM 0 H GLY A 67 -3.892 -4.030 -8.735 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -6.338 -3.759 -7.431 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -5.718 -2.636 -8.625 1.00 0.55 H new ATOM 977 N ASP A 68 -6.777 -4.219 -10.690 1.00 0.54 N ATOM 978 CA ASP A 68 -7.820 -4.629 -11.671 1.00 0.54 C ATOM 979 C ASP A 68 -8.236 -6.079 -11.416 1.00 0.52 C ATOM 980 O ASP A 68 -9.323 -6.491 -11.769 1.00 0.56 O ATOM 981 CB ASP A 68 -7.250 -4.506 -13.087 1.00 0.60 C ATOM 982 CG ASP A 68 -8.386 -4.597 -14.108 1.00 1.43 C ATOM 983 OD1 ASP A 68 -9.351 -5.291 -13.831 1.00 2.20 O ATOM 984 OD2 ASP A 68 -8.271 -3.972 -15.149 1.00 2.12 O ATOM 0 H ASP A 68 -5.853 -4.046 -11.085 1.00 0.54 H new ATOM 0 HA ASP A 68 -8.692 -3.984 -11.563 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -6.724 -3.558 -13.197 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -6.522 -5.297 -13.267 1.00 0.60 H new ATOM 989 N GLU A 69 -7.378 -6.864 -10.813 1.00 0.56 N ATOM 990 CA GLU A 69 -7.726 -8.295 -10.546 1.00 0.56 C ATOM 991 C GLU A 69 -8.315 -8.428 -9.140 1.00 0.55 C ATOM 992 O GLU A 69 -8.930 -9.427 -8.825 1.00 0.73 O ATOM 993 CB GLU A 69 -6.463 -9.154 -10.659 1.00 0.61 C ATOM 994 CG GLU A 69 -6.835 -10.639 -10.582 1.00 0.84 C ATOM 995 CD GLU A 69 -5.647 -11.488 -11.043 1.00 1.65 C ATOM 996 OE1 GLU A 69 -4.740 -11.681 -10.251 1.00 2.23 O ATOM 997 OE2 GLU A 69 -5.666 -11.929 -12.180 1.00 2.48 O ATOM 0 H GLU A 69 -6.453 -6.577 -10.494 1.00 0.56 H new ATOM 0 HA GLU A 69 -8.462 -8.633 -11.276 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -5.954 -8.946 -11.600 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -5.768 -8.902 -9.858 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -7.110 -10.903 -9.561 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -7.704 -10.840 -11.208 1.00 0.84 H new ATOM 1004 N LEU A 70 -8.128 -7.463 -8.274 1.00 0.53 N ATOM 1005 CA LEU A 70 -8.687 -7.612 -6.893 1.00 0.52 C ATOM 1006 C LEU A 70 -10.182 -7.261 -6.914 1.00 0.54 C ATOM 1007 O LEU A 70 -10.950 -7.728 -6.098 1.00 0.60 O ATOM 1008 CB LEU A 70 -7.913 -6.705 -5.911 1.00 0.61 C ATOM 1009 CG LEU A 70 -7.565 -7.466 -4.624 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -6.664 -6.591 -3.751 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -8.848 -7.796 -3.856 1.00 1.61 C ATOM 0 H LEU A 70 -7.624 -6.595 -8.456 1.00 0.53 H new ATOM 0 HA LEU A 70 -8.576 -8.642 -6.555 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -6.999 -6.345 -6.384 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -8.513 -5.828 -5.669 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.049 -8.392 -4.878 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -6.414 -7.127 -2.835 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -5.749 -6.354 -4.295 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -7.186 -5.668 -3.500 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -8.597 -8.336 -2.943 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -9.367 -6.872 -3.600 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -9.495 -8.415 -4.477 1.00 1.61 H new ATOM 1023 N ASP A 71 -10.604 -6.476 -7.870 1.00 0.67 N ATOM 1024 CA ASP A 71 -12.054 -6.144 -7.967 1.00 0.91 C ATOM 1025 C ASP A 71 -12.788 -7.405 -8.422 1.00 1.02 C ATOM 1026 O ASP A 71 -13.998 -7.453 -8.527 1.00 1.29 O ATOM 1027 CB ASP A 71 -12.263 -5.031 -8.995 1.00 1.09 C ATOM 1028 CG ASP A 71 -11.522 -5.384 -10.285 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -11.415 -6.563 -10.580 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -11.075 -4.469 -10.957 1.00 2.25 O ATOM 0 H ASP A 71 -10.011 -6.053 -8.584 1.00 0.67 H new ATOM 0 HA ASP A 71 -12.433 -5.803 -7.003 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -13.326 -4.903 -9.197 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -11.897 -4.083 -8.600 1.00 1.09 H new ATOM 1035 N SER A 72 -12.024 -8.426 -8.694 1.00 0.90 N ATOM 1036 CA SER A 72 -12.574 -9.730 -9.155 1.00 1.20 C ATOM 1037 C SER A 72 -13.424 -10.394 -8.075 1.00 0.98 C ATOM 1038 O SER A 72 -14.257 -11.226 -8.377 1.00 1.02 O ATOM 1039 CB SER A 72 -11.397 -10.659 -9.456 1.00 1.57 C ATOM 1040 OG SER A 72 -10.571 -10.065 -10.449 1.00 2.09 O ATOM 0 H SER A 72 -11.007 -8.408 -8.613 1.00 0.90 H new ATOM 0 HA SER A 72 -13.196 -9.552 -10.032 1.00 1.20 H new ATOM 0 HB2 SER A 72 -10.821 -10.841 -8.549 1.00 1.57 H new ATOM 0 HB3 SER A 72 -11.762 -11.627 -9.801 1.00 1.57 H new ATOM 0 HG SER A 72 -9.635 -10.100 -10.160 1.00 2.09 H new ATOM 1046 N ASN A 73 -13.213 -10.071 -6.816 1.00 0.92 N ATOM 1047 CA ASN A 73 -14.011 -10.740 -5.734 1.00 0.83 C ATOM 1048 C ASN A 73 -15.143 -9.819 -5.274 1.00 0.75 C ATOM 1049 O ASN A 73 -14.904 -8.771 -4.706 1.00 1.07 O ATOM 1050 CB ASN A 73 -13.088 -11.043 -4.551 1.00 0.91 C ATOM 1051 CG ASN A 73 -11.943 -11.946 -5.015 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -11.120 -11.543 -5.813 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -11.854 -13.160 -4.545 1.00 1.90 N ATOM 0 H ASN A 73 -12.532 -9.383 -6.495 1.00 0.92 H new ATOM 0 HA ASN A 73 -14.441 -11.665 -6.118 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -12.690 -10.115 -4.140 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -13.649 -11.530 -3.754 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -11.094 -13.770 -4.847 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -12.544 -13.499 -3.875 1.00 1.90 H new ATOM 1060 N MET A 74 -16.369 -10.188 -5.516 1.00 0.71 N ATOM 1061 CA MET A 74 -17.500 -9.315 -5.091 1.00 0.67 C ATOM 1062 C MET A 74 -17.679 -9.406 -3.572 1.00 0.67 C ATOM 1063 O MET A 74 -18.413 -8.647 -2.972 1.00 0.71 O ATOM 1064 CB MET A 74 -18.777 -9.748 -5.815 1.00 0.75 C ATOM 1065 CG MET A 74 -18.603 -9.537 -7.327 1.00 1.20 C ATOM 1066 SD MET A 74 -19.739 -10.628 -8.223 1.00 1.92 S ATOM 1067 CE MET A 74 -18.579 -11.206 -9.491 1.00 1.96 C ATOM 0 H MET A 74 -16.637 -11.052 -5.987 1.00 0.71 H new ATOM 0 HA MET A 74 -17.285 -8.279 -5.351 1.00 0.67 H new ATOM 0 HB2 MET A 74 -18.990 -10.796 -5.605 1.00 0.75 H new ATOM 0 HB3 MET A 74 -19.628 -9.171 -5.452 1.00 0.75 H new ATOM 0 HG2 MET A 74 -18.801 -8.497 -7.585 1.00 1.20 H new ATOM 0 HG3 MET A 74 -17.574 -9.747 -7.618 1.00 1.20 H new ATOM 0 HE1 MET A 74 -19.087 -11.901 -10.159 1.00 1.96 H new ATOM 0 HE2 MET A 74 -18.212 -10.354 -10.064 1.00 1.96 H new ATOM 0 HE3 MET A 74 -17.739 -11.710 -9.013 1.00 1.96 H new ATOM 1077 N GLU A 75 -16.970 -10.305 -2.948 1.00 0.70 N ATOM 1078 CA GLU A 75 -17.034 -10.440 -1.466 1.00 0.75 C ATOM 1079 C GLU A 75 -16.340 -9.235 -0.828 1.00 0.73 C ATOM 1080 O GLU A 75 -16.970 -8.434 -0.166 1.00 0.78 O ATOM 1081 CB GLU A 75 -16.310 -11.721 -1.046 1.00 0.87 C ATOM 1082 CG GLU A 75 -16.598 -12.009 0.427 1.00 1.15 C ATOM 1083 CD GLU A 75 -15.881 -13.293 0.849 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -16.395 -14.359 0.553 1.00 2.29 O ATOM 1085 OE2 GLU A 75 -14.831 -13.188 1.461 1.00 2.21 O ATOM 0 H GLU A 75 -16.340 -10.961 -3.409 1.00 0.70 H new ATOM 0 HA GLU A 75 -18.073 -10.484 -1.141 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -16.640 -12.557 -1.662 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -15.237 -11.613 -1.204 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -16.263 -11.174 1.043 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -17.672 -12.111 0.585 1.00 1.15 H new ATOM 1092 N LEU A 76 -15.061 -9.083 -1.017 1.00 0.74 N ATOM 1093 CA LEU A 76 -14.372 -7.908 -0.414 1.00 0.80 C ATOM 1094 C LEU A 76 -15.131 -6.634 -0.806 1.00 0.75 C ATOM 1095 O LEU A 76 -15.557 -5.876 0.041 1.00 0.81 O ATOM 1096 CB LEU A 76 -12.914 -7.854 -0.898 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.150 -6.697 -0.225 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -11.777 -7.063 1.217 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -10.863 -6.422 -1.010 1.00 1.51 C ATOM 0 H LEU A 76 -14.467 -9.713 -1.556 1.00 0.74 H new ATOM 0 HA LEU A 76 -14.362 -7.994 0.673 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -12.418 -8.799 -0.676 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -12.891 -7.728 -1.980 1.00 0.92 H new ATOM 0 HG LEU A 76 -12.790 -5.815 -0.215 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -11.238 -6.234 1.675 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -12.684 -7.266 1.787 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -11.144 -7.950 1.215 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -10.317 -5.604 -0.539 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -10.242 -7.317 -1.015 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -11.113 -6.148 -2.035 1.00 1.51 H new ATOM 1111 N GLN A 77 -15.305 -6.390 -2.077 1.00 0.76 N ATOM 1112 CA GLN A 77 -16.042 -5.161 -2.500 1.00 0.74 C ATOM 1113 C GLN A 77 -17.339 -5.030 -1.689 1.00 0.71 C ATOM 1114 O GLN A 77 -17.724 -3.946 -1.294 1.00 0.72 O ATOM 1115 CB GLN A 77 -16.385 -5.239 -3.989 1.00 0.71 C ATOM 1116 CG GLN A 77 -17.083 -3.944 -4.411 1.00 1.26 C ATOM 1117 CD GLN A 77 -17.172 -3.879 -5.936 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -17.879 -4.654 -6.549 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -16.480 -2.978 -6.579 1.00 2.03 N ATOM 0 H GLN A 77 -14.972 -6.983 -2.837 1.00 0.76 H new ATOM 0 HA GLN A 77 -15.408 -4.293 -2.322 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -15.479 -5.386 -4.576 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -17.032 -6.095 -4.181 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -18.082 -3.900 -3.977 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -16.532 -3.083 -4.032 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -15.887 -2.327 -6.064 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -16.533 -2.925 -7.596 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.017 -6.119 -1.435 1.00 0.72 N ATOM 1129 CA ARG A 78 -19.283 -6.036 -0.650 1.00 0.73 C ATOM 1130 C ARG A 78 -18.961 -5.709 0.807 1.00 0.75 C ATOM 1131 O ARG A 78 -19.669 -4.964 1.455 1.00 0.79 O ATOM 1132 CB ARG A 78 -20.030 -7.377 -0.726 1.00 0.74 C ATOM 1133 CG ARG A 78 -21.303 -7.343 0.167 1.00 0.94 C ATOM 1134 CD ARG A 78 -21.031 -7.946 1.560 1.00 1.23 C ATOM 1135 NE ARG A 78 -22.316 -8.445 2.155 1.00 1.80 N ATOM 1136 CZ ARG A 78 -23.372 -7.677 2.249 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -23.288 -6.398 2.006 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -24.507 -8.184 2.650 1.00 3.41 N ATOM 0 H ARG A 78 -17.750 -7.057 -1.735 1.00 0.72 H new ATOM 0 HA ARG A 78 -19.914 -5.250 -1.066 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -20.309 -7.587 -1.759 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -19.373 -8.185 -0.403 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -21.646 -6.314 0.275 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -22.106 -7.897 -0.320 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -20.315 -8.764 1.479 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -20.585 -7.194 2.211 1.00 1.23 H new ATOM 0 HE ARG A 78 -22.367 -9.406 2.494 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -22.393 -5.987 1.740 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -24.117 -5.809 2.082 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -24.568 -9.174 2.888 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -25.333 -7.590 2.725 1.00 3.41 H new ATOM 1152 N MET A 79 -17.894 -6.251 1.330 1.00 0.75 N ATOM 1153 CA MET A 79 -17.532 -5.956 2.744 1.00 0.77 C ATOM 1154 C MET A 79 -17.118 -4.491 2.850 1.00 0.77 C ATOM 1155 O MET A 79 -17.587 -3.762 3.701 1.00 0.78 O ATOM 1156 CB MET A 79 -16.364 -6.848 3.172 1.00 0.81 C ATOM 1157 CG MET A 79 -16.829 -8.303 3.276 1.00 1.08 C ATOM 1158 SD MET A 79 -15.602 -9.259 4.201 1.00 1.07 S ATOM 1159 CE MET A 79 -16.231 -8.899 5.860 1.00 0.81 C ATOM 0 H MET A 79 -17.260 -6.883 0.840 1.00 0.75 H new ATOM 0 HA MET A 79 -18.386 -6.149 3.392 1.00 0.77 H new ATOM 0 HB2 MET A 79 -15.551 -6.768 2.451 1.00 0.81 H new ATOM 0 HB3 MET A 79 -15.972 -6.513 4.132 1.00 0.81 H new ATOM 0 HG2 MET A 79 -17.797 -8.353 3.775 1.00 1.08 H new ATOM 0 HG3 MET A 79 -16.961 -8.726 2.280 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.401 -8.874 6.566 1.00 0.81 H new ATOM 0 HE2 MET A 79 -16.733 -7.932 5.857 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.938 -9.674 6.157 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.250 -4.050 1.981 1.00 0.77 N ATOM 1170 CA ILE A 80 -15.819 -2.627 2.024 1.00 0.80 C ATOM 1171 C ILE A 80 -17.066 -1.736 2.035 1.00 0.80 C ATOM 1172 O ILE A 80 -17.053 -0.636 2.550 1.00 0.83 O ATOM 1173 CB ILE A 80 -14.956 -2.317 0.800 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -13.673 -3.151 0.873 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.594 -0.832 0.793 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -12.907 -3.037 -0.446 1.00 1.10 C ATOM 0 H ILE A 80 -15.823 -4.613 1.246 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.230 -2.438 2.922 1.00 0.80 H new ATOM 0 HB ILE A 80 -15.506 -2.559 -0.109 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.050 -2.805 1.698 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -13.917 -4.194 1.074 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -13.979 -0.612 -0.079 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.505 -0.235 0.755 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.039 -0.589 1.699 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -11.995 -3.632 -0.390 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -13.530 -3.404 -1.261 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -12.649 -1.994 -0.628 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.145 -2.204 1.468 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.396 -1.391 1.446 1.00 0.80 C ATOM 1190 C ALA A 81 -20.111 -1.498 2.799 1.00 0.81 C ATOM 1191 O ALA A 81 -20.951 -0.686 3.136 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.320 -1.923 0.353 1.00 0.79 C ATOM 0 H ALA A 81 -18.215 -3.117 1.018 1.00 0.78 H new ATOM 0 HA ALA A 81 -19.144 -0.349 1.250 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.236 -1.333 0.332 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -19.820 -1.851 -0.613 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -20.564 -2.965 0.559 1.00 0.79 H new ATOM 1198 N ALA A 82 -19.790 -2.501 3.571 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.449 -2.681 4.899 1.00 0.80 C ATOM 1200 C ALA A 82 -19.782 -1.790 5.949 1.00 0.79 C ATOM 1201 O ALA A 82 -20.343 -1.531 6.996 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.322 -4.144 5.329 1.00 0.87 C ATOM 0 H ALA A 82 -19.094 -3.209 3.338 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.500 -2.404 4.814 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -20.801 -4.281 6.298 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -20.806 -4.784 4.591 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.268 -4.411 5.405 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.599 -1.307 5.687 1.00 0.80 N ATOM 1209 CA VAL A 83 -17.922 -0.423 6.687 1.00 0.85 C ATOM 1210 C VAL A 83 -18.384 1.024 6.465 1.00 0.99 C ATOM 1211 O VAL A 83 -17.811 1.788 5.714 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.392 -0.564 6.569 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -15.984 -0.591 5.099 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -15.682 0.597 7.280 1.00 1.40 C ATOM 0 H VAL A 83 -18.072 -1.482 4.831 1.00 0.80 H