USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1271 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 75 TYR OH : rot -100:sc= 0.535 USER MOD Set 1.2: A 139 ASN : amide:sc= 1.06 K(o=1.6,f=-0.6) USER MOD Set 2.1: A 43 ASN : amide:sc= 0.707 K(o=1.3,f=-0.074) USER MOD Set 2.2: A 113 ASN : amide:sc= 0.557 K(o=1.3,f=-4.3!) USER MOD Set 3.1: A 99 THR OG1 : rot 58:sc= 0.881 USER MOD Set 3.2: A 103 GLN : amide:sc= 0.747 K(o=1.6,f=-1.2) USER MOD Set 4.1: A 67 LYS NZ :NH3+ 165:sc= 0.916 (180deg=0) USER MOD Set 4.2: A 84 GLN : amide:sc= -0.875 K(o=0.041,f=-8!) USER MOD Set 5.1: A 31 ASN : amide:sc= 0 K(o=0.65,f=-1!) USER MOD Set 5.2: A 34 THR OG1 : rot 4:sc= 0.653 USER MOD Set 6.1: A 26 GLN : amide:sc= -0.0171 K(o=0.12,f=-2.1) USER MOD Set 6.2: A 36 GLN : amide:sc= 0.141 K(o=0.12,f=-2.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 136:sc= 1.35 (180deg=0.293) USER MOD Single : A 4 SER OG : rot -67:sc= 0.925 USER MOD Single : A 8 MET CE :methyl 174:sc=-0.00168 (180deg=-0.0928) USER MOD Single : A 9 LYS NZ :NH3+ -170:sc=-0.00324 (180deg=-0.105) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 172:sc= 0 (180deg=-0.0335) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.159 K(o=0.16,f=-3.1) USER MOD Single : A 24 ASN : amide:sc=-0.000192 K(o=-0.00019,f=-1.1) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.589 K(o=0.59,f=0) USER MOD Single : A 61 TYR OH : rot -41:sc= 1.35 USER MOD Single : A 64 LYS NZ :NH3+ -176:sc= -0.0406 (180deg=-0.109) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0921 USER MOD Single : A 71 LYS NZ :NH3+ -154:sc= -0.187 (180deg=-1.62!) USER MOD Single : A 72 THR OG1 : rot 32:sc= 0.247 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-2.6) USER MOD Single : A 78 ASN :FLIP amide:sc= -1.1 F(o=-2.1,f=-1.1) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.444 X(o=-0.44,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ -158:sc= 1.22 (180deg=0.55) USER MOD Single : A 101 THR OG1 : rot 177:sc= 2.24 USER MOD Single : A 106 GLN : amide:sc= -0.508 K(o=-0.51,f=-1.1) USER MOD Single : A 107 SER OG : rot -150:sc= 0 USER MOD Single : A 116 GLN :FLIP amide:sc= -0.104 F(o=-0.81,f=-0.1) USER MOD Single : A 119 HIS : no HE2:sc= 0.162 K(o=0.16,f=-1.8) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -173:sc= -0.582 (180deg=-0.654) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -160:sc= 0.617 (180deg=-0.118) USER MOD Single : A 137 CYS SG : rot 180:sc= -0.0927 USER MOD Single : A 138 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0209) USER