new ATOM 0 HA VAL A 83 -18.195 -0.720 7.700 1.00 0.85 H new ATOM 0 HB VAL A 83 -16.096 -1.498 7.046 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -14.901 -0.691 5.024 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -16.462 -1.437 4.604 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -16.297 0.335 4.617 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -14.603 0.477 7.184 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -15.984 1.541 6.826 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -15.954 0.598 8.335 1.00 1.40 H new ATOM 1224 N ASP A 84 -19.430 1.383 7.167 1.00 1.46 N ATOM 1225 CA ASP A 84 -20.000 2.760 7.107 1.00 1.71 C ATOM 1226 C ASP A 84 -19.348 3.598 8.207 1.00 1.39 C ATOM 1227 O ASP A 84 -18.677 3.085 9.079 1.00 1.80 O ATOM 1228 CB ASP A 84 -21.508 2.684 7.360 1.00 2.38 C ATOM 1229 CG ASP A 84 -21.772 2.027 8.715 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -21.313 0.914 8.912 1.00 3.45 O ATOM 1231 OD2 ASP A 84 -22.432 2.647 9.533 1.00 3.57 O ATOM 0 H ASP A 84 -19.927 0.755 7.799 1.00 1.46 H new ATOM 0 HA ASP A 84 -19.814 3.208 6.131 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -21.940 3.684 7.340 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -21.991 2.112 6.568 1.00 2.38 H new ATOM 1236 N THR A 85 -19.549 4.892 8.171 1.00 1.68 N ATOM 1237 CA THR A 85 -18.951 5.787 9.209 1.00 1.97 C ATOM 1238 C THR A 85 -17.488 5.391 9.426 1.00 1.67 C ATOM 1239 O THR A 85 -16.708 5.314 8.500 1.00 2.28 O ATOM 1240 CB THR A 85 -19.742 5.663 10.510 1.00 3.20 C ATOM 1241 OG1 THR A 85 -19.636 4.336 11.005 1.00 3.80 O ATOM 1242 CG2 THR A 85 -21.211 5.995 10.240 1.00 3.87 C ATOM 0 H THR A 85 -20.106 5.370 7.462 1.00 1.68 H new ATOM 0 HA THR A 85 -18.993 6.825 8.878 1.00 1.97 H new ATOM 0 HB THR A 85 -19.342 6.356 11.250 1.00 3.20 H new ATOM 0 HG1 THR A 85 -18.904 3.873 10.547 1.00 3.80 H new ATOM 0 HG21 THR A 85 -21.780 5.908 11.166 1.00 3.87 H new ATOM 0 HG22 THR A 85 -21.290 7.014 9.860 1.00 3.87 H new ATOM 0 HG23 THR A 85 -21.611 5.300 9.502 1.00 3.87 H new ATOM 1250 N ASP A 86 -17.124 5.117 10.656 1.00 1.51 N ATOM 1251 CA ASP A 86 -15.725 4.702 10.950 1.00 1.98 C ATOM 1252 C ASP A 86 -14.744 5.739 10.399 1.00 1.78 C ATOM 1253 O ASP A 86 -14.517 5.819 9.208 1.00 2.48 O ATOM 1254 CB ASP A 86 -15.460 3.345 10.297 1.00 2.56 C ATOM 1255 CG ASP A 86 -16.561 2.360 10.700 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -17.591 2.810 11.173 1.00 3.57 O ATOM 1257 OD2 ASP A 86 -16.352 1.169 10.535 1.00 3.50 O ATOM 0 H ASP A 86 -17.740 5.164 11.467 1.00 1.51 H new ATOM 0 HA ASP A 86 -15.588 4.626 12.029 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -15.431 3.451 9.213 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -14.486 2.965 10.606 1.00 2.56 H new ATOM 1262 N SER A 87 -14.164 6.541 11.248 1.00 1.11 N ATOM 1263 CA SER A 87 -13.210 7.573 10.754 1.00 0.93 C ATOM 1264 C SER A 87 -12.117 6.893 9.900 1.00 0.84 C ATOM 1265 O SER A 87 -11.720 5.790 10.207 1.00 0.97 O ATOM 1266 CB SER A 87 -12.557 8.268 11.949 1.00 0.88 C ATOM 1267 OG SER A 87 -13.561 8.900 12.732 1.00 1.63 O ATOM 0 H SER A 87 -14.308 6.527 12.258 1.00 1.11 H new ATOM 0 HA SER A 87 -13.744 8.306 10.149 1.00 0.93 H new ATOM 0 HB2 SER A 87 -12.012 7.542 12.553 1.00 0.88 H new ATOM 0 HB3 SER A 87 -11.832 9.005 11.604 1.00 0.88 H new ATOM 0 HG SER A 87 -13.711 8.383 13.551 1.00 1.63 H new ATOM 1273 N PRO A 88 -11.635 7.548 8.860 1.00 0.77 N ATOM 1274 CA PRO A 88 -10.572 6.956 8.025 1.00 0.83 C ATOM 1275 C PRO A 88 -9.281 6.803 8.847 1.00 0.73 C ATOM 1276 O PRO A 88 -8.517 5.879 8.646 1.00 0.72 O ATOM 1277 CB PRO A 88 -10.367 7.963 6.868 1.00 1.01 C ATOM 1278 CG PRO A 88 -11.231 9.216 7.182 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.096 8.886 8.419 1.00 0.83 C ATOM 0 HA PRO A 88 -10.834 5.964 7.658 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -9.315 8.235 6.778 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -10.664 7.521 5.917 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.596 10.080 7.378 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -11.862 9.470 6.330 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -11.961 9.629 9.205 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.157 8.876 8.168 1.00 0.83 H new ATOM 1287 N ARG A 89 -9.014 7.717 9.745 1.00 0.75 N ATOM 1288 CA ARG A 89 -7.750 7.626 10.537 1.00 0.73 C ATOM 1289 C ARG A 89 -7.827 6.490 11.561 1.00 0.67 C ATOM 1290 O ARG A 89 -6.886 5.739 11.727 1.00 0.68 O ATOM 1291 CB ARG A 89 -7.487 8.944 11.269 1.00 0.79 C ATOM 1292 CG ARG A 89 -7.129 10.041 10.264 1.00 1.63 C ATOM 1293 CD ARG A 89 -7.028 11.389 10.990 1.00 1.65 C ATOM 1294 NE ARG A 89 -8.395 11.941 11.206 1.00 2.07 N ATOM 1295 CZ ARG A 89 -8.579 12.912 12.058 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -7.570 13.388 12.735 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -9.774 13.405 12.237 1.00 3.10 N ATOM 0 H ARG A 89 -9.610 8.515 9.963 1.00 0.75 H new ATOM 0 HA ARG A 89 -6.935 7.423 9.842 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -8.370 9.235 11.838 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -6.675 8.816 11.984 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -6.183 9.807 9.776 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -7.886 10.093 9.482 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -6.520 11.262 11.946 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.431 12.087 10.402 1.00 1.65 H new ATOM 0 HE ARG A 89 -9.187 11.560 10.688 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -6.636 13.001 12.598 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -7.715 14.147 13.401 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -10.564 13.031 11.711 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -9.918 14.164 12.903 1.00 3.10 H new ATOM 1311 N GLU A 90 -8.919 6.354 12.264 1.00 0.65 N ATOM 1312 CA GLU A 90 -8.992 5.261 13.273 1.00 0.65 C ATOM 1313 C GLU A 90 -8.955 3.909 12.550 1.00 0.64 C ATOM 1314 O GLU A 90 -8.541 2.916 13.103 1.00 0.67 O ATOM 1315 CB GLU A 90 -10.274 5.404 14.119 1.00 0.71 C ATOM 1316 CG GLU A 90 -11.486 4.809 13.394 1.00 1.32 C ATOM 1317 CD GLU A 90 -12.770 5.249 14.100 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -12.829 6.392 14.522 1.00 2.78 O ATOM 1319 OE2 GLU A 90 -13.674 4.436 14.205 1.00 2.46 O ATOM 0 H GLU A 90 -9.749 6.941 12.186 1.00 0.65 H new ATOM 0 HA GLU A 90 -8.139 5.323 13.949 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -10.138 4.903 15.077 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.456 6.457 14.333 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -11.499 5.138 12.355 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -11.419 3.721 13.383 1.00 1.32 H new ATOM 1326 N VAL A 91 -9.401 3.860 11.322 1.00 0.64 N ATOM 1327 CA VAL A 91 -9.408 2.565 10.571 1.00 0.67 C ATOM 1328 C VAL A 91 -8.054 2.345 9.893 1.00 0.66 C ATOM 1329 O VAL A 91 -7.470 1.283 9.984 1.00 0.67 O ATOM 1330 CB VAL A 91 -10.507 2.616 9.499 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -10.405 1.410 8.559 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -11.877 2.604 10.168 1.00 0.75 C ATOM 0 H VAL A 91 -9.762 4.661 10.804 1.00 0.64 H new ATOM 0 HA VAL A 91 -9.597 1.746 11.265 1.00 0.67 H new ATOM 0 HB VAL A 91 -10.378 3.531 8.921 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -11.193 1.467 7.808 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -9.433 1.414 8.066 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -10.517 0.490 9.133 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -12.655 2.640 9.405 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -11.987 1.692 10.755 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -11.970 3.471 10.822 1.00 0.75 H new ATOM 1342 N PHE A 92 -7.562 3.325 9.194 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.264 3.151 8.490 1.00 0.65 C ATOM 1344 C PHE A 92 -5.170 2.737 9.478 1.00 0.62 C ATOM 1345 O PHE A 92 -4.285 1.975 9.142 1.00 0.67 O ATOM 1346 CB PHE A 92 -5.871 4.465 7.812 1.00 0.65 C ATOM 1347 CG PHE A 92 -4.518 4.309 7.152 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -4.380 3.481 6.030 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.401 4.989 7.658 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.130 3.333 5.416 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.152 4.841 7.044 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.016 4.013 5.923 1.00 0.73 C ATOM 0 H PHE A 92 -8.001 4.238 9.079 1.00 0.64 H new ATOM 0 HA PHE A 92 -6.373 2.368 7.740 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -6.620 4.741 7.070 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -5.838 5.270 8.546 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.239 2.956 5.638 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -3.505 5.628 8.523 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -3.025 2.694 4.551 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.293 5.366 7.435 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.052 3.899 5.450 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.201 3.240 10.690 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.130 2.876 11.674 1.00 0.57 C ATOM 1364 C PHE A 93 -4.536 1.619 12.454 1.00 0.59 C ATOM 1365 O PHE A 93 -3.706 0.793 12.777 1.00 0.60 O ATOM 1366 CB PHE A 93 -3.901 4.048 12.631 1.00 0.57 C ATOM 1367 CG PHE A 93 -2.870 3.677 13.668 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -3.263 3.035 14.849 1.00 1.47 C ATOM 1369 CD2 PHE A 93 -1.522 3.985 13.454 1.00 1.15 C ATOM 1370 CE1 PHE A 93 -2.307 2.700 15.815 1.00 1.58 C ATOM 1371 CE2 PHE A 93 -0.565 3.649 14.419 1.00 1.07 C ATOM 1372 CZ PHE A 93 -0.958 3.007 15.600 1.00 0.70 C ATOM 0 H PHE A 93 -5.914 3.881 11.038 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.203 2.665 11.140 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -3.568 4.923 12.073 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -4.838 4.318 13.119 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -4.304 2.798 15.014 1.00 1.47 H new ATOM 0 HD2 PHE A 93 -1.220 4.482 12.544 1.00 1.15 H new ATOM 0 HE1 PHE A 93 -2.610 2.205 16.726 1.00 1.58 H new ATOM 0 HE2 PHE A 93 0.476 3.885 14.253 1.00 1.07 H new ATOM 0 HZ PHE A 93 -0.220 2.749 16.345 1.00 0.70 H new ATOM 1382 N ARG A 94 -5.796 1.452 12.752 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.217 0.228 13.498 1.00 0.67 C ATOM 1384 C ARG A 94 -6.056 -0.989 12.587 1.00 0.66 C ATOM 1385 O ARG A 94 -5.472 -1.981 12.974 1.00 0.67 O ATOM 1386 CB ARG A 94 -7.676 0.352 13.948 1.00 0.72 C ATOM 1387 CG ARG A 94 -8.069 -0.848 14.824 1.00 0.89 C ATOM 1388 CD ARG A 94 -7.224 -0.891 16.114 1.00 1.00 C ATOM 1389 NE ARG A 94 -6.866 0.491 16.549 1.00 1.95 N ATOM 1390 CZ ARG A 94 -6.443 0.707 17.764 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -6.318 -0.286 18.601 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -6.141 1.920 18.140 1.00 3.65 N ATOM 0 H ARG A 94 -6.546 2.101 12.515 1.00 0.62 H new ATOM 0 HA ARG A 94 -5.592 0.113 14.384 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -7.814 1.278 14.506 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -8.329 0.404 13.077 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -9.127 -0.785 15.080 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -7.931 -1.773 14.264 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -7.781 -1.395 16.904 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -6.317 -1.471 15.943 1.00 1.00 H new ATOM 0 HE ARG A 94 -6.952 1.269 15.895 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -6.551 -1.234 18.306 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -5.987 -0.114 19.550 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -6.236 2.696 17.484 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -5.810 2.092 19.089 1.00 3.65 H new ATOM 1406 N VAL A 95 -6.544 -0.936 11.380 1.00 0.65 N ATOM 1407 CA VAL A 95 -6.381 -2.102 10.469 1.00 0.66 C ATOM 1408 C VAL A 95 -4.895 -2.333 10.206 1.00 0.66 C ATOM 1409 O VAL A 95 -4.419 -3.451 10.193 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.077 -1.795 9.142 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -6.849 -2.948 8.161 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -8.575 -1.629 9.389 1.00 1.08 C ATOM 0 H VAL A 95 -7.046 -0.140 10.986 1.00 0.65 H new ATOM 0 HA VAL A 95 -6.817 -2.990 10.926 1.00 0.66 H new ATOM 0 HB VAL A 95 -6.668 -0.877 8.720 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -7.346 -2.726 7.217 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -5.780 -3.072 7.988 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -7.258 -3.868 8.579 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.077 -1.410 8.447 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -8.979 -2.550 9.810 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -8.740 -0.808 10.087 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.162 -1.278 9.976 1.00 0.65 N ATOM 1423 CA ALA A 96 -2.711 -1.428 9.691 1.00 0.68 C ATOM 1424 C ALA A 96 -2.019 -2.105 10.869 1.00 0.70 C ATOM 1425 O ALA A 96 -1.314 -3.085 10.733 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.111 -0.036 9.475 1.00 0.69 C ATOM 0 H ALA A 96 -4.508 -0.318 9.974 1.00 0.65 H new ATOM 0 HA ALA A 96 -2.570 -2.040 8.800 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.045 -0.128 9.264 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -2.607 0.447 8.633 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.253 0.565 10.373 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.232 -1.550 12.036 1.00 0.74 N ATOM 1433 CA ALA A 97 -1.621 -2.084 13.285 1.00 0.78 C ATOM 1434 C ALA A 97 -2.070 -3.523 13.533 1.00 0.79 C ATOM 1435 O ALA A 97 -1.280 -4.364 13.905 1.00 0.83 O ATOM 1436 CB ALA A 97 -2.070 -1.216 14.463 1.00 0.77 C ATOM 0 H ALA A 97 -2.820 -0.728 12.175 1.00 0.74 H new ATOM 0 HA ALA A 97 -0.536 -2.066 13.183 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -1.629 -1.597 15.384 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -1.744 -0.188 14.303 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -3.157 -1.244 14.542 1.00 0.77 H new ATOM 1442 N ASP A 98 -3.324 -3.823 13.331 1.00 0.78 N ATOM 1443 CA ASP A 98 -3.791 -5.218 13.567 1.00 0.82 C ATOM 1444 C ASP A 98 -3.112 -6.142 12.559 1.00 0.83 C ATOM 1445 O ASP A 98 -2.657 -7.221 12.883 1.00 0.88 O ATOM 1446 CB ASP A 98 -5.308 -5.289 13.385 1.00 0.82 C ATOM 1447 CG ASP A 98 -5.787 -6.716 13.661 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -6.059 -7.017 14.812 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -5.872 -7.484 12.717 1.00 2.19 O ATOM 0 H ASP A 98 -4.040 -3.169 13.015 1.00 0.78 H new ATOM 0 HA ASP A 98 -3.538 -5.526 14.582 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -5.800 -4.591 14.063 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -5.578 -4.993 12.371 1.00 0.82 H new ATOM 1454 N MET A 99 -3.062 -5.715 11.329 1.00 0.81 N ATOM 1455 CA MET A 99 -2.439 -6.535 10.255 1.00 0.85 C ATOM 1456 C MET A 99 -0.953 -6.758 10.534 1.00 0.97 C ATOM 1457 O MET A 99 -0.408 -7.795 10.214 1.00 1.14 O ATOM 1458 CB MET A 99 -2.580 -5.789 8.922 1.00 0.79 C ATOM 1459 CG MET A 99 -2.114 -6.684 7.746 1.00 0.81 C ATOM 1460 SD MET A 99 -3.503 -7.008 6.627 1.00 0.97 S ATOM 1461 CE MET A 99 -3.537 -5.379 5.840 1.00 0.48 C ATOM 0 H MET A 99 -3.433 -4.817 11.018 1.00 0.81 H new