MOD Single : A 144 THR OG1 : rot 85:sc= 0.825 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 150:sc= 0.076 (180deg=0.00587) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 158:sc= -0.0499 (180deg=-0.431) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.364 -3.777 11.016 1.00 2.11 N ATOM 2 CA MET A 1 -21.287 -3.795 10.003 1.00 1.24 C ATOM 3 C MET A 1 -21.593 -2.851 8.830 1.00 1.01 C ATOM 4 O MET A 1 -21.389 -3.231 7.682 1.00 0.96 O ATOM 5 CB MET A 1 -21.039 -5.228 9.487 1.00 1.12 C ATOM 6 CG MET A 1 -20.635 -6.211 10.589 1.00 1.78 C ATOM 7 SD MET A 1 -21.980 -6.816 11.646 1.00 2.48 S ATOM 8 CE MET A 1 -22.412 -8.344 10.768 1.00 3.46 C ATOM 0 H1 MET A 1 -22.576 -4.750 11.314 1.00 2.11 H new ATOM 0 H2 MET A 1 -22.057 -3.222 11.840 1.00 2.11 H new ATOM 0 H3 MET A 1 -23.218 -3.346 10.607 1.00 2.11 H new ATOM 0 HA MET A 1 -20.380 -3.438 10.491 1.00 1.24 H new ATOM 0 HB2 MET A 1 -21.943 -5.592 9.000 1.00 1.12 H new ATOM 0 HB3 MET A 1 -20.256 -5.203 8.729 1.00 1.12 H new ATOM 0 HG2 MET A 1 -20.151 -7.070 10.123 1.00 1.78 H new ATOM 0 HG3 MET A 1 -19.890 -5.730 11.223 1.00 1.78 H new ATOM 0 HE1 MET A 1 -23.229 -8.844 11.288 1.00 3.46 H new ATOM 0 HE2 MET A 1 -22.723 -8.104 9.751 1.00 3.46 H new ATOM 0 HE3 MET A 1 -21.544 -9.003 10.736 1.00 3.46 H new ATOM 20 N ALA A 2 -22.053 -1.613 9.063 1.00 1.19 N ATOM 21 CA ALA A 2 -22.372 -0.717 7.950 1.00 1.10 C ATOM 22 C ALA A 2 -21.144 -0.478 7.070 1.00 0.83 C ATOM 23 O ALA A 2 -21.231 -0.530 5.844 1.00 0.82 O ATOM 24 CB ALA A 2 -22.928 0.606 8.479 1.00 1.44 C ATOM 0 H ALA A 2 -22.209 -1.219 9.991 1.00 1.19 H new ATOM 0 HA ALA A 2 -23.135 -1.192 7.334 1.00 1.10 H new ATOM 0 HB1 ALA A 2 -23.161 1.263 7.641 1.00 1.44 H new ATOM 0 HB2 ALA A 2 -23.834 0.416 9.054 1.00 1.44 H new ATOM 0 HB3 ALA A 2 -22.185 1.083 9.119 1.00 1.44 H new ATOM 30 N ALA A 3 -19.991 -0.267 7.714 1.00 0.76 N ATOM 31 CA ALA A 3 -18.710 -0.119 7.046 1.00 0.51 C ATOM 32 C ALA A 3 -18.516 -1.193 5.986 1.00 0.40 C ATOM 33 O ALA A 3 -18.252 -0.877 4.834 1.00 0.33 O ATOM 34 CB ALA A 3 -17.584 -0.174 8.080 1.00 0.64 C ATOM 0 H ALA A 3 -19.929 -0.194 8.730 1.00 0.76 H new ATOM 0 HA ALA A 3 -18.689 0.848 6.543 1.00 0.51 H new ATOM 0 HB1 ALA A 3 -16.623 -0.063 7.578 1.00 0.64 H new ATOM 0 HB2 ALA A 3 -17.712 0.633 8.801 1.00 0.64 H new ATOM 0 HB3 ALA A 3 -17.613 -1.132 8.599 1.00 0.64 H new ATOM 40 N SER A 4 -18.682 -2.460 6.367 1.00 0.44 N ATOM 41 CA SER A 4 -18.420 -3.600 5.507 1.00 0.38 C ATOM 42 C SER A 4 -19.183 -3.485 4.195 1.00 0.30 