ATOM 0 HA MET A 99 -2.940 -7.502 10.217 1.00 0.85 H new ATOM 0 HB2 MET A 99 -3.618 -5.493 8.772 1.00 0.79 H new ATOM 0 HB3 MET A 99 -1.988 -4.874 8.947 1.00 0.79 H new ATOM 0 HG2 MET A 99 -1.305 -6.194 7.203 1.00 0.81 H new ATOM 0 HG3 MET A 99 -1.717 -7.624 8.129 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.311 -5.362 5.073 1.00 0.48 H new ATOM 0 HE2 MET A 99 -3.751 -4.617 6.590 1.00 0.48 H new ATOM 0 HE3 MET A 99 -2.569 -5.176 5.383 1.00 0.48 H new ATOM 1471 N PHE A 100 -0.286 -5.784 11.101 1.00 0.98 N ATOM 1472 CA PHE A 100 1.180 -5.924 11.372 1.00 1.14 C ATOM 1473 C PHE A 100 1.462 -5.959 12.871 1.00 1.28 C ATOM 1474 O PHE A 100 2.597 -5.850 13.287 1.00 1.67 O ATOM 1475 CB PHE A 100 1.924 -4.743 10.739 1.00 1.19 C ATOM 1476 CG PHE A 100 1.982 -4.934 9.241 1.00 1.15 C ATOM 1477 CD1 PHE A 100 2.706 -6.006 8.711 1.00 1.67 C ATOM 1478 CD2 PHE A 100 1.314 -4.049 8.385 1.00 1.64 C ATOM 1479 CE1 PHE A 100 2.767 -6.198 7.328 1.00 1.79 C ATOM 1480 CE2 PHE A 100 1.374 -4.240 6.999 1.00 1.69 C ATOM 1481 CZ PHE A 100 2.101 -5.314 6.470 1.00 1.38 C ATOM 0 H PHE A 100 -0.694 -4.895 11.389 1.00 0.98 H new ATOM 0 HA PHE A 100 1.525 -6.863 10.938 1.00 1.14 H new ATOM 0 HB2 PHE A 100 1.417 -3.808 10.979 1.00 1.19 H new ATOM 0 HB3 PHE A 100 2.932 -4.672 11.147 1.00 1.19 H new ATOM 0 HD1 PHE A 100 3.220 -6.688 9.372 1.00 1.67 H new ATOM 0 HD2 PHE A 100 0.754 -3.221 8.793 1.00 1.64 H new ATOM 0 HE1 PHE A 100 3.327 -7.027 6.921 1.00 1.79 H new ATOM 0 HE2 PHE A 100 0.859 -3.559 6.338 1.00 1.69 H new ATOM 0 HZ PHE A 100 2.148 -5.460 5.401 1.00 1.38 H new ATOM 1491 N SER A 101 0.462 -6.097 13.695 1.00 1.34 N ATOM 1492 CA SER A 101 0.742 -6.121 15.156 1.00 1.52 C ATOM 1493 C SER A 101 1.783 -7.208 15.449 1.00 1.61 C ATOM 1494 O SER A 101 1.437 -8.330 15.739 1.00 1.99 O ATOM 1495 CB SER A 101 -0.537 -6.411 15.948 1.00 1.79 C ATOM 1496 OG SER A 101 -0.206 -6.602 17.316 1.00 2.21 O ATOM 0 H SER A 101 -0.518 -6.192 13.428 1.00 1.34 H new ATOM 0 HA SER A 101 1.123 -5.146 15.459 1.00 1.52 H new ATOM 0 HB2 SER A 101 -1.239 -5.584 15.843 1.00 1.79 H new ATOM 0 HB3 SER A 101 -1.030 -7.299 15.553 1.00 1.79 H new ATOM 0 HG SER A 101 -1.022 -6.786 17.827 1.00 2.21 H new ATOM 1502 N ASP A 102 3.047 -6.843 15.421 1.00 1.99 N ATOM 1503 CA ASP A 102 4.174 -7.788 15.741 1.00 2.34 C ATOM 1504 C ASP A 102 5.455 -7.229 15.098 1.00 2.07 C ATOM 1505 O ASP A 102 5.422 -6.232 14.405 1.00 2.62 O ATOM 1506 CB ASP A 102 3.912 -9.218 15.226 1.00 3.15 C ATOM 1507 CG ASP A 102 5.164 -10.076 15.430 1.00 3.78 C ATOM 1508 OD1 ASP A 102 5.397 -10.486 16.555 1.00 4.10 O ATOM 1509 OD2 ASP A 102 5.866 -10.308 14.460 1.00 4.42 O ATOM 0 H ASP A 102 3.354 -5.900 15.182 1.00 1.99 H new ATOM 0 HA ASP A 102 4.271 -7.860 16.824 1.00 2.34 H new ATOM 0 HB2 ASP A 102 3.068 -9.657 15.757 1.00 3.15 H new ATOM 0 HB3 ASP A 102 3.645 -9.192 14.169 1.00 3.15 H new ATOM 1514 N GLY A 103 6.583 -7.845 15.334 1.00 2.05 N ATOM 1515 CA GLY A 103 7.861 -7.328 14.752 1.00 2.45 C ATOM 1516 C GLY A 103 7.914 -7.561 13.234 1.00 2.44 C ATOM 1517 O GLY A 103 6.984 -7.259 12.513 1.00 3.08 O ATOM 0 H GLY A 103 6.677 -8.685 15.905 1.00 2.05 H new ATOM 0 HA2 GLY A 103 7.955 -6.263 14.963 1.00 2.45 H new ATOM 0 HA3 GLY A 103 8.707 -7.823 15.228 1.00 2.45 H new ATOM 1521 N ASN A 104 9.018 -8.077 12.748 1.00 2.29 N ATOM 1522 CA ASN A 104 9.175 -8.319 11.277 1.00 2.55 C ATOM 1523 C ASN A 104 7.964 -9.065 10.724 1.00 2.17 C ATOM 1524 O ASN A 104 7.416 -9.937 11.370 1.00 2.54 O ATOM 1525 CB ASN A 104 10.424 -9.168 11.037 1.00 3.20 C ATOM 1526 CG ASN A 104 11.673 -8.358 11.383 1.00 3.72 C ATOM 1527 OD1 ASN A 104 12.366 -7.886 10.504 1.00 4.05 O ATOM 1528 ND2 ASN A 104 11.993 -8.179 12.635 1.00 4.31 N ATOM 0 H ASN A 104 9.825 -8.343 13.313 1.00 2.29 H new ATOM 0 HA ASN A 104 9.264 -7.357 10.773 1.00 2.55 H new ATOM 0 HB2 ASN A 104 10.384 -10.071 11.646 1.00 3.20 H new ATOM 0 HB3 ASN A 104 10.463 -9.488 9.996 1.00 3.20 H new ATOM 0 HD21 ASN A 104 12.826 -7.642 12.877 1.00 4.31 H new ATOM 0 HD22 ASN A 104 11.410 -8.576 13.372 1.00 4.31 H new ATOM 1535 N PHE A 105 7.520 -8.719 9.538 1.00 1.90 N ATOM 1536 CA PHE A 105 6.323 -9.387 8.936 1.00 1.74 C ATOM 1537 C PHE A 105 6.612 -9.713 7.461 1.00 1.59 C ATOM 1538 O PHE A 105 7.672 -9.416 6.947 1.00 1.88 O ATOM 1539 CB PHE A 105 5.154 -8.402 9.008 1.00 2.03 C ATOM 1540 CG PHE A 105 5.674 -7.009 8.709 1.00 1.75 C ATOM 1541 CD1 PHE A 105 5.985 -6.643 7.393 1.00 2.28 C ATOM 1542 CD2 PHE A 105 5.851 -6.089 9.751 1.00 2.14 C ATOM 1543 CE1 PHE A 105 6.470 -5.358 7.120 1.00 2.84 C ATOM 1544 CE2 PHE A 105 6.336 -4.804 9.476 1.00 2.60 C ATOM 1545 CZ PHE A 105 6.646 -4.439 8.161 1.00 2.84 C ATOM 0 H PHE A 105 7.941 -7.995 8.956 1.00 1.90 H new ATOM 0 HA PHE A 105 6.089 -10.307 9.471 1.00 1.74 H new ATOM 0 HB2 PHE A 105 4.381 -8.679 8.291 1.00 2.03 H new ATOM 0 HB3 PHE A 105 4.696 -8.430 9.997 1.00 2.03 H new ATOM 0 HD1 PHE A 105 5.851 -7.352 6.589 1.00 2.28 H new ATOM 0 HD2 PHE A 105 5.613 -6.371 10.766 1.00 2.14 H new ATOM 0 HE1 PHE A 105 6.708 -5.076 6.105 1.00 2.84 H new ATOM 0 HE2 PHE A 105 6.471 -4.095 10.279 1.00 2.60 H new ATOM 0 HZ PHE A 105 7.021 -3.449 7.949 1.00 2.84 H new ATOM 1555 N ASN A 106 5.672 -10.312 6.776 1.00 1.85 N ATOM 1556 CA ASN A 106 5.875 -10.650 5.334 1.00 1.93 C ATOM 1557 C ASN A 106 5.745 -9.385 4.476 1.00 1.72 C ATOM 1558 O ASN A 106 4.794 -8.638 4.591 1.00 2.31 O ATOM 1559 CB ASN A 106 4.802 -11.655 4.906 1.00 2.62 C ATOM 1560 CG ASN A 106 4.891 -12.901 5.788 1.00 3.11 C ATOM 1561 OD1 ASN A 106 5.956 -13.459 5.966 1.00 3.46 O ATOM 1562 ND2 ASN A 106 3.811 -13.364 6.355 1.00 3.79 N ATOM 0 H ASN A 106 4.765 -10.584 7.156 1.00 1.85 H new ATOM 0 HA ASN A 106 6.869 -11.076 5.198 1.00 1.93 H new ATOM 0 HB2 ASN A 106 3.813 -11.206 4.991 1.00 2.62 H new ATOM 0 HB3 ASN A 106 4.939 -11.927 3.859 1.00 2.62 H new ATOM 0 HD21 ASN A 106 3.861 -14.193 6.947 1.00 3.79 H new ATOM 0 HD22 ASN A 106 2.917 -12.897 6.206 1.00 3.79 H new ATOM 1569 N TRP A 107 6.705 -9.139 3.623 1.00 1.54 N ATOM 1570 CA TRP A 107 6.657 -7.921 2.760 1.00 1.68 C ATOM 1571 C TRP A 107 5.443 -7.970 1.824 1.00 1.47 C ATOM 1572 O TRP A 107 5.133 -7.015 1.141 1.00 1.49 O ATOM 1573 CB TRP A 107 7.937 -7.845 1.921 1.00 2.30 C ATOM 1574 CG TRP A 107 9.106 -8.245 2.760 1.00 2.32 C ATOM 1575 CD1 TRP A 107 9.896 -9.319 2.530 1.00 2.69 C ATOM 1576 CD2 TRP A 107 9.631 -7.598 3.954 1.00 2.77 C ATOM 1577 NE1 TRP A 107 10.873 -9.372 3.507 1.00 3.12 N ATOM 1578 CE2 TRP A 107 10.751 -8.333 4.408 1.00 3.35 C ATOM 1579 CE3 TRP A 107 9.247 -6.457 4.680 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 11.467 -7.948 5.542 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 9.964 -6.067 5.823 1.00 4.29 C ATOM 1582 CH2 TRP A 107 11.072 -6.811 6.253 1.00 4.80 C ATOM 0 H TRP A 107 7.524 -9.732 3.486 1.00 1.54 H new ATOM 0 HA TRP A 107 6.573 -7.042 3.399 1.00 1.68 H new ATOM 0 HB2 TRP A 107 7.856 -8.501 1.054 1.00 2.30 H new ATOM 0 HB3 TRP A 107 8.077 -6.833 1.542 1.00 2.30 H new ATOM 0 HD1 TRP A 107 9.782 -10.020 1.716 1.00 2.69 H new ATOM 0 HE1 TRP A 107 11.595 -10.091 3.556 1.00 3.12 H new ATOM 0 HE3 TRP A 107 8.395 -5.877 4.357 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 12.320 -8.524 5.868 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 9.660 -5.189 6.374 1.00 4.29 H new ATOM 0 HH2 TRP A 107 11.620 -6.506 7.132 1.00 4.80 H new ATOM 1593 N GLY A 108 4.769 -9.087 1.775 1.00 1.41 N ATOM 1594 CA GLY A 108 3.592 -9.213 0.869 1.00 1.47 C ATOM 1595 C GLY A 108 2.342 -8.643 1.538 1.00 1.05 C ATOM 1596 O GLY A 108 1.459 -8.104 0.882 1.00 1.02 O ATOM 0 H GLY A 108 4.983 -9.919 2.324 1.00 1.41 H new ATOM 0 HA2 GLY A 108 3.785 -8.685 -0.065 1.00 1.47 H new ATOM 0 HA3 GLY A 108 3.431 -10.261 0.615 1.00 1.47 H new ATOM 1600 N ARG A 109 2.229 -8.762 2.832 1.00 0.86 N ATOM 1601 CA ARG A 109 1.003 -8.234 3.475 1.00 0.87 C ATOM 1602 C ARG A 109 0.931 -6.739 3.178 1.00 0.70 C ATOM 1603 O ARG A 109 -0.124 -6.140 3.138 1.00 0.81 O ATOM 1604 CB ARG A 109 1.050 -8.480 4.987 1.00 1.08 C ATOM 1605 CG ARG A 109 0.741 -9.952 5.278 1.00 1.48 C ATOM 1606 CD ARG A 109 0.875 -10.220 6.777 1.00 1.96 C ATOM 1607 NE ARG A 109 0.380 -11.593 7.078 1.00 2.74 N ATOM 1608 CZ ARG A 109 0.663 -12.153 8.221 1.00 3.19 C ATOM 1609 NH1 ARG A 109 1.376 -11.510 9.104 1.00 3.19 N ATOM 1610 NH2 ARG A 109 0.233 -13.358 8.482 1.00 4.08 N ATOM 0 H ARG A 109 2.914 -9.190 3.454 1.00 0.86 H new ATOM 0 HA ARG A 109 0.119 -8.739 3.085 1.00 0.87 H new ATOM 0 HB2 ARG A 109 2.034 -8.220 5.377 1.00 1.08 H new ATOM 0 HB3 ARG A 109 0.327 -7.839 5.493 1.00 1.08 H new ATOM 0 HG2 ARG A 109 -0.268 -10.195 4.944 1.00 1.48 H new ATOM 0 HG3 ARG A 109 1.424 -10.594 4.722 1.00 1.48 H new ATOM 0 HD2 ARG A 109 1.916 -10.121 7.084 1.00 1.96 H new ATOM 0 HD3 ARG A 109 0.304 -9.483 7.342 1.00 1.96 H new ATOM 0 HE ARG A 109 -0.181 -12.095 6.389 1.00 2.74 H new ATOM 0 HH11 ARG A 109 1.712 -10.569 8.900 1.00 3.19 H new ATOM 0 HH12 ARG A 109 1.597 -11.948 9.998 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -0.324 -13.861 7.792 1.00 4.08 H new ATOM 0 HH22 ARG A 109 0.454 -13.796 9.376 1.00 4.08 H new ATOM 1624 N VAL A 110 2.081 -6.138 2.981 1.00 0.60 N ATOM 1625 CA VAL A 110 2.142 -4.678 2.696 1.00 0.68 C ATOM 1626 C VAL A 110 1.393 -4.390 1.398 1.00 0.56 C ATOM 1627 O VAL A 110 0.707 -3.395 1.279 1.00 0.60 O ATOM 1628 CB VAL A 110 3.605 -4.243 2.561 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.683 -2.730 2.353 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.376 -4.626 3.827 1.00 1.73 C ATOM 0 H VAL A 110 2.987 -6.606 3.007 1.00 0.60 H new ATOM 0 HA VAL A 110 1.680 -4.123 3.512 1.00 0.68 H new ATOM 0 HB VAL A 110 4.047 -4.746 1.701 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.726 -2.429 2.258 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.143 -2.459 1.446 1.00 1.27 H new ATOM 0 HG13 VAL A 110 3.235 -2.222 3.207 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.416 -4.315 3.728 1.00 1.73 H new ATOM 0 HG22 VAL A 110 3.930 -4.130 4.689 1.00 1.73 H new ATOM 0 HG23 VAL A 110 4.332 -5.706 3.967 1.00 1.73 H new ATOM 1640 N VAL A 111 1.497 -5.256 0.427 1.00 0.51 N ATOM 1641 CA VAL A 111 0.757 -5.008 -0.838 1.00 0.50 C ATOM 1642 C VAL A 111 -0.721 -4.853 -0.481 1.00 0.46 C ATOM 1643 O VAL A 111 -1.416 -4.003 -0.998 1.00 0.47 O ATOM 1644 CB VAL A 111 0.953 -6.176 -1.803 1.00 0.58 C ATOM 1645 CG1 VAL A 111 0.247 -5.865 -3.123 1.00 1.41 C ATOM 1646 CG2 VAL A 111 2.449 -6.376 -2.059 1.00 1.36 C ATOM 0 H VAL A 111 2.053 -6.110 0.455 1.00 0.51 H new ATOM 0 HA VAL A 111 1.127 -4.108 -1.329 1.00 0.50 H new ATOM 0 HB VAL A 111 0.533 -7.084 -1.370 1.00 0.58 H new ATOM 0 HG11 VAL A 111 0.385 -6.697 -3.814 1.00 1.41 H new ATOM 0 HG12 VAL A 111 -0.817 -5.718 -2.940 1.00 1.41 H new ATOM 0 HG13 VAL A 111 0.670 -4.959 -3.557 1.00 1.41 H new ATOM 0 HG21 VAL A 111 2.592 -7.209 -2.747 1.00 1.36 H new ATOM 0 HG22 VAL A 111 2.868 -5.469 -2.495 1.00 1.36 H new ATOM 0 HG23 VAL A 111 2.953 -6.593 -1.117 1.00 1.36 H new ATOM 1656 N ALA A 112 -1.195 -5.657 0.432 1.00 0.45 N ATOM 1657 CA ALA A 112 -2.622 -5.536 0.863 1.00 0.47 C ATOM 1658 C ALA A 112 -2.846 -4.138 1.467 1.00 0.46 C ATOM 1659 O ALA A 112 -3.800 -3.464 1.135 1.00 0.54 O ATOM 1660 CB ALA A 112 -2.943 -6.618 1.895 1.00 0.53 C ATOM 0 H ALA A 112 -0.660 -6.390 0.898 1.00 0.45 H new ATOM 0 HA ALA A 112 -3.281 -5.668 0.005 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -3.984 -6.526 2.207 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -2.782 -7.601 1.453 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.293 -6.498 2.762 1.00 0.53 H new ATOM 1666 N LEU A 113 -1.967 -3.678 2.309 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.120 -2.303 2.880 1.00 0.43 C ATOM 1668 C LEU A 113 -2.277 -1.288 1.742 1.00 0.42 C ATOM 1669 O LEU A 113 -3.210 -0.510 1.702 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.843 -1.947 3.657 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.004 -0.577 4.353 1.00 0.51 C ATOM 1672 CD1 LEU A 113 -2.171 -0.603 5.363 1.00 1.45 C ATOM 1673 CD2 LEU A 113 0.297 -0.237 5.088 1.00 1.27 C ATOM 0 H LEU A 113 -1.146 -4.191 2.630 1.00 0.43 H new ATOM 0 HA LEU A 113 -2.994 -2.277 3.530 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.634 -2.717 4.399 1.00 0.44 H new ATOM 0 HB3 LEU A 113 0.009 -1.920 2.977 1.00 0.44 H new ATOM 0 HG LEU A 113 -1.222 0.177 3.597 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -2.262 0.373 5.839 1.00 1.45 H new ATOM 0 HD12 LEU A 113 -3.098 -0.841 4.842 1.00 1.45 H new ATOM 0 HD13 LEU A 113 -1.978 -1.360 6.123 1.00 1.45 H new ATOM 0 HD21 LEU A 113 0.194 0.729 5.583 1.00 1.27 H new ATOM 0 HD22 LEU A 113 0.506 -1.006 5.832 1.00 1.27 H new ATOM 0 HD23 LEU A 113 1.118 -0.192 4.372 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.356 -1.301 0.824 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.385 -0.363 -0.337 1.00 0.40 C ATOM 1687 C PHE A 114 -2.783 -0.311 -0.969 1.00 0.39 C ATOM 1688 O PHE A 114 -3.225 0.718 -1.441 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.376 -0.870 -1.382 1.00 0.41 C ATOM 1690 CG PHE A 114 1.052 -0.499 -0.992 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.426 -0.317 0.358 1.00 1.29 C ATOM 1692 CD2 PHE A 114 2.014 -0.342 -1.998 1.00 1.27 C ATOM 1693 CE1 PHE A 114 2.746 0.016 0.680 1.00 1.38 C ATOM 1694 CE2 PHE A 114 3.334 -0.009 -1.668 1.00 1.27 C ATOM 1695 CZ PHE A 114 3.699 0.170 -0.330 1.00 0.68 C ATOM 0 H PHE A 114 -0.561 -1.940 0.827 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.129 0.640 0.003 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -0.460 -1.952 -1.478 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.612 -0.444 -2.357 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.693 -0.435 1.142 1.00 1.29 H new ATOM 0 HD2 PHE A 114 1.737 -0.478 -3.033 1.00 1.27 H new ATOM 0 HE1 PHE A 114 3.029 0.155 1.713 1.00 1.38 H new ATOM 0 HE2 PHE A 114 4.071 0.110 -2.448 1.00 1.27 H new ATOM 0 HZ PHE A 114 4.717 0.427 -0.077 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.466 -1.421 -1.009 1.00 0.40 N ATOM 1706 CA TYR A 115 -4.819 -1.452 -1.640 1.00 0.41 C ATOM 1707 C TYR A 115 -5.876 -0.835 -0.719 1.00 0.41 C ATOM 1708 O TYR A 115 -6.771 -0.149 -1.169 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.202 -2.903 -1.940 1.00 0.44 C ATOM 1710 CG TYR A 115 -6.489 -2.935 -2.732 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -6.470 -2.656 -4.104 1.00 1.28 C ATOM 1712 CD2 TYR A 115 -7.700 -3.244 -2.098 1.00 1.24 C ATOM 1713 CE1 TYR A 115 -7.659 -2.686 -4.842 1.00 1.32 C ATOM 1714 CE2 TYR A 115 -8.889 -3.274 -2.836 1.00 1.26 C ATOM 1715 CZ TYR A 115 -8.869 -2.995 -4.208 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.041 -3.024 -4.936 1.00 0.70 O ATOM 0 H TYR A 115 -3.146 -2.312 -0.631 1.00 0.40 H new ATOM 0 HA TYR A 115 -4.781 -0.869 -2.560 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.406 -3.391 -2.502 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.322 -3.458 -1.009 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -5.537 -2.417 -4.593 1.00 1.28 H new ATOM 0 HD2 TYR A 115 -7.716 -3.459 -1.040 1.00 1.24 H new ATOM 0 HE1 TYR A 115 -7.643 -2.471 -5.900 1.00 1.32 H new ATOM 0 HE2 TYR A 115 -9.822 -3.512 -2.347 1.00 1.26 H new ATOM 0 HH TYR A 115 -10.788 -3.256 -4.345 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.795 -1.075 0.558 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.820 -0.497 1.470 1.00 0.38 C ATOM 1728 C PHE A 116 -6.845 1.028 1.304 1.00 0.36 C ATOM 1729 O PHE A 116 -7.895 1.640 1.222 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.475 -0.862 2.930 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.745 -0.984 3.759 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.540 0.146 4.006 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -8.125 -2.228 4.284 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -9.705 0.030 4.774 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -9.291 -2.341 5.050 1.00 1.37 C ATOM 1736 CZ PHE A 116 -10.080 -1.213 5.295 1.00 0.45 C ATOM 0 H PHE A 116 -5.073 -1.639 1.007 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.802 -0.902 1.224 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -5.924 -1.802 2.956 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.825 -0.099 3.359 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -8.253 1.106 3.603 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -7.517 -3.100 4.097 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -10.315 0.901 4.964 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -9.581 -3.300 5.452 1.00 1.37 H new ATOM 0 HZ PHE A 116 -10.979 -1.301 5.887 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.695 1.649 1.252 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.663 3.128 1.093 1.00 0.34 C ATOM 1748 C ALA A 117 -6.165 3.512 -0.300 1.00 0.34 C ATOM 1749 O ALA A 117 -6.906 4.460 -0.451 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.239 3.651 1.290 1.00 0.37 C ATOM 0 H ALA A 117 -4.783 1.196 1.313 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.311 3.576 1.846 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -4.230 4.734 1.171 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.892 3.393 2.290 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.580 3.199 0.549 1.00 0.37 H new ATOM 1756 N SER A 118 -5.781 2.788 -1.323 1.00 0.35 N ATOM 1757 CA SER A 118 -6.249 3.124 -2.701 1.00 0.37 C ATOM 1758 C SER A 118 -7.750 3.427 -2.695 1.00 0.36 C ATOM 1759 O SER A 118 -8.212 4.358 -3.323 1.00 0.36 O ATOM 1760 CB SER A 118 -5.974 1.934 -3.626 1.00 0.42 C ATOM 1761 OG SER A 118 -4.676 1.422 -3.356 1.00 1.25 O ATOM 0 H SER A 118 -5.163 1.979 -1.262 1.00 0.35 H new ATOM 0 HA SER A 118 -5.714 4.006 -3.055 1.00 0.37 H new ATOM 0 HB2 SER A 118 -6.723 1.158 -3.472 1.00 0.42 H new ATOM 0 HB3 SER A 118 -6.046 2.244 -4.668 1.00 0.42 H new ATOM 0 HG SER A 118 -4.657 1.037 -2.455 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.505 2.662 -1.956 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.970 2.912 -1.866 1.00 0.39 C ATOM 1769 C LYS A 119 -10.192 4.259 -1.171 1.00 0.36 C ATOM 1770 O LYS A 119 -10.883 5.113 -1.689 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.640 1.779 -1.066 1.00 0.46 C ATOM 1772 CG LYS A 119 -12.112 1.612 -1.496 1.00 1.29 C ATOM 1773 CD LYS A 119 -12.206 0.621 -2.663 1.00 1.84 C ATOM 1774 CE LYS A 119 -13.662 0.495 -3.112 1.00 2.48 C ATOM 1775 NZ LYS A 119 -13.742 -0.430 -4.277 1.00 3.36 N ATOM 0 H LYS A 119 -8.168 1.871 -1.408 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.411 2.938 -2.862 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.100 0.845 -1.225 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -10.589 1.999 0.000 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -12.707 1.255 -0.656 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -12.525 2.576 -1.792 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -11.587 0.961 -3.493 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -11.823 -0.353 -2.358 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -14.276 0.120 -2.293 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -14.057 1.474 -3.383 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -14.732 -0.517 -4.584 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -13.169 -0.054 -5.059 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -13.381 -1.366 -4.003 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.598 4.485 -0.029 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.780 5.812 0.636 1.00 0.35 C ATOM 1791 C LEU A 120 -9.494 6.910 -0.393 1.00 0.33 C ATOM 1792 O LEU A 120 -10.184 7.907 -0.473 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.802 5.939 1.804 1.00 0.36 C ATOM 1794 CG LEU A 120 -8.917 4.707 2.706 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -8.005 4.884 3.922 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -10.371 4.529 3.173 1.00 1.28 C ATOM 0 H LEU A 120 -9.003 3.821 0.467 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.798 5.906 1.014 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.783 6.034 1.429 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -9.017 6.842 2.375 1.00 0.36 H new ATOM 0 HG LEU A 120 -8.615 3.822 2.146 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -8.084 4.009 4.567 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -6.973 4.998 3.589 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -8.307 5.772 4.477 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -10.442 3.650 3.814 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -10.685 5.411 3.731 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -11.018 4.399 2.306 1.00 1.28 H new ATOM 1808 N VAL A 121 -8.491 6.703 -1.198 1.00 0.33 N ATOM 1809 CA VAL A 121 -8.144 7.687 -2.257 1.00 0.39 C ATOM 1810 C VAL A 121 -9.181 7.619 -3.386 1.00 0.36 C ATOM 1811 O VAL A 121 -9.963 8.528 -3.578 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.758 7.370 -2.816 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -6.338 8.479 -3.780 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.747 7.300 -1.668 1.00 1.18 C ATOM 0 H VAL A 121 -7.888 5.881 -1.166 1.00 0.33 H new ATOM 0 HA VAL A 121 -8.142 8.690 -1.830 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.788 6.414 -3.338 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -5.349 8.257 -4.181 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -7.056 8.542 -4.598 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -6.309 9.431 -3.249 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.758 7.074 -2.067 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -5.718 8.258 -1.149 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -6.044 6.518 -0.969 1.00 1.18 H new ATOM 1824 N LEU A 122 -9.187 6.549 -4.143 1.00 0.37 N ATOM 1825 CA LEU A 122 -10.167 6.427 -5.265 1.00 0.39 C ATOM 1826 C LEU A 122 -11.566 6.818 -4.774 1.00 0.40 C ATOM 1827 O LEU A 122 -12.195 7.706 -5.313 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.179 4.974 -5.789 1.00 0.42 C ATOM 1829 CG LEU A 122 -9.160 4.809 -6.925 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -7.748 5.050 -6.390 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -9.254 3.390 -7.491 1.00 1.24 C ATOM 0 H LEU A 122 -8.556 5.756 -4.032 1.00 0.37 H new ATOM 0 HA LEU A 122 -9.874 7.095 -6.075 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -9.944 4.286 -4.977 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.176 4.717 -6.146 1.00 0.42 H new ATOM 0 HG LEU A 122 -9.376 5.532 -7.712 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -7.027 4.932 -7.199 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -7.679 6.060 -5.987 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -7.530 4.330 -5.602 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -8.531 3.271 -8.298 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.039 2.669 -6.702 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -10.259 3.218 -7.876 1.00 1.24 H new ATOM 1843 N LYS A 123 -12.054 6.178 -3.745 1.00 0.51 N ATOM 1844 CA LYS A 123 -13.403 6.542 -3.223 1.00 0.55 C ATOM 1845 C LYS A 123 -13.470 8.061 -3.039 1.00 0.54 C ATOM 1846 O LYS A 123 -14.507 8.662 -3.214 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.654 5.842 -1.875 1.00 0.59 C ATOM 1848 CG LYS A 123 -15.167 5.730 -1.597 1.00 0.97 C ATOM 1849 CD LYS A 123 -15.733 4.456 -2.238 1.00 1.37 C ATOM 1850 CE LYS A 123 -17.246 4.403 -2.018 1.00 1.74 C ATOM 1851 NZ LYS A 123 -17.902 5.469 -2.826 1.00 2.32 N ATOM 0 H LYS A 123 -11.581 5.424 -3.246 1.00 0.51 H new ATOM 0 HA LYS A 123 -14.167 6.221 -3.931 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -13.206 4.848 -1.886 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -13.171 6.401 -1.073 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -15.346 5.715 -0.522 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -15.682 6.605 -1.994 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -15.509 4.443 -3.305 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.260 3.576 -1.802 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -17.632 3.425 -2.305 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -17.476 4.539 -0.961 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -18.911 5.246 -2.940 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -17.802 6.383 -2.341 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -17.451 5.522 -3.762 1.00 2.32 H new ATOM 1865 N ALA A 124 -12.377 8.687 -2.681 1.00 0.52 N ATOM 1866 CA ALA A 124 -12.407 10.166 -2.485 1.00 0.52 C ATOM 1867 C ALA A 124 -12.406 10.877 -3.839 1.00 0.51 C ATOM 1868 O ALA A 124 -12.964 11.941 -3.999 1.00 0.54 O ATOM 1869 CB ALA A 124 -11.199 10.621 -1.682 1.00 0.51 C ATOM 0 H ALA A 124 -11.474 8.242 -2.518 1.00 0.52 H new ATOM 0 HA ALA A 124 -13.316 10.419 -1.940 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -11.237 11.702 -1.549 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -11.206 10.135 -0.707 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -10.286 10.353 -2.214 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.800 10.279 -4.827 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.772 10.887 -6.177 1.00 0.47 C ATOM 1877 C LEU A 125 -13.197 10.940 -6.729 1.00 0.48 C ATOM 1878 O LEU A 125 -13.642 11.953 -7.232 1.00 0.48 O ATOM 1879 CB LEU A 125 -10.900 9.998 -7.079 1.00 0.51 C ATOM 1880 CG LEU A 125 -10.933 10.493 -8.530 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.363 11.915 -8.625 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -10.098 9.546 -9.398 1.00 1.21 C ATOM 0 H LEU A 125 -11.318 9.383 -4.750 1.00 0.47 H new ATOM 0 HA LEU A 125 -11.366 11.898 -6.139 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -9.873 9.998 -6.714 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -11.254 8.968 -7.034 1.00 0.51 H new ATOM 0 HG LEU A 125 -11.965 10.509 -8.880 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.394 12.251 -9.662 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -10.958 12.588 -8.008 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -9.331 11.918 -8.273 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.115 9.890 -10.432 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -9.070 9.533 -9.037 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -10.514 8.540 -9.343 1.00 1.21 H new ATOM 1894 N CYS A 126 -13.904 9.845 -6.669 1.00 0.52 N ATOM 1895 CA CYS A 126 -15.291 9.818 -7.224 1.00 0.57 C ATOM 1896 C CYS A 126 -16.200 10.758 -6.432 1.00 0.57 C ATOM 1897 O CYS A 126 -17.311 11.047 -6.828 1.00 0.68 O ATOM 1898 CB CYS A 126 -15.844 8.381 -7.157 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.623 8.079 -5.543 1.00 1.67 S ATOM 0 H CYS A 126 -13.583 8.967 -6.260 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.263 10.151 -8.262 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -16.571 8.227 -7.954 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.037 7.666 -7.319 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.764 8.314 -4.596 1.00 1.67 H new ATOM 1905 N THR A 127 -15.731 11.236 -5.315 1.00 0.57 N ATOM 1906 CA THR A 127 -16.553 12.160 -4.485 1.00 0.60 C ATOM 1907 C THR A 127 -16.134 13.595 -4.830 1.00 0.62 C ATOM 1908 O THR A 127 -16.729 14.562 -4.398 1.00 0.70 O ATOM 1909 CB THR A 127 -16.239 11.864 -3.000 1.00 0.60 C ATOM 1910 OG1 THR A 127 -15.284 10.832 -2.921 1.00 1.14 O ATOM 1911 CG2 THR A 127 -17.490 11.459 -2.204 1.00 1.19 C ATOM 0 H THR A 127 -14.807 11.025 -4.938 1.00 0.57 H new ATOM 0 HA THR A 127 -17.620 12.032 -4.670 1.00 0.60 H new ATOM 0 HB THR A 127 -15.852 12.783 -2.559 1.00 0.60 H new ATOM 0 HG1 THR A 127 -15.725 9.967 -3.054 1.00 1.14 H new ATOM 0 HG21 THR A 127 -17.214 11.262 -1.168 1.00 1.19 H new ATOM 0 HG22 THR A 127 -18.220 12.267 -2.238 1.00 1.19 H new ATOM 0 HG23 THR A 127 -17.924 10.560 -2.641 1.00 1.19 H new ATOM 1919 N LYS A 128 -15.077 13.708 -5.602 1.00 0.60 N ATOM 1920 CA LYS A 128 -14.536 15.040 -6.006 1.00 0.70 C ATOM 1921 C LYS A 128 -14.122 15.841 -4.769 1.00 0.61 C ATOM 1922 O LYS A 128 -14.715 16.860 -4.470 1.00 0.60 O ATOM 1923 CB LYS A 128 -15.577 15.829 -6.820 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.944 15.065 -8.121 1.00 1.12 C ATOM 1925 CD LYS A 128 -17.337 14.433 -7.999 1.00 1.43 C ATOM 1926 CE LYS A 128 -17.682 13.702 -9.298 1.00 1.83 C ATOM 1927 NZ LYS A 128 -17.711 14.678 -10.425 1.00 2.47 N ATOM 0 H LYS A 128 -14.558 12.913 -5.975 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.660 14.876 -6.633 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -16.473 15.987 -6.219 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -15.182 16.814 -7.069 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -15.922 15.749 -8.970 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -15.203 14.290 -8.316 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -17.360 13.737 -7.161 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -18.081 15.203 -7.794 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -16.946 12.923 -9.496 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -18.650 13.209 -9.205 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -18.272 14.287 -11.209 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -18.141 15.568 -10.102 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -16.741 14.860 -10.751 1.00 2.47 H new ATOM 1941 N VAL A 129 -13.104 15.413 -4.045 1.00 0.60 N ATOM 1942 CA VAL A 129 -12.656 16.182 -2.834 1.00 0.53 C ATOM 1943 C VAL A 129 -11.102 16.230 -2.816 1.00 0.53 C ATOM 1944 O VAL A 129 -10.468 15.538 -2.051 1.00 0.56 O ATOM 1945 CB VAL A 129 -13.218 15.490 -1.566 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -12.771 14.027 -1.476 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -12.793 16.260 -0.307 1.00 1.22 C ATOM 0 H VAL A 129 -12.568 14.568 -4.242 1.00 0.60 H new ATOM 0 HA VAL A 129 -13.030 17.206 -2.860 1.00 0.53 H new ATOM 0 HB VAL A 129 -14.306 15.498 -1.637 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -13.184 13.575 -0.574 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -13.128 13.483 -2.351 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.683 13.981 -1.439 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -13.194 15.763 0.576 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -11.705 16.285 -0.246 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -13.177 17.279 -0.356 1.00 1.22 H new ATOM 1957 N PRO A 130 -10.508 17.036 -3.675 1.00 0.62 N ATOM 1958 CA PRO A 130 -9.035 17.119 -3.746 1.00 0.73 C ATOM 1959 C PRO A 130 -8.447 17.468 -2.368 1.00 0.65 C ATOM 1960 O PRO A 130 -7.281 17.243 -2.108 1.00 0.64 O ATOM 1961 CB PRO A 130 -8.733 18.180 -4.822 1.00 1.00 C ATOM 1962 CG PRO A 130 -10.102 18.649 -5.403 1.00 1.00 C ATOM 1963 CD PRO A 130 -11.223 17.924 -4.617 1.00 0.75 C ATOM 0 HA PRO A 130 -8.572 16.170 -4.017 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -8.189 19.021 -4.391 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -8.104 17.763 -5.608 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -10.207 19.730 -5.309 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -10.167 18.414 -6.465 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -11.858 18.634 -4.087 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -11.870 17.355 -5.284 1.00 0.75 H new ATOM 1971 N GLU A 131 -9.253 17.956 -1.472 1.00 0.73 N ATOM 1972 CA GLU A 131 -8.753 18.252 -0.102 1.00 0.82 C ATOM 1973 C GLU A 131 -8.379 16.935 0.586 1.00 0.72 C ATOM 1974 O GLU A 131 -7.478 16.863 1.398 1.00 0.73 O ATOM 1975 CB GLU A 131 -9.884 18.904 0.713 1.00 1.09 C ATOM 1976 CG GLU A 131 -9.299 19.491 2.009 1.00 1.55 C ATOM 1977 CD GLU A 131 -10.365 20.305 2.743 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -11.284 19.702 3.271 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -10.239 21.519 2.770 1.00 2.52 O ATOM 0 H GLU A 131 -10.239 18.164 -1.628 1.00 0.73 H new ATOM 0 HA GLU A 131 -7.890 18.915 -0.163 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -10.364 19.689 0.128 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -10.651 18.166 0.948 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -8.937 18.688 2.651 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -8.442 20.124 1.777 1.00 1.55 H new ATOM 1986 N LEU A 132 -9.111 15.898 0.267 1.00 0.71 N ATOM 1987 CA LEU A 132 -8.888 14.559 0.875 1.00 0.69 C ATOM 1988 C LEU A 132 -7.789 13.790 0.133 1.00 0.58 C ATOM 1989 O LEU A 132 -6.957 13.159 0.754 1.00 0.59 O ATOM 1990 CB LEU A 132 -10.221 13.783 0.819 1.00 0.80 C ATOM 1991 CG LEU A 132 -10.490 13.025 2.126 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -10.587 14.004 3.321 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -11.808 12.253 1.972 1.00 0.77 C ATOM 0 H LEU A 132 -9.874 15.929 -0.409 1.00 0.71 H new ATOM 0 HA LEU A 132 -8.558 14.675 1.907 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -11.039 14.477 0.626 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -10.198 13.079 -0.012 1.00 0.80 H new ATOM 0 HG LEU A 132 -9.668 12.338 2.324 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -10.778 13.443 4.236 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -9.650 14.551 3.420 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -11.402 14.708 3.150 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -12.019 11.706 2.891 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -12.619 12.954 1.772 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -11.723 11.550 1.143 1.00 0.77 H new ATOM 2005 N ILE A 133 -7.762 13.815 -1.171 1.00 0.52 N ATOM 2006 CA ILE A 133 -6.690 13.062 -1.887 1.00 0.46 C ATOM 2007 C ILE A 133 -5.336 13.428 -1.273 1.00 0.43 C ATOM 2008 O ILE A 133 -4.510 12.578 -1.005 1.00 0.46 O ATOM 2009 CB ILE A 133 -6.715 13.419 -3.378 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -8.100 13.084 -3.943 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -5.647 12.615 -4.130 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -8.167 13.463 -5.424 1.00 1.19 C ATOM 0 H ILE A 133 -8.423 14.315 -1.765 1.00 0.52 H new ATOM 0 HA ILE A 133 -6.855 11.989 -1.786 1.00 0.46 H new ATOM 0 HB ILE A 133 -6.507 14.482 -3.502 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -8.304 12.020 -3.822 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -8.868 13.621 -3.387 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -5.673 12.876 -5.188 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -4.663 12.847 -3.723 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -5.845 11.549 -4.014 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -9.155 13.221 -5.817 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -7.984 14.532 -5.535 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -7.410 12.906 -5.977 1.00 1.19 H new ATOM 2024 N ARG A 134 -5.106 14.692 -1.053 1.00 0.42 N ATOM 2025 CA ARG A 134 -3.809 15.121 -0.462 1.00 0.43 C ATOM 2026 C ARG A 134 -3.756 14.747 1.030 1.00 0.40 C ATOM 2027 O ARG A 134 -2.730 14.336 1.535 1.00 0.39 O ATOM 2028 CB ARG A 134 -3.663 16.637 -0.626 1.00 0.51 C ATOM 2029 CG ARG A 134 -3.746 16.993 -2.113 1.00 1.26 C ATOM 2030 CD ARG A 134 -3.814 18.513 -2.282 1.00 1.57 C ATOM 2031 NE ARG A 134 -3.936 18.841 -3.732 1.00 2.30 N ATOM 2032 CZ ARG A 134 -4.300 20.039 -4.104 1.00 2.86 C ATOM 2033 NH1 ARG A 134 -4.553 20.952 -3.207 1.00 2.98 N ATOM 2034 NH2 ARG A 134 -4.409 20.322 -5.373 1.00 3.71 N ATOM 0 H ARG A 134 -5.761 15.447 -1.257 1.00 0.42 H new ATOM 0 HA ARG A 134 -2.991 14.615 -0.975 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -4.448 17.152 -0.072 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -2.711 16.969 -0.213 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -2.877 16.598 -2.639 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -4.626 16.529 -2.558 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -4.666 18.914 -1.733 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -2.920 18.977 -1.866 1.00 1.57 H new ATOM 0 HE ARG A 134 -3.735 18.129 -4.434 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -4.467 20.730 -2.215 1.00 2.98 H new ATOM 0 HH12 ARG A 134 -4.837 21.888 -3.498 1.00 2.98 H new ATOM 0 HH21 ARG A 134 -4.210 19.608 -6.074 1.00 3.71 H new ATOM 0 HH22 ARG A 134 -4.693 21.257 -5.664 1.00 3.71 H new ATOM 2048 N THR A 135 -4.843 14.912 1.746 1.00 0.41 N ATOM 2049 CA THR A 135 -4.825 14.590 3.208 1.00 0.41 C ATOM 2050 C THR A 135 -4.688 13.083 3.439 1.00 0.39 C ATOM 2051 O THR A 135 -4.014 12.649 4.351 1.00 0.52 O ATOM 2052 CB THR A 135 -6.088 15.111 3.895 1.00 0.42 C ATOM 2053 OG1 THR A 135 -6.116 16.528 3.804 1.00 0.89 O ATOM 2054 CG2 THR A 135 -6.081 14.699 5.370 1.00 0.88 C ATOM 0 H THR A 135 -5.734 15.253 1.385 1.00 0.41 H new ATOM 0 HA THR A 135 -3.958 15.087 3.644 1.00 0.41 H new ATOM 0 HB THR A 135 -6.967 14.690 3.407 1.00 0.42 H new ATOM 0 HG1 THR A 135 -6.577 16.794 2.981 1.00 0.89 H new ATOM 0 HG21 THR A 135 -6.982 15.072 5.856 1.00 0.88 H new ATOM 0 HG22 THR A 135 -6.052 13.612 5.444 1.00 0.88 H new ATOM 0 HG23 THR A 135 -5.203 15.119 5.861 1.00 0.88 H new ATOM 2062 N ILE A 136 -5.275 12.276 2.599 1.00 0.35 N ATOM 2063 CA ILE A 136 -5.120 10.804 2.759 1.00 0.36 C ATOM 2064 C ILE A 136 -3.643 10.471 2.543 1.00 0.35 C ATOM 2065 O ILE A 136 -2.960 10.078 3.468 1.00 0.51 O ATOM 2066 CB ILE A 136 -6.012 10.086 1.730 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -7.483 10.207 2.177 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -5.625 8.604 1.644 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -8.423 10.028 0.981 1.00 0.64 C ATOM 0 H ILE A 136 -5.853 12.571 1.812 1.00 0.35 H new ATOM 0 HA ILE A 136 -5.426 10.474 3.752 1.00 0.36 H new ATOM 0 HB ILE A 136 -5.879 10.544 0.750 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -7.702 9.455 2.935 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -7.651 11.181 2.636 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -6.261 8.104 0.914 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -4.583 8.517 1.337 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -5.756 8.137 2.620 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -9.457 10.116 1.314 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -8.215 10.796 0.236 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -8.267 9.044 0.540 1.00 0.64 H new ATOM 2081 N MET A 137 -3.139 10.622 1.343 1.00 0.35 N ATOM 2082 CA MET A 137 -1.695 10.318 1.081 1.00 0.33 C ATOM 2083 C MET A 137 -0.824 10.787 2.256 1.00 0.31 C ATOM 2084 O MET A 137 0.220 10.237 2.542 1.00 0.34 O ATOM 2085 CB MET A 137 -1.252 11.034 -0.199 1.00 0.36 C ATOM 2086 CG MET A 137 -1.873 10.347 -1.421 1.00 0.67 C ATOM 2087 SD MET A 137 -1.899 11.503 -2.813 1.00 1.13 S ATOM 2088 CE MET A 137 -0.127 11.474 -3.175 1.00 0.67 C ATOM 0 H MET A 137 -3.666 10.943 0.531 1.00 0.35 H new ATOM 0 HA MET A 137 -1.577 9.241 0.966 1.00 0.33 H new ATOM 0 HB2 MET A 137 -1.556 12.080 -0.165 1.00 0.36 H new ATOM 0 HB3 MET A 137 -0.165 11.020 -0.276 1.00 0.36 H new ATOM 0 HG2 MET A 137 -1.299 9.458 -1.683 1.00 0.67 H new ATOM 0 HG3 MET A 137 -2.886 10.016 -1.190 1.00 0.67 H new ATOM 0 HE1 MET A 137 0.024 11.312 -4.242 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.319 12.425 -2.886 1.00 0.67 H new ATOM 0 HE3 MET A 137 0.345 10.667 -2.615 1.00 0.67 H new ATOM 2098 N GLY A 138 -1.276 11.807 2.939 1.00 0.31 N ATOM 2099 CA GLY A 138 -0.528 12.350 4.111 1.00 0.33 C ATOM 2100 C GLY A 138 -0.483 11.298 5.222 1.00 0.33 C ATOM 2101 O GLY A 138 0.568 10.961 5.729 1.00 0.34 O ATOM 0 H GLY A 138 -2.147 12.294 2.730 1.00 0.31 H new ATOM 0 HA2 GLY A 138 0.484 12.624 3.814 1.00 0.33 H new ATOM 0 HA3 GLY A 138 -1.010 13.257 4.475 1.00 0.33 H new ATOM 2105 N TRP A 139 -1.617 10.771 5.594 1.00 0.34 N ATOM 2106 CA TRP A 139 -1.634 9.732 6.661 1.00 0.37 C ATOM 2107 C TRP A 139 -0.926 8.472 6.156 1.00 0.35 C ATOM 2108 O TRP A 139 -0.490 7.641 6.928 1.00 0.39 O ATOM 2109 CB TRP A 139 -3.071 9.386 7.062 1.00 0.43 C ATOM 2110 CG TRP A 139 -3.804 10.610 7.527 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -3.278 11.619 8.266 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -5.201 10.956 7.306 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -4.264 12.560 8.502 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -5.466 12.197 7.931 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -6.254 10.318 6.626 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -6.731 12.784 7.884 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -7.529 10.906 6.577 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -7.766 12.137 7.204 1.00 0.78 C ATOM 0 H TRP A 139 -2.529 11.014 5.207 1.00 0.34 H new ATOM 0 HA TRP A 139 -1.116 10.124 7.536 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -3.594 8.944 6.214 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -3.062 8.639 7.855 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -2.257 11.678 8.613 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -4.120 13.418 9.034 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -6.081 9.370 6.138 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -6.909 13.732 8.370 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -8.331 10.407 6.053 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -8.748 12.585 7.162 1.00 0.78 H new ATOM 2129 N THR A 140 -0.800 8.325 4.864 1.00 0.34 N ATOM 2130 CA THR A 140 -0.113 7.123 4.315 1.00 0.36 C ATOM 2131 C THR A 140 1.397 7.268 4.523 1.00 0.34 C ATOM 2132 O THR A 140 2.024 6.468 5.188 1.00 0.39 O ATOM 2133 CB THR A 140 -0.414 7.002 2.820 1.00 0.38 C ATOM 2134 OG1 THR A 140 -1.815 7.117 2.611 1.00 1.20 O ATOM 2135 CG2 THR A 140 0.071 5.646 2.307 1.00 1.17 C ATOM 0 H THR A 140 -1.143 8.985 4.167 1.00 0.34 H new ATOM 0 HA THR A 140 -0.469 6.230 4.828 1.00 0.36 H new ATOM 0 HB THR A 140 0.101 7.796 2.280 1.00 0.38 H new ATOM 0 HG1 THR A 140 -2.010 7.042 1.654 1.00 1.20 H new ATOM 0 HG21 THR A 140 -0.144 5.562 1.242 1.00 1.17 H new ATOM 0 HG22 THR A 140 1.146 5.559 2.468 1.00 1.17 H new ATOM 0 HG23 THR A 140 -0.442 4.849 2.845 1.00 1.17 H new ATOM 2143 N LEU A 141 1.983 8.290 3.960 1.00 0.33 N ATOM 2144 CA LEU A 141 3.450 8.502 4.124 1.00 0.34 C ATOM 2145 C LEU A 141 3.785 8.716 5.603 1.00 0.33 C ATOM 2146 O LEU A 141 4.862 8.378 6.053 1.00 0.33 O ATOM 2147 CB LEU A 141 3.895 9.716 3.300 1.00 0.35 C ATOM 2148 CG LEU A 141 3.643 9.457 1.797 1.00 0.41 C ATOM 2149 CD1 LEU A 141 3.430 10.789 1.066 1.00 0.99 C ATOM 2150 CD2 LEU A 141 4.844 8.723 1.180 1.00 0.80 C ATOM 0 H LEU A 141 1.507 8.990 3.391 1.00 0.33 H new ATOM 0 HA LEU A 141 3.981 7.619 3.768 1.00 0.34 H new ATOM 0 HB2 LEU A 141 3.349 10.603 3.621 1.00 0.35 H new ATOM 0 HB3 LEU A 141 4.953 9.914 3.471 1.00 0.35 H new ATOM 0 HG LEU A 141 2.751 8.839 1.693 1.00 0.41 H new ATOM 0 HD11 LEU A 141 3.253 10.599 0.007 1.00 0.99 H new ATOM 0 HD12 LEU A 141 2.568 11.304 1.491 1.00 0.99 H new ATOM 0 HD13 LEU A 141 4.317 11.412 1.179 1.00 0.99 H new ATOM 0 HD21 LEU A 141 4.657 8.545 0.121 1.00 0.80 H new ATOM 0 HD22 LEU A 141 5.740 9.333 1.293 1.00 0.80 H new ATOM 0 HD23 LEU A 141 4.988 7.769 1.688 1.00 0.80 H new ATOM 2162 N ASP A 142 2.881 9.257 6.371 1.00 0.36 N ATOM 2163 CA ASP A 142 3.181 9.459 7.817 1.00 0.37 C ATOM 2164 C ASP A 142 3.434 8.092 8.457 1.00 0.37 C ATOM 2165 O ASP A 142 4.478 7.845 9.027 1.00 0.42 O ATOM 2166 CB ASP A 142 1.995 10.138 8.502 1.00 0.37 C ATOM 2167 CG ASP A 142 1.871 11.578 8.001 1.00 0.78 C ATOM 2168 OD1 ASP A 142 2.438 11.873 6.961 1.00 1.32 O ATOM 2169 OD2 ASP A 142 1.213 12.361 8.665 1.00 1.59 O ATOM 0 H ASP A 142 1.958 9.565 6.066 1.00 0.36 H new ATOM 0 HA ASP A 142 4.061 10.093 7.930 1.00 0.37 H new ATOM 0 HB2 ASP A 142 1.077 9.589 8.292 1.00 0.37 H new ATOM 0 HB3 ASP A 142 2.132 10.129 9.583 1.00 0.37 H new ATOM 2174 N PHE A 143 2.489 7.198 8.354 1.00 0.41 N ATOM 2175 CA PHE A 143 2.672 5.840 8.940 1.00 0.43 C ATOM 2176 C PHE A 143 3.849 5.143 8.250 1.00 0.43 C ATOM 2177 O PHE A 143 4.660 4.505 8.891 1.00 0.45 O ATOM 2178 CB PHE A 143 1.389 5.022 8.737 1.00 0.44 C ATOM 2179 CG PHE A 143 1.652 3.562 9.038 1.00 0.47 C ATOM 2180 CD1 PHE A 143 1.509 3.075 10.343 1.00 1.29 C ATOM 2181 CD2 PHE A 143 2.046 2.699 8.008 1.00 1.16 C ATOM 2182 CE1 PHE A 143 1.758 1.724 10.616 1.00 1.35 C ATOM 2183 CE2 PHE A 143 2.296 1.350 8.282 1.00 1.22 C ATOM 2184 CZ PHE A 143 2.152 0.862 9.586 1.00 0.72 C ATOM 0 H PHE A 143 1.595 7.350 7.887 1.00 0.41 H new ATOM 0 HA PHE A 143 2.880 5.924 10.007 1.00 0.43 H new ATOM 0 HB2 PHE A 143 0.601 5.400 9.388 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.036 5.132 7.712 1.00 0.44 H new ATOM 0 HD1 PHE A 143 1.207 3.740 11.138 1.00 1.29 H new ATOM 0 HD2 PHE A 143 2.157 3.075 7.002 1.00 1.16 H new ATOM 0 HE1 PHE A 143 1.646 1.347 11.622 1.00 1.35 H new ATOM 0 HE2 PHE A 143 2.600 0.685 7.487 1.00 1.22 H new ATOM 0 HZ PHE A 143 2.345 -0.179 9.797 1.00 0.72 H new ATOM 2194 N LEU A 144 3.955 5.250 6.955 1.00 0.45 N ATOM 2195 CA LEU A 144 5.087 4.579 6.256 1.00 0.47 C ATOM 2196 C LEU A 144 6.398 5.183 6.792 1.00 0.47 C ATOM 2197 O LEU A 144 7.274 4.473 7.247 1.00 0.49 O ATOM 2198 CB LEU A 144 4.922 4.787 4.733 1.00 0.49 C ATOM 2199 CG LEU A 144 5.299 3.525 3.937 1.00 0.64 C ATOM 2200 CD1 LEU A 144 4.684 3.607 2.533 1.00 1.31 C ATOM 2201 CD2 LEU A 144 6.825 3.430 3.813 1.00 1.01 C ATOM 0 H LEU A 144 3.313 5.768 6.355 1.00 0.45 H new ATOM 0 HA LEU A 144 5.103 3.505 6.441 1.00 0.47 H new ATOM 0 HB2 LEU A 144 3.890 5.060 4.514 1.00 0.49 H new ATOM 0 HB3 LEU A 144 5.547 5.620 4.411 1.00 0.49 H new ATOM 0 HG LEU A 144 4.920 2.644 4.456 1.00 0.64 H new ATOM 0 HD11 LEU A 144 4.949 2.714 1.967 1.00 1.31 H new ATOM 0 HD12 LEU A 144 3.599 3.676 2.614 1.00 1.31 H new ATOM 0 HD13 LEU A 144 5.066 4.489 2.019 1.00 1.31 H new ATOM 0 HD21 LEU A 144 7.089 2.535 3.249 1.00 1.01 H new ATOM 0 HD22 LEU A 144 7.203 4.311 3.295 1.00 1.01 H new ATOM 0 HD23 LEU A 144 7.268 3.376 4.807 1.00 1.01 H new ATOM 2213 N ARG A 145 6.529 6.477 6.772 1.00 0.47 N ATOM 2214 CA ARG A 145 7.767 7.116 7.312 1.00 0.48 C ATOM 2215 C ARG A 145 7.946 6.779 8.801 1.00 0.49 C ATOM 2216 O ARG A 145 9.050 6.559 