C ATOM 43 O SER A 4 -18.660 -3.816 3.137 1.00 0.35 O ATOM 44 CB SER A 4 -18.740 -4.900 6.253 1.00 0.42 C ATOM 45 OG SER A 4 -20.102 -5.262 6.177 1.00 1.18 O ATOM 0 H SER A 4 -19.008 -2.720 7.298 1.00 0.44 H new ATOM 0 HA SER A 4 -17.361 -3.615 5.249 1.00 0.38 H new ATOM 0 HB2 SER A 4 -18.133 -5.706 5.842 1.00 0.42 H new ATOM 0 HB3 SER A 4 -18.458 -4.790 7.300 1.00 0.42 H new ATOM 0 HG SER A 4 -20.641 -4.613 6.675 1.00 1.18 H new ATOM 51 N ARG A 5 -20.411 -2.967 4.240 1.00 0.36 N ATOM 52 CA ARG A 5 -21.193 -2.784 3.029 1.00 0.44 C ATOM 53 C ARG A 5 -20.474 -1.817 2.107 1.00 0.45 C ATOM 54 O ARG A 5 -20.291 -2.095 0.924 1.00 0.64 O ATOM 55 CB ARG A 5 -22.600 -2.280 3.360 1.00 0.59 C ATOM 56 CG ARG A 5 -23.239 -3.163 4.434 1.00 0.90 C ATOM 57 CD ARG A 5 -24.759 -2.966 4.478 1.00 1.28 C ATOM 58 NE ARG A 5 -25.456 -4.257 4.594 1.00 1.98 N ATOM 59 CZ ARG A 5 -26.772 -4.446 4.432 1.00 2.49 C ATOM 60 NH1 ARG A 5 -27.273 -5.683 4.432 1.00 3.20 N ATOM 61 NH2 ARG A 5 -27.582 -3.400 4.269 1.00 2.94 N ATOM 0 H ARG A 5 -20.878 -2.671 5.097 1.00 0.36 H new ATOM 0 HA ARG A 5 -21.299 -3.744 2.524 1.00 0.44 H new ATOM 0 HB2 ARG A 5 -22.552 -1.248 3.708 1.00 0.59 H new ATOM 0 HB3 ARG A 5 -23.217 -2.284 2.461 1.00 0.59 H new ATOM 0 HG2 ARG A 5 -23.011 -4.209 4.232 1.00 0.90 H new ATOM 0 HG3 ARG A 5 -22.810 -2.925 5.407 1.00 0.90 H new ATOM 0 HD2 ARG A 5 -25.022 -2.330 5.323 1.00 1.28 H new ATOM 0 HD3 ARG A 5 -25.089 -2.451 3.576 1.00 1.28 H new ATOM 0 HE ARG A 5 -24.890 -5.076 4.816 1.00 1.98 H new ATOM 0 HH11 ARG A 5 -26.654 -6.484 4.555 1.00 3.20 H new ATOM 0 HH12 ARG A 5 -28.275 -5.827 4.309 1.00 3.20 H new ATOM 0 HH21 ARG A 5 -27.200 -2.454 4.268 1.00 2.94 H new ATOM 0 HH22 ARG A 5 -28.584 -3.545 4.146 1.00 2.94 H new ATOM 75 N ARG A 6 -20.057 -0.674 2.648 1.00 0.37 N ATOM 76 CA ARG A 6 -19.326 0.318 1.871 1.00 0.40 C ATOM 77 C ARG A 6 -18.044 -0.297 1.332 1.00 0.43 C ATOM 78 O ARG A 6 -17.678 -0.031 0.201 1.00 0.66 O ATOM 79 CB ARG A 6 -19.087 1.591 2.696 1.00 0.40 C ATOM 80 CG ARG A 6 -20.432 2.264 3.014 1.00 0.58 C ATOM 81 CD ARG A 6 -20.304 3.357 4.078 1.00 1.18 C ATOM 82 NE ARG A 6 -19.515 4.518 3.624 1.00 1.52 N ATOM 83 CZ ARG A 6 -20.004 5.699 3.224 1.00 1.67 C ATOM 84 NH1 ARG A 6 -19.176 6.732 3.072 1.00 2.37 N ATOM 85 NH2 ARG A 6 -21.306 5.848 2.978 1.00 2.06 N ATOM 0 H ARG A 6 -20.214 -0.414 3.622 1.00 0.37 H new ATOM 0 HA ARG A 6 -19.922 0.626 1.012 1.00 0.40 H new ATOM 0 HB2 ARG A 6 -18.566 1.344 3.621 1.00 0.40 H new ATOM 0 HB3 ARG A 6 -18.447 2.279 2.143 1.00 0.40 H new ATOM 0 HG2 ARG A 6 -20.843 2.696 2.102 1.00 0.58 H new ATOM 0 HG3 ARG A 6 -21.140 1.509 3.356 1.00 0.58 H new ATOM 0 HD2 ARG A 6 -21.300 3.693 4.367 1.00 1.18 H new ATOM 0 HD3 ARG A 6 -19.839 2.935 4.969 1.00 1.18 H new ATOM 0 HE ARG A 6 -18.501 4.411 3.614 1.00 1.52 H new ATOM 0 HH11 ARG A 6 -18.180 6.619 3.260 1.00 2.37 H new ATOM 0 HH12 ARG A 6 -19.538 7.636 2.768 1.00 2.37 H new ATOM 0 HH21 ARG A 6 -21.941 5.058 3.094 1.00 2.06 H new ATOM 0 HH22 ARG A 6 -21.667 6.752 2.674 1.00 2.06 H new ATOM 99 N LEU A 7 -17.384 -1.162 2.087 1.00 0.26 N ATOM 100 CA LEU A 7 -16.160 -1.792 1.630 1.00 0.23 C ATOM 101 C LEU A 7 -16.450 -2.744 0.477 1.00 0.24 C ATOM 102 O LEU A 7 -15.656 -2.821 -0.447 1.00 0.30 O ATOM 103 CB LEU A 7 -15.467 -2.488 2.804 1.00 0.22 C ATOM 104 CG LEU A 7 -15.030 -1.478 3.874 1.00 0.27 C ATOM 105 CD1 LEU A 7 -14.381 -2.230 5.034 1.00 0.46 C ATOM 106 CD2 LEU A 7 -14.034 -0.434 3.373 1.00 0.41 C ATOM 0 H LEU A 7 -17.679 -1.443 3.022 1.00 0.26 H new ATOM 0 HA LEU A 7 -15.477 -1.034 1.248 1.00 0.23 H new ATOM 0 HB2 LEU A 7 -16.144 -3.219 3.246 1.00 0.22 H new ATOM 0 HB3 LEU A 7 -14.597 -3.036 2.442 1.00 0.22 H new ATOM 0 HG LEU A 7 -15.932 -0.946 4.176 1.00 0.27 H new ATOM 0 HD11 LEU A 7 -14.068 -1.519 5.799 1.00 0.46 H new ATOM 0 HD12 LEU A 7 -15.099 -2.930 5.461 1.00 0.46 H new ATOM 0 HD13 LEU A 7 -13.512 -2.779 4.671 1.00 0.46 H new ATOM 0 HD21 LEU A 7 -13.775 0.242 4.188 1.00 0.41 H new ATOM 0 HD22 LEU A 7 -13.133 -0.933 3.015 1.00 0.41 H new ATOM 0 HD23 LEU A 7 -14.482 0.135 2.558 1.00 0.41 H new ATOM 118 N MET A 8 -17.579 -3.450 0.490 1.00 0.27 N ATOM 119 CA MET A 8 -17.948 -4.351 -0.589 1.00 0.37 C ATOM 120 C MET A 8 -18.162 -3.583 -1.884 1.00 0.39 C ATOM 121 O MET A 8 -17.555 -3.918 -2.899 1.00 0.42 O ATOM 122 CB MET A 8 -19.165 -5.189 -0.181 1.00 0.41 C ATOM 123 CG MET A 8 -19.647 -6.078 -1.331 1.00 0.74 C ATOM 124 SD MET A 8 -20.849 -7.349 -0.853 1.00 1.45 S ATOM 125 CE MET A 8 -22.170 -6.321 -0.161 1.00 3.57 C ATOM 0 H MET A 8 -18.259 -3.411 1.249 1.00 0.27 H new ATOM 0 HA MET A 8 -17.130 -5.046 -0.778 1.00 0.37 H new ATOM 0 HB2 MET A 8 -18.909 -5.810 0.677 1.00 0.41 H new ATOM 0 HB3 MET A 8 -19.974 -4.529 0.133 1.00 0.41 H new ATOM 0 HG2 MET A 8 -20.093 -5.446 -2.099 1.00 0.74 H new ATOM 0 HG3 MET A 8 -18.783 -6.566 -1.782 1.00 0.74 H new ATOM 0 HE1 MET A 8 -23.029 -6.947 0.081 1.00 3.57 H new ATOM 0 HE2 MET A 8 -21.812 -5.830 0.744 1.00 3.57 H new ATOM 0 HE3 MET A 8 -22.465 -5.567 -0.891 1.00 3.57 H new ATOM 135 N LYS A 9 -19.013 -2.554 -1.879 