9.259 1.00 0.50 O ATOM 2217 CB ARG A 145 7.666 8.641 7.169 1.00 0.49 C ATOM 2218 CG ARG A 145 9.053 9.259 7.404 1.00 0.69 C ATOM 2219 CD ARG A 145 8.957 10.793 7.439 1.00 0.68 C ATOM 2220 NE ARG A 145 10.237 11.392 6.938 1.00 1.56 N ATOM 2221 CZ ARG A 145 11.402 10.993 7.386 1.00 2.10 C ATOM 2222 NH1 ARG A 145 11.482 10.180 8.404 1.00 2.12 N ATOM 2223 NH2 ARG A 145 12.496 11.458 6.846 1.00 3.16 N ATOM 0 H ARG A 145 5.832 7.125 6.405 1.00 0.47 H new ATOM 0 HA ARG A 145 8.619 6.736 6.749 1.00 0.48 H new ATOM 0 HB2 ARG A 145 7.301 8.903 6.176 1.00 0.49 H new ATOM 0 HB3 ARG A 145 6.950 9.040 7.887 1.00 0.49 H new ATOM 0 HG2 ARG A 145 9.467 8.893 8.343 1.00 0.69 H new ATOM 0 HG3 ARG A 145 9.735 8.949 6.613 1.00 0.69 H new ATOM 0 HD2 ARG A 145 8.122 11.129 6.824 1.00 0.68 H new ATOM 0 HD3 ARG A 145 8.760 11.131 8.456 1.00 0.68 H new ATOM 0 HE ARG A 145 10.200 12.127 6.232 1.00 1.56 H new ATOM 0 HH11 ARG A 145 10.632 9.848 8.860 1.00 2.12 H new ATOM 0 HH12 ARG A 145 12.395 9.876 8.744 1.00 2.12 H new ATOM 0 HH21 ARG A 145 12.441 12.129 6.079 1.00 3.16 H new ATOM 0 HH22 ARG A 145 13.405 11.151 7.191 1.00 3.16 H new ATOM 2237 N GLU A 146 6.896 6.796 9.575 1.00 0.49 N ATOM 2238 CA GLU A 146 7.054 6.539 11.042 1.00 0.51 C ATOM 2239 C GLU A 146 7.153 5.039 11.375 1.00 0.53 C ATOM 2240 O GLU A 146 7.871 4.684 12.289 1.00 0.55 O ATOM 2241 CB GLU A 146 5.876 7.158 11.800 1.00 0.52 C ATOM 2242 CG GLU A 146 5.922 8.682 11.666 1.00 0.96 C ATOM 2243 CD GLU A 146 4.696 9.292 12.347 1.00 1.48 C ATOM 2244 OE1 GLU A 146 3.786 8.544 12.665 1.00 2.03 O ATOM 2245 OE2 GLU A 146 4.687 10.497 12.539 1.00 2.22 O ATOM 0 H GLU A 146 5.942 6.975 9.263 1.00 0.49 H new ATOM 0 HA GLU A 146 7.992 7.000 11.352 1.00 0.51 H new ATOM 0 HB2 GLU A 146 4.935 6.776 11.404 1.00 0.52 H new ATOM 0 HB3 GLU A 146 5.918 6.874 12.852 1.00 0.52 H new ATOM 0 HG2 GLU A 146 6.834 9.070 12.120 1.00 0.96 H new ATOM 0 HG3 GLU A 146 5.945 8.965 10.613 1.00 0.96 H new ATOM 2252 N ARG A 147 6.423 4.158 10.721 1.00 0.59 N ATOM 2253 CA ARG A 147 6.493 2.700 11.127 1.00 0.62 C ATOM 2254 C ARG A 147 7.178 1.815 10.074 1.00 0.58 C ATOM 2255 O ARG A 147 7.992 0.971 10.390 1.00 0.62 O ATOM 2256 CB ARG A 147 5.063 2.198 11.345 1.00 0.63 C ATOM 2257 CG ARG A 147 4.470 2.873 12.594 1.00 0.73 C ATOM 2258 CD ARG A 147 5.201 2.400 13.870 1.00 1.11 C ATOM 2259 NE ARG A 147 4.215 2.216 14.980 1.00 1.75 N ATOM 2260 CZ ARG A 147 3.320 3.129 15.248 1.00 2.40 C ATOM 2261 NH1 ARG A 147 3.353 4.287 14.649 1.00 2.71 N ATOM 2262 NH2 ARG A 147 2.414 2.899 16.158 1.00 3.30 N ATOM 0 H ARG A 147 5.797 4.371 9.944 1.00 0.59 H new ATOM 0 HA ARG A 147 7.092 2.634 12.035 1.00 0.62 H new ATOM 0 HB2 ARG A 147 4.450 2.421 10.472 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.061 1.115 11.468 1.00 0.63 H new ATOM 0 HG2 ARG A 147 4.553 3.956 12.502 1.00 0.73 H new ATOM 0 HG3 ARG A 147 3.408 2.640 12.670 1.00 0.73 H new ATOM 0 HD2 ARG A 147 5.722 1.463 13.675 1.00 1.11 H new ATOM 0 HD3 ARG A 147 5.956 3.131 14.160 1.00 1.11 H new ATOM 0 HE ARG A 147 4.242 1.362 15.538 1.00 1.75 H new ATOM 0 HH11 ARG A 147 4.082 4.486 13.964 1.00 2.71 H new ATOM 0 HH12 ARG A 147 2.650 4.993 14.865 1.00 2.71 H new ATOM 0 HH21 ARG A 147 2.407 2.009 16.657 1.00 3.30 H new ATOM 0 HH22 ARG A 147 1.713 3.609 16.371 1.00 3.30 H new ATOM 2276 N LEU A 148 6.801 1.964 8.838 1.00 0.53 N ATOM 2277 CA LEU A 148 7.350 1.106 7.743 1.00 0.57 C ATOM 2278 C LEU A 148 8.648 1.668 7.141 1.00 0.67 C ATOM 2279 O LEU A 148 8.895 1.493 5.964 1.00 1.61 O ATOM 2280 CB LEU A 148 6.264 1.038 6.638 1.00 0.59 C ATOM 2281 CG LEU A 148 6.176 -0.383 6.036 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.351 -1.299 6.954 1.00 1.29 C ATOM 2283 CD2 LEU A 148 5.493 -0.321 4.667 1.00 1.34 C ATOM 0 H LEU A 148 6.121 2.658 8.529 1.00 0.53 H new ATOM 0 HA LEU A 148 7.594 0.125 8.150 1.00 0.57 H new ATOM 0 HB2 LEU A 148 5.297 1.321 7.055 1.00 0.59 H new ATOM 0 HB3 LEU A 148 6.495 1.757 5.852 1.00 0.59 H new ATOM 0 HG LEU A 148 7.186 -0.780 5.935 1.00 0.70 H new ATOM 0 HD11 LEU A 148 5.297 -2.297 6.519 1.00 1.29 H new ATOM 0 HD12 LEU A 148 5.826 -1.356 7.933 1.00 1.29 H new ATOM 0 HD13 LEU A 148 4.344 -0.895 7.062 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.432 -1.324 4.245 1.00 1.34 H new ATOM 0 HD22 LEU A 148 4.488 0.087 4.780 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.071 0.319 4.000 1.00 1.34 H new ATOM 2295 N LEU A 149 9.483 2.325 7.910 1.00 0.67 N ATOM 2296 CA LEU A 149 10.761 2.872 7.333 1.00 0.57 C ATOM 2297 C LEU A 149 11.949 2.035 7.830 1.00 0.56 C ATOM 2298 O LEU A 149 12.754 1.560 7.054 1.00 0.58 O ATOM 2299 CB LEU A 149 10.933 4.347 7.758 1.00 0.54 C ATOM 2300 CG LEU A 149 11.592 5.162 6.630 1.00 0.59 C ATOM 2301 CD1 LEU A 149 11.814 6.598 7.108 1.00 0.83 C ATOM 2302 CD2 LEU A 149 12.944 4.542 6.248 1.00 1.21 C ATOM 0 H LEU A 149 9.341 2.507 8.903 1.00 0.67 H new ATOM 0 HA LEU A 149 10.721 2.820 6.245 1.00 0.57 H new ATOM 0 HB2 LEU A 149 9.962 4.776 8.004 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.544 4.403 8.659 1.00 0.54 H new ATOM 0 HG LEU A 149 10.938 5.156 5.758 1.00 0.59 H new ATOM 0 HD11 LEU A 149 12.281 7.178 6.312 1.00 0.83 H new ATOM 0 HD12 LEU A 149 10.856 7.046 7.370 1.00 0.83 H new ATOM 0 HD13 LEU A 149 12.464 6.594 7.983 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.400 5.127 5.449 1.00 1.21 H new ATOM 0 HD22 LEU A 149 13.602 4.540 7.117 1.00 1.21 H new ATOM 0 HD23 LEU A 149 12.791 3.518 5.906 1.00 1.21 H new ATOM 2314 N GLY A 150 12.073 1.870 9.119 1.00 0.56 N ATOM 2315 CA GLY A 150 13.216 1.085 9.672 1.00 0.58 C ATOM 2316 C GLY A 150 13.204 -0.350 9.136 1.00 0.62 C ATOM 2317 O GLY A 150 14.229 -0.889 8.768 1.00 0.70 O ATOM 0 H GLY A 150 11.430 2.246 9.816 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.156 1.568 9.407 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.160 1.071 10.760 1.00 0.58 H new ATOM 2321 N TRP A 151 12.065 -0.989 9.116 1.00 0.63 N ATOM 2322 CA TRP A 151 12.017 -2.401 8.634 1.00 0.69 C ATOM 2323 C TRP A 151 12.360 -2.483 7.144 1.00 0.70 C ATOM 2324 O TRP A 151 12.861 -3.487 6.679 1.00 0.72 O ATOM 2325 CB TRP A 151 10.617 -2.980 8.852 1.00 0.73 C ATOM 2326 CG TRP A 151 10.340 -3.120 10.317 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.120 -3.785 11.203 1.00 2.17 C ATOM 2328 CD2 TRP A 151 9.210 -2.602 11.076 1.00 1.86 C ATOM 2329 NE1 TRP A 151 10.541 -3.699 12.457 1.00 2.65 N ATOM 2330 CE2 TRP A 151 9.363 -2.981 12.430 1.00 2.43 C ATOM 2331 CE3 TRP A 151 8.080 -1.845 10.722 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 8.427 -2.621 13.399 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 7.135 -1.482 11.695 1.00 3.62 C ATOM 2334 CH2 TRP A 151 7.308 -1.868 13.031 1.00 3.67 C ATOM 0 H TRP A 151 11.170 -0.598 9.411 1.00 0.63 H new ATOM 0 HA TRP A 151 12.751 -2.974 9.200 1.00 0.69 H new ATOM 0 HB2 TRP A 151 9.871 -2.331 8.393 1.00 0.73 H new ATOM 0 HB3 TRP A 151 10.537 -3.952 8.364 1.00 0.73 H new ATOM 0 HD1 TRP A 151 12.041 -4.298 10.969 1.00 2.17 H new ATOM 0 HE1 TRP A 151 10.937 -4.116 13.299 1.00 2.65 H new ATOM 0 HE3 TRP A 151 7.938 -1.541 9.696 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 8.566 -2.922 14.427 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 6.269 -0.902 11.412 1.00 3.62 H new ATOM 0 HH2 TRP A 151 6.578 -1.584 13.775 1.00 3.67 H new ATOM 2345 N ILE A 152 12.092 -1.458 6.380 1.00 0.73 N ATOM 2346 CA ILE A 152 12.410 -1.542 4.924 1.00 0.76 C ATOM 2347 C ILE A 152 13.926 -1.448 4.743 1.00 0.79 C ATOM 2348 O ILE A 152 14.525 -2.203 4.004 1.00 0.89 O ATOM 2349 CB ILE A 152 11.706 -0.407 4.170 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.190 -0.590 4.317 1.00 0.83 C ATOM 2351 CG2 ILE A 152 12.090 -0.451 2.682 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.451 0.524 3.573 1.00 0.94 C ATOM 0 H ILE A 152 11.675 -0.581 6.692 1.00 0.73 H new ATOM 0 HA ILE A 152 12.057 -2.491 4.520 1.00 0.76 H new ATOM 0 HB ILE A 152 12.009 0.555 4.582 1.00 0.78 H new ATOM 0 HG12 ILE A 152 9.893 -1.561 3.921 1.00 0.83 H new ATOM 0 HG13 ILE A 152 9.915 -0.578 5.372 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.587 0.358 2.152 1.00 0.92 H new ATOM 0 HG22 ILE A 152 13.169 -0.334 2.581 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.787 -1.408 2.256 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.376 0.384 3.684 1.00 0.94 H new ATOM 0 HD12 ILE A 152 9.736 1.490 3.989 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.714 0.492 2.516 1.00 0.94 H new ATOM 2364 N GLN A 153 14.549 -0.526 5.427 1.00 0.77 N ATOM 2365 CA GLN A 153 16.027 -0.376 5.316 1.00 0.80 C ATOM 2366 C GLN A 153 16.695 -1.723 5.606 1.00 0.81 C ATOM 2367 O GLN A 153 17.592 -2.138 4.899 1.00 0.82 O ATOM 2368 CB GLN A 153 16.507 0.679 6.317 1.00 0.82 C ATOM 2369 CG GLN A 153 17.917 1.153 5.957 1.00 1.09 C ATOM 2370 CD GLN A 153 18.317 2.283 6.909 1.00 1.98 C ATOM 2371 OE1 GLN A 153 19.298 2.176 7.620 1.00 2.66 O ATOM 2372 NE2 GLN A 153 17.595 3.369 6.957 1.00 2.77 N ATOM 0 H GLN A 153 14.095 0.132 6.060 1.00 0.77 H new ATOM 0 HA GLN A 153 16.293 -0.056 4.309 1.00 0.80 H new ATOM 0 HB2 GLN A 153 15.821 1.526 6.319 1.00 0.82 H new ATOM 0 HB3 GLN A 153 16.502 0.263 7.324 1.00 0.82 H new ATOM 0 HG2 GLN A 153 18.624 0.327 6.034 1.00 1.09 H new ATOM 0 HG3 GLN A 153 17.946 1.502 4.925 1.00 1.09 H new ATOM 0 HE21 GLN A 153 16.772 3.461 6.362 1.00 2.77 H new ATOM 0 HE22 GLN A 153 17.854 4.126 7.590 1.00 2.77 H new ATOM 2381 N ASP A 154 16.281 -2.411 6.633 1.00 0.83 N ATOM 2382 CA ASP A 154 16.924 -3.722 6.933 1.00 0.86 C ATOM 2383 C ASP A 154 16.698 -4.672 5.753 1.00 0.85 C ATOM 2384 O ASP A 154 17.447 -5.605 5.541 1.00 0.94 O ATOM 2385 CB ASP A 154 16.320 -4.318 8.205 1.00 0.90 C ATOM 2386 CG ASP A 154 16.610 -3.395 9.391 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.548 -2.191 9.208 1.00 1.84 O ATOM 2388 OD2 ASP A 154 16.887 -3.909 10.462 1.00 1.99 O ATOM 0 H ASP A 154 15.536 -2.129 7.270 1.00 0.83 H new ATOM 0 HA ASP A 154 17.994 -3.579 7.086 1.00 0.86 H new ATOM 0 HB2 ASP A 154 15.244 -4.445 8.084 1.00 0.90 H new ATOM 0 HB3 ASP A 154 16.739 -5.307 8.390 1.00 0.90 H new ATOM 2393 N GLN A 155 15.674 -4.433 4.977 1.00 0.79 N ATOM 2394 CA GLN A 155 15.394 -5.307 3.800 1.00 0.79 C ATOM 2395 C GLN A 155 16.465 -5.078 2.726 1.00 0.72 C ATOM 2396 O GLN A 155 17.047 -6.011 2.210 1.00 1.03 O ATOM 2397 CB GLN A 155 14.004 -4.960 3.236 1.00 0.90 C ATOM 2398 CG GLN A 155 13.400 -6.181 2.531 1.00 1.37 C ATOM 2399 CD GLN A 155 14.358 -6.674 1.444 1.00 2.01 C ATOM 2400 OE1 GLN A 155 14.697 -7.840 1.400 1.00 2.72 O ATOM 2401 NE2 GLN A 155 14.811 -5.829 0.559 1.00 2.54 N ATOM 0 H GLN A 155 15.016 -3.665 5.109 1.00 0.79 H new ATOM 0 HA GLN A 155 15.413 -6.354 4.103 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.347 -4.634 4.042 1.00 0.90 H new ATOM 0 HB3 GLN A 155 14.085 -4.129 2.535 1.00 0.90 H new ATOM 0 HG2 GLN A 155 13.214 -6.976 3.254 1.00 1.37 H new ATOM 0 HG3 GLN A 155 12.438 -5.920 2.090 1.00 1.37 H new ATOM 0 HE21 GLN A 155 14.526 -4.850 0.596 1.00 2.54 H new ATOM 0 HE22 GLN A 155 15.450 -6.147 -0.170 1.00 2.54 H new ATOM 2410 N GLY A 156 16.737 -3.836 2.402 1.00 0.63 N ATOM 2411 CA GLY A 156 17.783 -3.518 1.376 1.00 0.72 C ATOM 2412 C GLY A 156 17.207 -2.606 0.286 1.00 0.87 C ATOM 2413 O GLY A 156 17.877 -2.302 -0.681 1.00 1.38 O ATOM 0 H GLY A 156 16.275 -3.022 2.808 1.00 0.63 H new ATOM 0 HA2 GLY A 156 18.633 -3.031 1.854 1.00 0.72 H new ATOM 0 HA3 GLY A 156 18.154 -4.440 0.928 1.00 0.72 H new ATOM 2417 N GLY A 157 15.982 -2.153 0.435 1.00 0.81 N ATOM 2418 CA GLY A 157 15.373 -1.240 -0.595 1.00 1.10 C ATOM 2419 C GLY A 157 14.108 -1.871 -1.189 1.00 0.84 C ATOM 2420 O GLY A 157 13.803 -3.025 -0.965 1.00 0.88 O ATOM 0 H GLY A 157 15.376 -2.375 1.225 1.00 0.81 H new ATOM 0 HA2 GLY A 157 15.129 -0.280 -0.140 1.00 1.10 H new ATOM 0 HA3 GLY A 157 16.095 -1.043 -1.387 1.00 1.10 H new ATOM 2424 N TRP A 158 13.366 -1.094 -1.939 1.00 0.67 N ATOM 2425 CA TRP A 158 12.102 -1.598 -2.556 1.00 0.50 C ATOM 2426 C TRP A 158 12.381 -2.813 -3.444 1.00 0.51 C ATOM 2427 O TRP A 158 11.465 -3.503 -3.861 1.00 0.53 O ATOM 2428 CB TRP A 158 11.469 -0.493 -3.405 1.00 0.51 C ATOM 2429 CG TRP A 158 11.088 0.667 -2.541 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.698 1.874 -2.548 1.00 0.59 C ATOM 2431 CD2 TRP A 158 10.019 0.755 -1.556 1.00 0.46 C ATOM 2432 NE1 TRP A 158 11.070 2.697 -1.632 1.00 0.55 N ATOM 2433 CE2 TRP A 158 10.030 2.052 -0.992 1.00 0.47 C ATOM 2434 CE3 TRP A 158 9.051 -0.157 -1.100 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 9.112 2.432 -0.012 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 8.126 0.221 -0.114 1.00 0.84 C ATOM 2437 CH2 TRP A 158 8.156 1.513 0.429 1.00 0.78 C ATOM 0 H TRP A 158 13.586 -0.121 -2.152 1.00 0.67 H new ATOM 0 HA TRP A 158 11.422 -1.892 -1.757 1.00 0.50 H new ATOM 0 HB2 TRP A 158 12.170 -0.168 -4.174 1.00 0.51 H new ATOM 0 HB3 TRP A 158 10.588 -0.878 -3.919 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.538 2.150 -3.168 1.00 0.59 H new ATOM 0 HE1 TRP A 158 11.342 3.663 -1.451 1.00 0.55 H new ATOM 0 HE3 TRP A 158 9.019 -1.155 -1.511 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 9.140 3.429 0.403 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 7.387 -0.488 0.228 1.00 0.84 H new ATOM 0 HH2 TRP A 158 7.441 1.798 1.187 1.00 0.78 H new ATOM 2448 N ASP A 159 13.612 -3.099 -3.754 1.00 0.50 N ATOM 2449 CA ASP A 159 13.871 -4.279 -4.621 1.00 0.51 C ATOM 2450 C ASP A 159 13.305 -5.520 -3.932 1.00 0.51 C ATOM 2451 O ASP A 159 12.848 -6.445 -4.573 1.00 0.51 O ATOM 2452 CB ASP A 159 15.377 -4.438 -4.840 1.00 0.54 C ATOM 2453 CG ASP A 159 15.927 -3.192 -5.537 1.00 1.66 C ATOM 2454 OD1 ASP A 159 15.598 -2.101 -5.101 1.00 2.46 O ATOM 2455 OD2 ASP A 159 16.667 -3.350 -6.494 1.00 2.37 O ATOM 0 H ASP A 159 14.436 -2.579 -3.452 1.00 0.50 H new ATOM 0 HA ASP A 159 13.392 -4.146 -5.591 1.00 0.51 H new ATOM 0 HB2 ASP A 159 15.880 -4.585 -3.884 1.00 0.54 H new ATOM 0 HB3 ASP A 159 15.576 -5.323 -5.444 1.00 0.54 H new ATOM 2460 N GLY A 160 13.314 -5.536 -2.625 1.00 0.52 N ATOM 2461 CA GLY A 160 12.758 -6.707 -1.891 1.00 0.54 C ATOM 2462 C GLY A 160 11.281 -6.852 -2.257 1.00 0.53 C ATOM 2463 O GLY A 160 10.750 -7.944 -2.315 1.00 0.54 O ATOM 0 H GLY A 160 13.682 -4.789 -2.036 1.00 0.52 H new ATOM 0 HA2 GLY A 160 13.304 -7.613 -2.154 1.00 0.54 H new ATOM 0 HA3 GLY A 160 12.870 -6.568 -0.816 1.00 0.54 H new ATOM 2467 N LEU A 161 10.618 -5.761 -2.526 1.00 0.54 N ATOM 2468 CA LEU A 161 9.184 -5.842 -2.911 1.00 0.56 C ATOM 2469 C LEU A 161 9.076 -6.694 -4.177 1.00 0.56 C ATOM 2470 O LEU A 161 8.265 -7.593 -4.279 1.00 0.62 O ATOM 2471 CB LEU A 161 8.649 -4.418 -3.196 1.00 0.58 C ATOM 2472 CG LEU A 161 7.169 -4.323 -2.776 1.00 0.74 C ATOM 2473 CD1 LEU A 161 6.637 -2.917 -3.049 1.00 1.63 C ATOM 2474 CD2 LEU A 161 6.340 -5.339 -3.569 1.00 1.56 C ATOM 0 H LEU A 161 11.008 -4.819 -2.495 1.00 0.54 H new ATOM 0 HA LEU A 161 8.599 -6.288 -2.107 1.00 0.56 H new ATOM 0 HB2 LEU A 161 9.239 -3.682 -2.651 1.00 0.58 H new ATOM 0 HB3 LEU A 161 8.751 -4.186 -4.256 1.00 0.58 H new ATOM 0 HG LEU A 161 7.091 -4.538 -1.710 1.00 0.74 H new ATOM 0 HD11 LEU A 161 5.591 -2.859 -2.749 1.00 1.63 H new ATOM 0 HD12 LEU A 161 7.218 -2.191 -2.480 1.00 1.63 H new ATOM 0 HD13 LEU A 161 6.722 -2.696 -4.113 1.00 1.63 H new ATOM 0 HD21 LEU A 161 5.294 -5.269 -3.269 1.00 1.56 H new