1.00 0.41 N ATOM 136 CA LYS A 9 -19.244 -1.811 -3.116 1.00 0.46 C ATOM 137 C LYS A 9 -17.963 -1.132 -3.594 1.00 0.47 C ATOM 138 O LYS A 9 -17.679 -1.132 -4.786 1.00 0.59 O ATOM 139 CB LYS A 9 -20.430 -0.844 -3.011 1.00 0.53 C ATOM 140 CG LYS A 9 -20.549 -0.043 -1.711 1.00 1.88 C ATOM 141 CD LYS A 9 -21.828 -0.446 -0.964 1.00 2.18 C ATOM 142 CE LYS A 9 -23.095 0.028 -1.686 1.00 2.81 C ATOM 143 NZ LYS A 9 -23.223 1.502 -1.690 1.00 3.81 N ATOM 0 H LYS A 9 -19.534 -2.227 -1.066 1.00 0.41 H new ATOM 0 HA LYS A 9 -19.529 -2.532 -3.882 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -20.370 -0.140 -3.841 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -21.348 -1.416 -3.144 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -19.678 -0.223 -1.081 1.00 1.88 H new ATOM 0 HG3 LYS A 9 -20.567 1.024 -1.932 1.00 1.88 H new ATOM 0 HD2 LYS A 9 -21.857 -1.530 -0.857 1.00 2.18 H new ATOM 0 HD3 LYS A 9 -21.807 -0.026 0.042 1.00 2.18 H new ATOM 0 HE2 LYS A 9 -23.082 -0.336 -2.713 1.00 2.81 H new ATOM 0 HE3 LYS A 9 -23.970 -0.409 -1.204 1.00 2.81 H new ATOM 0 HZ1 LYS A 9 -24.168 1.767 -2.035 1.00 3.81 H new ATOM 0 HZ2 LYS A 9 -23.093 1.864 -0.724 1.00 3.81 H new ATOM 0 HZ3 LYS A 9 -22.499 1.912 -2.314 1.00 3.81 H new ATOM 157 N GLU A 10 -17.176 -0.577 -2.677 1.00 0.37 N ATOM 158 CA GLU A 10 -15.909 0.059 -3.006 1.00 0.37 C ATOM 159 C GLU A 10 -14.932 -0.958 -3.588 1.00 0.31 C ATOM 160 O GLU A 10 -14.144 -0.617 -4.457 1.00 0.47 O ATOM 161 CB GLU A 10 -15.320 0.706 -1.751 1.00 0.40 C ATOM 162 CG GLU A 10 -16.185 1.884 -1.276 1.00 0.57 C ATOM 163 CD GLU A 10 -15.920 3.198 -2.000 1.00 1.08 C ATOM 164 OE1 GLU A 10 -14.741 3.493 -2.267 1.00 1.77 O ATOM 165 OE2 GLU A 10 -16.910 3.948 -2.175 1.00 1.80 O ATOM 0 H GLU A 10 -17.402 -0.557 -1.682 1.00 0.37 H new ATOM 0 HA GLU A 10 -16.084 0.829 -3.758 1.00 0.37 H new ATOM 0 HB2 GLU A 10 -15.244 -0.037 -0.957 1.00 0.40 H new ATOM 0 HB3 GLU A 10 -14.308 1.055 -1.959 1.00 0.40 H new ATOM 0 HG2 GLU A 10 -17.235 1.620 -1.402 1.00 0.57 H new ATOM 0 HG3 GLU A 10 -16.019 2.032 -0.209 1.00 0.57 H new ATOM 172 N LEU A 11 -14.942 -2.205 -3.116 1.00 0.23 N ATOM 173 CA LEU A 11 -14.023 -3.220 -3.597 1.00 0.23 C ATOM 174 C LEU A 11 -14.390 -3.615 -5.014 1.00 0.28 C ATOM 175 O LEU A 11 -13.509 -3.775 -5.855 1.00 0.25 O ATOM 176 CB LEU A 11 -14.027 -4.439 -2.667 1.00 0.27 C ATOM 177 CG LEU A 11 -12.860 -5.369 -3.034 1.00 0.25 C ATOM 178 CD1 LEU A 11 -12.106 -5.909 -1.814 1.00 0.31 C ATOM 179 CD2 LEU A 11 -13.379 -6.550 -3.853 1.00 0.30 C ATOM 0 H LEU