ATOM 0 HD22 LEU A 161 6.427 -5.127 -4.635 1.00 1.56 H new ATOM 0 HD23 LEU A 161 6.708 -6.345 -3.368 1.00 1.56 H new ATOM 2486 N LEU A 162 9.909 -6.399 -5.144 1.00 0.53 N ATOM 2487 CA LEU A 162 9.897 -7.164 -6.427 1.00 0.56 C ATOM 2488 C LEU A 162 10.517 -8.551 -6.194 1.00 0.55 C ATOM 2489 O LEU A 162 10.097 -9.528 -6.782 1.00 0.57 O ATOM 2490 CB LEU A 162 10.716 -6.385 -7.493 1.00 0.61 C ATOM 2491 CG LEU A 162 9.834 -5.937 -8.668 1.00 0.80 C ATOM 2492 CD1 LEU A 162 10.600 -4.913 -9.514 1.00 1.56 C ATOM 2493 CD2 LEU A 162 9.486 -7.142 -9.550 1.00 1.33 C ATOM 0 H LEU A 162 10.603 -5.653 -5.098 1.00 0.53 H new ATOM 0 HA LEU A 162 8.873 -7.285 -6.781 1.00 0.56 H new ATOM 0 HB2 LEU A 162 11.178 -5.513 -7.031 1.00 0.61 H new ATOM 0 HB3 LEU A 162 11.524 -7.015 -7.864 1.00 0.61 H new ATOM 0 HG LEU A 162 8.918 -5.494 -8.277 1.00 0.80 H new ATOM 0 HD11 LEU A 162 9.977 -4.592 -10.349 1.00 1.56 H new ATOM 0 HD12 LEU A 162 10.854 -4.050 -8.899 1.00 1.56 H new ATOM 0 HD13 LEU A 162 11.514 -5.368 -9.896 1.00 1.56 H new ATOM 0 HD21 LEU A 162 8.860 -6.816 -10.381 1.00 1.33 H new ATOM 0 HD22 LEU A 162 10.403 -7.586 -9.938 1.00 1.33 H new ATOM 0 HD23 LEU A 162 8.947 -7.882 -8.959 1.00 1.33 H new ATOM 2505 N SER A 163 11.515 -8.650 -5.365 1.00 0.54 N ATOM 2506 CA SER A 163 12.146 -9.980 -5.136 1.00 0.56 C ATOM 2507 C SER A 163 11.088 -10.993 -4.683 1.00 0.53 C ATOM 2508 O SER A 163 11.221 -12.182 -4.896 1.00 0.60 O ATOM 2509 CB SER A 163 13.217 -9.852 -4.054 1.00 0.63 C ATOM 2510 OG SER A 163 13.994 -11.041 -4.024 1.00 1.32 O ATOM 0 H SER A 163 11.920 -7.876 -4.839 1.00 0.54 H new ATOM 0 HA SER A 163 12.597 -10.326 -6.066 1.00 0.56 H new ATOM 0 HB2 SER A 163 13.855 -8.991 -4.256 1.00 0.63 H new ATOM 0 HB3 SER A 163 12.752 -9.683 -3.083 1.00 0.63 H new ATOM 0 HG SER A 163 14.684 -10.964 -3.332 1.00 1.32 H new ATOM 2516 N TYR A 164 10.043 -10.529 -4.047 1.00 0.59 N ATOM 2517 CA TYR A 164 8.977 -11.457 -3.560 1.00 0.64 C ATOM 2518 C TYR A 164 7.972 -11.731 -4.680 1.00 0.63 C ATOM 2519 O TYR A 164 7.394 -12.797 -4.760 1.00 0.68 O ATOM 2520 CB TYR A 164 8.249 -10.808 -2.377 1.00 0.69 C ATOM 2521 CG TYR A 164 7.207 -11.757 -1.828 1.00 0.72 C ATOM 2522 CD1 TYR A 164 7.578 -12.748 -0.910 1.00 1.34 C ATOM 2523 CD2 TYR A 164 5.870 -11.643 -2.231 1.00 1.50 C ATOM 2524 CE1 TYR A 164 6.613 -13.624 -0.397 1.00 1.35 C ATOM 2525 CE2 TYR A 164 4.906 -12.519 -1.717 1.00 1.57 C ATOM 2526 CZ TYR A 164 5.277 -13.510 -0.800 1.00 0.87 C ATOM 2527 OH TYR A 164 4.327 -14.373 -0.293 1.00 0.97 O ATOM 0 H TYR A 164 9.881 -9.543 -3.843 1.00 0.59 H new ATOM 0 HA TYR A 164 9.432 -12.397 -3.249 1.00 0.64 H new ATOM 0 HB2 TYR A 164 8.965 -10.549 -1.597 1.00 0.69 H new ATOM 0 HB3 TYR A 164 7.775 -9.879 -2.696 1.00 0.69 H new ATOM 0 HD1 TYR A 164 8.608 -12.837 -0.598 1.00 1.34 H new ATOM 0 HD2 TYR A 164 5.583 -10.879 -2.938 1.00 1.50 H new ATOM 0 HE1 TYR A 164 6.900 -14.388 0.310 1.00 1.35 H new ATOM 0 HE2 TYR A 164 3.876 -12.430 -2.028 1.00 1.57 H new ATOM 0 HH TYR A 164 3.451 -14.156 -0.675 1.00 0.97 H new ATOM 2537 N PHE A 165 7.746 -10.774 -5.536 1.00 0.64 N ATOM 2538 CA PHE A 165 6.764 -10.981 -6.637 1.00 0.72 C ATOM 2539 C PHE A 165 7.313 -11.989 -7.653 1.00 0.82 C ATOM 2540 O PHE A 165 6.772 -12.147 -8.729 1.00 1.56 O ATOM 2541 CB PHE A 165 6.486 -9.634 -7.341 1.00 0.74 C ATOM 2542 CG PHE A 165 5.214 -9.009 -6.800 1.00 0.84 C ATOM 2543 CD1 PHE A 165 3.990 -9.665 -6.977 1.00 1.65 C ATOM 2544 CD2 PHE A 165 5.258 -7.779 -6.129 1.00 1.42 C ATOM 2545 CE1 PHE A 165 2.811 -9.094 -6.485 1.00 1.96 C ATOM 2546 CE2 PHE A 165 4.077 -7.208 -5.638 1.00 1.71 C ATOM 2547 CZ PHE A 165 2.855 -7.866 -5.816 1.00 1.66 C ATOM 0 H PHE A 165 8.197 -9.859 -5.521 1.00 0.64 H new ATOM 0 HA PHE A 165 5.837 -11.372 -6.217 1.00 0.72 H new ATOM 0 HB2 PHE A 165 7.326 -8.956 -7.188 1.00 0.74 H new ATOM 0 HB3 PHE A 165 6.394 -9.790 -8.416 1.00 0.74 H new ATOM 0 HD1 PHE A 165 3.956 -10.613 -7.494 1.00 1.65 H new ATOM 0 HD2 PHE A 165 6.202 -7.272 -5.991 1.00 1.42 H new ATOM 0 HE1 PHE A 165 1.867 -9.601 -6.622 1.00 1.96 H new ATOM 0 HE2 PHE A 165 4.110 -6.260 -5.122 1.00 1.71 H new ATOM 0 HZ PHE A 165 1.945 -7.425 -5.437 1.00 1.66 H new ATOM 2557 N GLY A 166 8.371 -12.684 -7.327 1.00 0.94 N ATOM 2558 CA GLY A 166 8.926 -13.687 -8.284 1.00 1.01 C ATOM 2559 C GLY A 166 8.295 -15.044 -7.984 1.00 1.23 C ATOM 2560 O GLY A 166 8.763 -16.073 -8.429 1.00 1.85 O ATOM 0 H GLY A 166 8.873 -12.601 -6.443 1.00 0.94 H new ATOM 0 HA2 GLY A 166 8.713 -13.389 -9.311 1.00 1.01 H new ATOM 0 HA3 GLY A 166 10.010 -13.744 -8.187 1.00 1.01 H new ATOM 2564 N THR A 167 7.236 -15.052 -7.222 1.00 1.51 N ATOM 2565 CA THR A 167 6.574 -16.339 -6.881 1.00 2.01 C ATOM 2566 C THR A 167 6.107 -17.026 -8.182 1.00 1.65 C ATOM 2567 O THR A 167 5.689 -16.345 -9.098 1.00 2.06 O ATOM 2568 CB THR A 167 5.360 -16.060 -5.991 1.00 3.10 C ATOM 2569 OG1 THR A 167 4.573 -17.238 -5.885 1.00 3.65 O ATOM 2570 CG2 THR A 167 4.520 -14.937 -6.604 1.00 3.92 C ATOM 0 H THR A 167 6.801 -14.221 -6.821 1.00 1.51 H new ATOM 0 HA THR A 167 7.273 -16.987 -6.353 1.00 2.01 H new ATOM 0 HB THR A 167 5.698 -15.757 -5.000 1.00 3.10 H new ATOM 0 HG1 THR A 167 3.764 -17.141 -6.429 1.00 3.65 H new ATOM 0 HG21 THR A 167 3.656 -14.740 -5.969 1.00 3.92 H new ATOM 0 HG22 THR A 167 5.124 -14.033 -6.685 1.00 3.92 H new ATOM 0 HG23 THR A 167 4.180 -15.236 -7.595 1.00 3.92 H new ATOM 2578 N PRO A 168 6.172 -18.346 -8.247 1.00 1.84 N ATOM 2579 CA PRO A 168 5.732 -19.070 -9.457 1.00 2.36 C ATOM 2580 C PRO A 168 4.252 -18.768 -9.743 1.00 1.79 C ATOM 2581 O PRO A 168 3.919 -18.077 -10.685 1.00 2.00 O ATOM 2582 CB PRO A 168 5.944 -20.567 -9.128 1.00 3.35 C ATOM 2583 CG PRO A 168 6.452 -20.656 -7.661 1.00 3.48 C ATOM 2584 CD PRO A 168 6.676 -19.214 -7.158 1.00 2.53 C ATOM 0 HA PRO A 168 6.287 -18.774 -10.347 1.00 2.36 H new ATOM 0 HB2 PRO A 168 5.013 -21.121 -9.245 1.00 3.35 H new ATOM 0 HB3 PRO A 168 6.667 -21.011 -9.812 1.00 3.35 H new ATOM 0 HG2 PRO A 168 5.725 -21.172 -7.034 1.00 3.48 H new ATOM 0 HG3 PRO A 168 7.379 -21.228 -7.610 1.00 3.48 H new ATOM 0 HD2 PRO A 168 6.138 -19.032 -6.228 1.00 2.53 H new ATOM 0 HD3 PRO A 168 7.731 -19.025 -6.959 1.00 2.53 H new ATOM 2592 N THR A 169 3.366 -19.292 -8.939 1.00 1.73 N ATOM 2593 CA THR A 169 1.911 -19.049 -9.164 1.00 1.33 C ATOM 2594 C THR A 169 1.530 -17.660 -8.647 1.00 1.05 C ATOM 2595 O THR A 169 1.845 -17.292 -7.533 1.00 1.06 O ATOM 2596 CB THR A 169 1.101 -20.110 -8.415 1.00 1.53 C ATOM 2597 OG1 THR A 169 1.536 -21.402 -8.814 1.00 1.94 O ATOM 2598 CG2 THR A 169 -0.384 -19.946 -8.741 1.00 2.40 C ATOM 0 H THR A 169 3.587 -19.879 -8.135 1.00 1.73 H new ATOM 0 HA THR A 169 1.696 -19.105 -10.231 1.00 1.33 H new ATOM 0 HB THR A 169 1.249 -19.991 -7.342 1.00 1.53 H new ATOM 0 HG1 THR A 169 1.020 -22.083 -8.335 1.00 1.94 H new ATOM 0 HG21 THR A 169 -0.959 -20.702 -8.207 1.00 2.40 H new ATOM 0 HG22 THR A 169 -0.716 -18.954 -8.435 1.00 2.40 H new ATOM 0 HG23 THR A 169 -0.536 -20.065 -9.814 1.00 2.40 H new ATOM 2606 N TRP A 170 0.848 -16.885 -9.451 1.00 1.04 N ATOM 2607 CA TRP A 170 0.438 -15.517 -9.012 1.00 1.01 C ATOM 2608 C TRP A 170 -0.961 -15.576 -8.393 1.00 0.92 C ATOM 2609 O TRP A 170 -1.314 -14.767 -7.557 1.00 0.95 O ATOM 2610 CB TRP A 170 0.420 -14.579 -10.222 1.00 1.32 C ATOM 2611 CG TRP A 170 -0.408 -15.181 -11.311 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -1.757 -15.123 -11.383 1.00 2.30 C ATOM 2613 CD2 TRP A 170 0.034 -15.925 -12.483 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -2.173 -15.786 -12.524 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -1.105 -16.298 -13.235 1.00 3.15 C ATOM 2616 CE3 TRP A 170 1.299 -16.311 -12.961 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -0.993 -17.026 -14.420 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 1.416 -17.044 -14.153 1.00 4.37 C ATOM 2619 CH2 TRP A 170 0.272 -17.401 -14.881 1.00 4.64 C ATOM 0 H TRP A 170 0.557 -17.141 -10.394 1.00 1.04 H new ATOM 0 HA TRP A 170 1.147 -15.145 -8.272 1.00 1.01 H new ATOM 0 HB2 TRP A 170 0.014 -13.609 -9.937 1.00 1.32 H new ATOM 0 HB3 TRP A 170 1.436 -14.407 -10.577 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -2.404 -14.638 -10.667 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -3.148 -15.885 -12.806 1.00 3.04 H new ATOM 0 HE3 TRP A 170 2.187 -16.042 -12.408 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -1.877 -17.298 -14.977 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 2.393 -17.334 -14.511 1.00 4.37 H new ATOM 0 HH2 TRP A 170 0.368 -17.965 -15.797 1.00 4.64 H new ATOM 2630 N GLN A 171 -1.764 -16.526 -8.793 1.00 0.88 N ATOM 2631 CA GLN A 171 -3.136 -16.624 -8.219 1.00 0.84 C ATOM 2632 C GLN A 171 -3.040 -16.762 -6.697 1.00 0.75 C ATOM 2633 O GLN A 171 -3.923 -16.336 -5.983 1.00 0.75 O ATOM 2634 CB GLN A 171 -3.868 -17.834 -8.807 1.00 0.88 C ATOM 2635 CG GLN A 171 -3.927 -17.711 -10.331 1.00 1.57 C ATOM 2636 CD GLN A 171 -4.796 -18.836 -10.899 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -5.966 -18.931 -10.587 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -4.269 -19.698 -11.726 1.00 2.34 N ATOM 0 H GLN A 171 -1.530 -17.234 -9.489 1.00 0.88 H new ATOM 0 HA GLN A 171 -3.695 -15.722 -8.468 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -3.354 -18.753 -8.526 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -4.877 -17.895 -8.398 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -4.338 -16.742 -10.613 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -2.922 -17.766 -10.750 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -3.286 -19.618 -11.988 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -4.840 -20.451 -12.110 1.00 2.34 H new ATOM 2647 N THR A 172 -1.971 -17.309 -6.184 1.00 0.67 N ATOM 2648 CA THR A 172 -1.846 -17.410 -4.699 1.00 0.60 C ATOM 2649 C THR A 172 -1.873 -15.985 -4.136 1.00 0.59 C ATOM 2650 O THR A 172 -2.660 -15.667 -3.268 1.00 0.74 O ATOM 2651 CB THR A 172 -0.515 -18.096 -4.340 1.00 0.59 C ATOM 2652 OG1 THR A 172 0.460 -17.770 -5.320 1.00 0.81 O ATOM 2653 CG2 THR A 172 -0.703 -19.616 -4.298 1.00 0.92 C ATOM 0 H THR A 172 -1.188 -17.686 -6.719 1.00 0.67 H new ATOM 0 HA THR A 172 -2.661 -17.999 -4.279 1.00 0.60 H new ATOM 0 HB THR A 172 -0.186 -17.749 -3.360 1.00 0.59 H new ATOM 0 HG1 THR A 172 1.309 -18.204 -5.094 1.00 0.81 H new ATOM 0 HG21 THR A 172 0.244 -20.093 -4.043 1.00 0.92 H new ATOM 0 HG22 THR A 172 -1.451 -19.870 -3.547 1.00 0.92 H new ATOM 0 HG23 THR A 172 -1.036 -19.969 -5.274 1.00 0.92 H new ATOM 2661 N VAL A 173 -1.014 -15.128 -4.610 1.00 0.59 N ATOM 2662 CA VAL A 173 -0.990 -13.733 -4.087 1.00 0.58 C ATOM 2663 C VAL A 173 -2.403 -13.138 -4.122 1.00 0.57 C ATOM 2664 O VAL A 173 -2.749 -12.303 -3.310 1.00 0.60 O ATOM 2665 CB VAL A 173 -0.046 -12.890 -4.953 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -0.169 -11.410 -4.577 1.00 1.13 C ATOM 2667 CG2 VAL A 173 1.394 -13.355 -4.721 1.00 1.01 C ATOM 0 H VAL A 173 -0.328 -15.332 -5.336 1.00 0.59 H new ATOM 0 HA VAL A 173 -0.636 -13.735 -3.056 1.00 0.58 H new ATOM 0 HB VAL A 173 -0.313 -13.013 -6.003 1.00 0.64 H new ATOM 0 HG11 VAL A 173 0.505 -10.820 -5.197 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -1.195 -11.078 -4.738 1.00 1.13 H new ATOM 0 HG13 VAL A 173 0.095 -11.278 -3.528 1.00 1.13 H new ATOM 0 HG21 VAL A 173 2.072 -12.760 -5.334 1.00 1.01 H new ATOM 0 HG22 VAL A 173 1.652 -13.230 -3.669 1.00 1.01 H new ATOM 0 HG23 VAL A 173 1.486 -14.406 -4.995 1.00 1.01 H new ATOM 2677 N THR A 174 -3.222 -13.551 -5.050 1.00 0.55 N ATOM 2678 CA THR A 174 -4.605 -12.992 -5.123 1.00 0.56 C ATOM 2679 C THR A 174 -5.429 -13.476 -3.924 1.00 0.53 C ATOM 2680 O THR A 174 -6.126 -12.705 -3.295 1.00 0.55 O ATOM 2681 CB THR A 174 -5.272 -13.460 -6.420 1.00 0.59 C ATOM 2682 OG1 THR A 174 -4.418 -13.172 -7.519 1.00 1.37 O ATOM 2683 CG2 THR A 174 -6.605 -12.734 -6.604 1.00 1.27 C ATOM 0 H THR A 174 -2.996 -14.249 -5.759 1.00 0.55 H new ATOM 0 HA THR A 174 -4.554 -11.903 -5.106 1.00 0.56 H new ATOM 0 HB THR A 174 -5.452 -14.534 -6.369 1.00 0.59 H new ATOM 0 HG1 THR A 174 -4.907 -12.643 -8.184 1.00 1.37 H new ATOM 0 HG21 THR A 174 -7.077 -13.069 -7.528 1.00 1.27 H new ATOM 0 HG22 THR A 174 -7.259 -12.955 -5.761 1.00 1.27 H new ATOM 0 HG23 THR A 174 -6.430 -11.659 -6.655 1.00 1.27 H new ATOM 2691 N ILE A 175 -5.364 -14.739 -3.598 1.00 0.51 N ATOM 2692 CA ILE A 175 -6.158 -15.246 -2.436 1.00 0.50 C ATOM 2693 C ILE A 175 -5.428 -14.898 -1.135 1.00 0.49 C ATOM 2694 O ILE A 175 -6.017 -14.842 -0.073 1.00 0.49 O ATOM 2695 CB ILE A 175 -6.318 -16.769 -2.547 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -4.985 -17.399 -2.933 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -7.359 -17.099 -3.619 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -5.109 -18.922 -2.896 1.00 0.89 C ATOM 0 H ILE A 175 -4.800 -15.439 -4.081 1.00 0.51 H new ATOM 0 HA ILE A 175 -7.144 -14.781 -2.436 1.00 0.50 H new ATOM 0 HB ILE A 175 -6.644 -17.165 -1.585 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -4.692 -17.072 -3.931 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -4.204 -17.071 -2.247 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -7.471 -18.180 -3.696 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -8.316 -16.653 -3.346 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -7.033 -16.698 -4.579 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -4.155 -19.372 -3.172 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -5.382 -19.240 -1.890 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -5.878 -19.242 -3.599 1.00 0.89 H new ATOM 2710 N PHE A 176 -4.151 -14.650 -1.217 1.00 0.48 N ATOM 2711 CA PHE A 176 -3.368 -14.290 0.002 1.00 0.49 C ATOM 2712 C PHE A 176 -3.860 -12.933 0.530 1.00 0.49 C ATOM 2713 O PHE A 176 -4.410 -12.844 1.610 1.00 0.56 O ATOM 2714 CB PHE A 176 -1.876 -14.198 -0.390 1.00 0.51 C ATOM 2715 CG PHE A 176 -1.004 -14.683 0.753 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -0.927 -13.938 1.936 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -0.279 -15.877 0.630 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -0.127 -14.386 2.995 1.00 1.22 C ATOM 2719 CE2 PHE A 176 0.521 -16.323 1.688 1.00 1.52 C ATOM 2720 CZ PHE A 176 0.597 -15.577 2.871 1.00 0.76 C ATOM 0 H PHE A 176 -3.611 -14.681 -2.082 1.00 0.48 H new ATOM 0 HA PHE A 176 -3.498 -15.042 0.781 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -1.689 -14.798 -1.280 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -1.621 -13.168 -0.640 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -1.484 -13.018 2.032 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -0.338 -16.453 -0.282 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -0.069 -13.812 3.908 1.00 1.22 H new ATOM 0 HE2 PHE A 176 1.080 -17.242 1.592 1.00 1.52 H new ATOM 0 HZ PHE A 176 1.214 -15.921 3.688 1.00 0.76 H new ATOM 2730 N VAL A 177 -3.637 -11.875 -0.200 1.00 0.46 N ATOM 2731 CA VAL A 177 -4.064 -10.529 0.285 1.00 0.48 C ATOM 2732 C VAL A 177 -5.591 -10.443 0.354 1.00 0.44 C ATOM 2733 O VAL A 177 -6.141 -9.856 1.265 1.00 0.57 O ATOM 2734 CB VAL A 177 -3.539 -9.458 -0.674 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -2.019 -9.593 -0.813 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -4.195 -9.637 -2.046 1.00 1.24 C ATOM 0 H VAL A 177 -3.178 -11.883 -1.111 1.00 0.46 H new ATOM 0 HA VAL A 177 -3.658 -10.369 1.284 1.00 0.48 H new ATOM 0 HB VAL A 177 -3.780 -8.470 -0.281 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -1.647 -8.830 -1.496 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -1.552 -9.465 0.163 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -1.776 -10.581 -1.205 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -3.822 -8.875 -2.730 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -3.955 -10.625 -2.438 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -5.276 -9.539 -1.948 1.00 1.24 H new ATOM 2746 N ALA A 178 -6.284 -11.012 -0.589 1.00 0.45 N ATOM 2747 CA ALA A 178 -7.773 -10.942 -0.551 1.00 0.43 C ATOM 2748 C ALA A 178 -8.289 -11.614 0.725 1.00 0.40 C ATOM 2749 O ALA A 178 -9.042 -11.034 1.483 1.00 0.40 O ATOM 2750 CB ALA A 178 -8.351 -11.658 -1.772 1.00 0.46 C ATOM 0 H ALA A 178 -5.890 -11.520 -1.381 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.084 -9.897 -0.561 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -9.439 -11.606 -1.743 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -7.989 -11.177 -2.681 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -8.037 -12.702 -1.764 1.00 0.46 H new ATOM 2756 N GLY A 179 -7.898 -12.835 0.963 1.00 0.41 N ATOM 2757 CA GLY A 179 -8.374 -13.550 2.182 1.00 0.43 C ATOM 2758 C GLY A 179 -7.977 -12.775 3.441 1.00 0.43 C ATOM 2759 O GLY A 179 -8.726 -12.700 4.396 1.00 0.48 O ATOM 0 H GLY A 179 -7.268 -13.370 0.365 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -9.457 -13.666 2.144 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -7.947 -14.552 2.214 1.00 0.43 H new ATOM 2763 N VAL A 180 -6.800 -12.214 3.463 1.00 0.42 N ATOM 2764 CA VAL A 180 -6.357 -11.470 4.673 1.00 0.45 C ATOM 2765 C VAL A 180 -7.094 -10.131 4.792 1.00 0.45 C ATOM 2766 O VAL A 180 -7.394 -9.668 5.877 1.00 0.43 O ATOM 2767 CB VAL A 180 -4.844 -11.223 4.604 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -4.407 -10.317 5.761 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -4.103 -12.559 4.705 1.00 1.41 C ATOM 0 H VAL A 180 -6.127 -12.239 2.697 1.00 0.42 H new ATOM 0 HA VAL A 180 -6.591 -12.071 5.552 1.00 0.45 H new ATOM 0 HB VAL A 180 -4.607 -10.739 3.657 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -3.332 -10.147 5.704 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -4.929 -9.363 5.693 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -4.649 -10.796 6.710 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -3.028 -12.384 4.656 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -4.349 -13.041 5.651 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -4.403 -13.205 3.880 1.00 1.41 H new ATOM 2779 N LEU A 181 -7.383 -9.495 3.686 1.00 0.49 N ATOM 2780 CA LEU A 181 -8.086 -8.183 3.756 1.00 0.50 C ATOM 2781 C LEU A 181 -9.486 -8.385 4.331 1.00 0.49 C ATOM 2782 O LEU A 181 -9.989 -7.578 5.086 1.00 0.51 O ATOM 2783 CB LEU A 181 -8.207 -7.588 2.346 1.00 0.56 C ATOM 2784 CG LEU A 181 -6.858 -7.004 1.893 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -6.813 -6.938 0.363 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -6.675 -5.584 2.453 1.00 1.20 C ATOM 0 H LEU A 181 -7.164 -9.825 2.746 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.518 -7.506 4.394 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -8.531 -8.358 1.646 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.969 -6.809 2.337 1.00 0.56 H new ATOM 0 HG LEU A 181 -6.060 -7.647 2.265 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -5.856 -6.524 0.045 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -6.929 -7.941 -0.048 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -7.622 -6.302 0.002 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -5.716 -5.184 2.124 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -7.479 -4.943 2.090 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -6.700 -5.616 3.542 1.00 1.20 H new ATOM 2798 N THR A 182 -10.112 -9.470 3.968 1.00 0.49 N ATOM 2799 CA THR A 182 -11.480 -9.748 4.473 1.00 0.51 C ATOM 2800 C THR A 182 -11.422 -9.977 5.977 1.00 0.48 C ATOM 2801 O THR A 182 -12.333 -9.637 6.704 1.00 0.51 O ATOM 2802 CB THR A 182 -12.044 -10.987 3.780 1.00 0.54 C ATOM 2803 OG1 THR A 182 -11.104 -12.049 3.866 1.00 1.16 O ATOM 2804 CG2 THR A 182 -12.316 -10.658 2.315 1.00 1.07 C ATOM 0 H THR A 182 -9.731 -10.178 3.340 1.00 0.49 H new ATOM 0 HA THR A 182 -12.128 -8.898 4.260 1.00 0.51 H new ATOM 0 HB THR A 182 -12.972 -11.291 4.265 1.00 0.54 H new ATOM 0 HG1 THR A 182 -10.269 -11.716 4.255 1.00 1.16 H new ATOM 0 HG21 THR A 182 -12.719 -11.538 1.813 1.00 1.07 H new ATOM 0 HG22 THR A 182 -13.037 -9.843 2.253 1.00 1.07 H new ATOM 0 HG23 THR A 182 -11.387 -10.358 1.831 1.00 1.07 H new ATOM 2812 N ALA A 183 -10.356 -10.559 6.452 1.00 0.45 N ATOM 2813 CA ALA A 183 -10.254 -10.811 7.912 1.00 0.44 C ATOM 2814 C ALA A 183 -10.418 -9.480 8.646 1.00 0.44 C ATOM 2815 O ALA A 183 -11.143 -9.372 9.614 1.00 0.50 O ATOM 2816 CB ALA A 183 -8.890 -11.423 8.232 1.00 0.46 C ATOM 0 H ALA A 183 -9.559 -10.868 5.896 1.00 0.45 H new ATOM 0 HA ALA A 183 -11.031 -11.506 8.231 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -8.816 -11.607 9.304 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -8.778 -12.364 7.693 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -8.102 -10.735 7.927 1.00 0.46 H new ATOM 2822 N SER A 184 -9.747 -8.459 8.174 1.00 0.47 N ATOM 2823 CA SER A 184 -9.845 -7.109 8.811 1.00 0.51 C ATOM 2824 C SER A 184 -11.303 -6.644 8.861 1.00 0.54 C ATOM 2825 O SER A 184 -11.785 -6.194 9.881 1.00 0.56 O ATOM 2826 CB SER A 184 -9.036 -6.112 7.981 1.00 0.62 C ATOM 2827 OG SER A 184 -9.324 -4.791 8.419 1.00 1.55 O ATOM 0 H SER A 184 -9.128 -8.504 7.365 1.00 0.47 H new ATOM 0 HA SER A 184 -9.457 -7.167 9.828 1.00 0.51 H new ATOM 0 HB2 SER A 184 -7.970 -6.317 8.083 1.00 0.62 H new ATOM 0 HB3 SER A 184 -9.281 -6.218 6.924 1.00 0.62 H new ATOM 0 HG SER A 184 -9.229 -4.169 7.668 1.00 1.55 H new ATOM 2833 N LEU A 185 -12.010 -6.752 7.774 1.00 0.58 N ATOM 2834 CA LEU A 185 -13.436 -6.322 7.764 1.00 0.69 C ATOM 2835 C LEU A 185 -14.277 -7.271 8.617 1.00 0.69 C ATOM 2836 O LEU A 185 -15.341 -6.935 9.098 1.00 0.79 O ATOM 2837 CB LEU A 185 -13.963 -6.394 6.309 1.00 0.71 C ATOM 2838 CG LEU A 185 -13.481 -5.197 5.433 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -13.629 -3.838 6.148 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -12.024 -5.410 5.016 1.00 1.18 C ATOM 0 H LEU A 185 -11.662 -7.120 6.889 1.00 0.58 H new ATOM 0 HA LEU A 185 -13.507 -5.309 8.161 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -13.633 -7.328 5.854 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -15.053 -6.413 6.322 1.00 0.71 H new ATOM 0 HG LEU A 185 -14.122 -5.167 4.552 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -13.278 -3.041 5.492 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -14.677 -3.669 6.396 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -13.036 -3.842 7.063 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -11.694 -4.570 4.404 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -11.397 -5.480 5.905 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -11.941 -6.332 4.441 1.00 1.18 H new ATOM 2852 N THR A 186 -13.796 -8.472 8.774 1.00 0.62 N ATOM 2853 CA THR A 186 -14.529 -9.501 9.557 1.00 0.68 C ATOM 2854 C THR A 186 -14.329 -9.308 11.055 1.00 0.62 C ATOM 2855 O THR A 186 -15.225 -9.587 11.827 1.00 0.64 O ATOM 2856 CB THR A 186 -14.016 -10.891 9.169 1.00 0.73 C ATOM 2857 OG1 THR A 186 -13.975 -11.000 7.754 1.00 0.89 O ATOM 2858 CG2 THR A 186 -14.954 -11.960 9.736 1.00 1.00 C ATOM 0 H THR A 186 -12.908 -8.788 8.384 1.00 0.62 H new ATOM 0 HA THR A 186 -15.591 -9.403 9.332 1.00 0.68 H new ATOM 0 HB THR A 186 -13.015 -11.035 9.575 1.00 0.73 H new ATOM 0 HG1 THR A 186 -13.082 -10.756 7.433 1.00 0.89 H new ATOM 0 HG21 THR A 186 -14.588 -12.949 9.459 1.00 1.00 H new ATOM 0 HG22 THR A 186 -14.987 -11.876 10.822 1.00 1.00 H new ATOM 0 HG23 THR A 186 -15.956 -11.817 9.331 1.00 1.00 H new ATOM 2866 N ILE A 187 -13.176 -8.866 11.506 1.00 0.64 N ATOM 2867 CA ILE A 187 -13.000 -8.722 12.989 1.00 0.66 C ATOM 2868 C ILE A 187 -13.578 -7.378 13.427 1.00 0.66 C ATOM 2869 O ILE A 187 -13.871 -7.187 14.591 1.00 0.75 O ATOM 2870 CB ILE A 187 -11.520 -8.830 13.361 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -10.725 -7.779 12.577 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -11.003 -10.225 13.000 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -9.264 -7.785 13.031 1.00 0.87 C ATOM 0 H ILE A 187 -12.373 -8.606 10.933 1.00 0.64 H new ATOM 0 HA ILE A 187 -13.530 -9.523 13.504 1.00 0.66 H new ATOM 0 HB ILE A 187 -11.400 -8.662 14.431 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -10.784 -7.988 11.509 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -11.159 -6.791 12.733 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -9.949 -10.302 13.265 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -11.571 -10.977 13.548 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -11.121 -10.391 11.929 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -8.705 -7.036 12.470 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -9.213 -7.554 14.095 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -8.831 -8.769 12.852 1.00 0.87 H new ATOM 2885 N TRP A 188 -13.740 -6.433 12.542 1.00 0.64 N ATOM 2886 CA TRP A 188 -14.290 -5.117 12.974 1.00 0.70 C ATOM 2887 C TRP A 188 -15.637 -5.342 13.674 1.00 0.81 C ATOM 2888 O TRP A 188 -15.745 -5.199 14.876 1.00 1.06 O ATOM 2889 CB TRP A 188 -14.472 -4.245 11.708 1.00 0.85 C ATOM 2890 CG TRP A 188 -14.089 -2.825 11.976 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -12.860 -2.301 11.764 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -14.915 -1.742 12.486 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -12.879 -0.965 12.117 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -14.124 -0.573 12.569 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -16.261 -1.664 12.883 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -14.650 0.633 13.030 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -16.794 -0.451 13.347 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -15.990 0.695 13.420 1.00 1.71 C ATOM 0 H TRP A 188 -13.518 -6.513 11.550 1.00 0.64 H new ATOM 0 HA TRP A 188 -13.619 -4.617 13.672 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -13.862 -4.643 10.897 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -15.510 -4.289 11.378 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -12.005 -2.838 11.382 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -12.072 -0.344 12.052 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -16.888 -2.542 12.831 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -14.026 1.513 13.085 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -17.830 -0.400 13.649 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -16.406 1.625 13.778 1.00 1.71 H new ATOM 2909 N LYS A 189 -16.661 -5.688 12.942 1.00 0.95 N ATOM 2910 CA LYS A 189 -17.981 -5.910 13.574 1.00 1.23 C ATOM 2911 C LYS A 189 -18.939 -6.515 12.538 1.00 1.53 C ATOM 2912 O LYS A 189 -18.624 -7.495 11.892 1.00 2.02 O ATOM 2913 CB LYS A 189 -18.524 -4.565 14.064 1.00 1.90 C ATOM 2914 CG LYS A 189 -19.642 -4.800 15.085 1.00 2.68 C ATOM 2915 CD LYS A 189 -20.374 -3.479 15.389 1.00 3.60 C ATOM 2916 CE LYS A 189 -19.665 -2.734 16.524 1.00 4.51 C ATOM 2917 NZ LYS A 189 -19.787 -3.524 17.782 1.00 5.09 N ATOM 0 H LYS A 189 -16.635 -5.825 11.932 1.00 0.95 H new ATOM 0 HA LYS A 189 -17.887 -6.594 14.417 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -17.722 -3.981 14.516 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -18.903 -3.986 13.222 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -20.348 -5.535 14.698 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -19.224 -5.212 16.004 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -20.401 -2.855 14.495 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -21.408 -3.683 15.667 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -18.614 -2.584 16.276 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -20.106 -1.746 16.657 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -19.809 -2.878 18.597 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -20.665 -4.081 17.758 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -18.972 -4.165 17.870 1.00 5.09 H new ATOM 2931 N LYS A 190 -20.101 -5.925 12.384 1.00 2.36 N ATOM 2932 CA LYS A 190 -21.121 -6.422 11.405 1.00 3.37 C ATOM 2933 C LYS A 190 -21.061 -7.947 11.276 1.00 3.71 C ATOM 2934 O LYS A 190 -20.573 -8.480 10.300 1.00 4.35 O ATOM 2935 CB LYS A 190 -20.878 -5.774 10.036 1.00 4.30 C ATOM 2936 CG LYS A 190 -21.086 -4.249 10.123 1.00 5.08 C ATOM 2937 CD LYS A 190 -22.573 -3.902 9.963 1.00 5.78 C ATOM 2938 CE LYS A 190 -22.757 -2.387 10.063 1.00 6.76 C ATOM 2939 NZ LYS A 190 -24.211 -2.063 10.044 1.00 7.40 N ATOM 0 H LYS A 190 -20.392 -5.100 12.909 1.00 2.36 H new ATOM 0 HA LYS A 190 -22.111 -6.150 11.770 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -19.865 -5.991 9.698 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -21.558 -6.199 9.298 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -20.721 -3.880 11.081 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -20.504 -3.751 9.347 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -22.940 -4.261 9.001 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -23.159 -4.402 10.734 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -22.302 -2.014 10.981 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -22.252 -1.893 9.233 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -24.338 -1.033 10.112 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -24.632 -2.406 9.157 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -24.680 -2.524 10.850 1.00 7.40 H new ATOM 2953 N MET A 191 -21.561 -8.651 12.254 1.00 3.81 N ATOM 2954 CA MET A 191 -21.542 -10.139 12.187 1.00 4.63 C ATOM 2955 C MET A 191 -22.542 -10.598 11.120 1.00 4.97 C ATOM 2956 O MET A 191 -22.243 -10.608 9.942 1.00 5.27 O ATOM 2957 CB MET A 191 -21.926 -10.715 13.559 1.00 5.48 C ATOM 2958 CG MET A 191 -22.958 -9.804 14.232 1.00 5.71 C ATOM 2959 SD MET A 191 -23.749 -10.693 15.595 1.00 7.00 S ATOM 2960 CE MET A 191 -24.159 -9.244 16.597 1.00 7.52 C ATOM 0 H MET A 191 -21.982 -8.260 13.097 1.00 3.81 H new ATOM 0 HA MET A 191 -20.545 -10.493 11.924 1.00 4.63 H new ATOM 0 HB2 MET A 191 -22.335 -11.719 13.441 1.00 5.48 H new ATOM 0 HB3 MET A 191 -21.040 -10.803 14.188 1.00 5.48 H new ATOM 0 HG2 MET A 191 -22.474 -8.901 14.605 1.00 5.71 H new ATOM 0 HG3 MET A 191 -23.707 -9.487 13.507 1.00 5.71 H new ATOM 0 HE1 MET A 191 -24.665 -9.563 17.508 1.00 7.52 H new ATOM 0 HE2 MET A 191 -23.244 -8.711 16.858 1.00 7.52 H new ATOM 0 HE3 MET A 191 -24.815 -8.583 16.030 1.00 7.52 H new ATOM 2970 N GLY A 192 -23.723 -10.981 11.519 1.00 5.37 N ATOM 2971 CA GLY A 192 -24.732 -11.440 10.522 1.00 6.15 C ATOM 2972 C GLY A 192 -25.067 -10.293 9.567 1.00 6.68 C ATOM 2973 O GLY A 192 -24.853 -10.458 8.377 1.00 7.01 O ATOM 2974 OXT GLY A 192 -25.532 -9.270 10.041 1.00 7.06 O ATOM 0 H GLY A 192 -24.033 -10.996 12.491 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -24.344 -12.291 9.962 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -25.634 -11.778 11.032 1.00 6.15 H new TER 2978 GLY A 192