A 11 -15.585 -2.532 -2.395 1.00 0.23 H new ATOM 0 HA LEU A 11 -13.013 -2.810 -3.601 1.00 0.23 H new ATOM 0 HB2 LEU A 11 -13.937 -4.118 -1.629 1.00 0.27 H new ATOM 0 HB3 LEU A 11 -14.973 -4.973 -2.755 1.00 0.27 H new ATOM 0 HG LEU A 11 -12.158 -4.767 -3.611 1.00 0.25 H new ATOM 0 HD11 LEU A 11 -11.295 -6.558 -2.145 1.00 0.31 H new ATOM 0 HD12 LEU A 11 -11.694 -5.077 -1.243 1.00 0.31 H new ATOM 0 HD13 LEU A 11 -12.791 -6.477 -1.185 1.00 0.31 H new ATOM 0 HD21 LEU A 11 -12.548 -7.207 -4.111 1.00 0.30 H new ATOM 0 HD22 LEU A 11 -14.112 -7.105 -3.267 1.00 0.30 H new ATOM 0 HD23 LEU A 11 -13.848 -6.182 -4.766 1.00 0.30 H new ATOM 191 N GLU A 12 -15.681 -3.791 -5.280 1.00 0.41 N ATOM 192 CA GLU A 12 -16.144 -4.090 -6.625 1.00 0.54 C ATOM 193 C GLU A 12 -15.712 -2.976 -7.579 1.00 0.52 C ATOM 194 O GLU A 12 -15.113 -3.259 -8.617 1.00 0.53 O ATOM 195 CB GLU A 12 -17.658 -4.317 -6.630 1.00 0.74 C ATOM 196 CG GLU A 12 -18.123 -4.722 -8.032 1.00 0.92 C ATOM 197 CD GLU A 12 -19.559 -5.243 -8.007 1.00 1.40 C ATOM 198 OE1 GLU A 12 -20.480 -4.413 -8.171 1.00 2.68 O ATOM 199 OE2 GLU A 12 -19.712 -6.472 -7.829 1.00 1.50 O ATOM 0 H GLU A 12 -16.422 -3.731 -4.581 1.00 0.41 H new ATOM 0 HA GLU A 12 -15.687 -5.015 -6.976 1.00 0.54 H new ATOM 0 HB2 GLU A 12 -17.920 -5.095 -5.912 1.00 0.74 H new ATOM 0 HB3 GLU A 12 -18.171 -3.408 -6.316 1.00 0.74 H new ATOM 0 HG2 GLU A 12 -18.056 -3.865 -8.702 1.00 0.92 H new ATOM 0 HG3 GLU A 12 -17.461 -5.491 -8.430 1.00 0.92 H new ATOM 206 N GLU A 13 -15.968 -1.720 -7.203 1.00 0.53 N ATOM 207 CA GLU A 13 -15.553 -0.543 -7.957 1.00 0.57 C ATOM 208 C GLU A 13 -14.056 -0.580 -8.226 1.00 0.44 C ATOM 209 O GLU A 13 -13.633 -0.408 -9.363 1.00 0.42 O ATOM 210 CB GLU A 13 -15.919 0.744 -7.197 1.00 0.69 C ATOM 211 CG GLU A 13 -17.243 1.336 -7.684 1.00 0.96 C ATOM 212 CD GLU A 13 -17.091 1.949 -9.079 1.00 2.26 C ATOM 213 OE1 GLU A 13 -16.847 3.174 -9.146 1.00 3.26 O ATOM 214 OE2 GLU A 13 -17.210 1.179 -10.058 1.00 3.09 O ATOM 0 H GLU A 13 -16.479 -1.493 -6.350 1.00 0.53 H new ATOM 0 HA GLU A 13 -16.081 -0.549 -8.911 1.00 0.57 H new ATOM 0 HB2 GLU A 13 -15.988 0.529 -6.131 1.00 0.69 H new ATOM 0 HB3 GLU A 13 -15.124 1.479 -7.323 1.00 0.69 H new ATOM 0 HG2 GLU A 13 -18.007 0.559 -7.706 1.00 0.96 H new ATOM 0 HG3 GLU A 13 -17.584 2.098 -6.983 1.00 0.96 H new ATOM 221 N ILE A 14 -13.243 -0.808 -7.196 1.00 0.40 N ATOM 222 CA ILE A 14 -11.794 -0.838 -7.311 1.00 0.31 C ATOM 223 C ILE A 14 -11.397 -1.858 -8.367 1.00 0.26 C ATOM 224 O ILE A 14 -10.674 -1.529 -9.306 1.00 0.32 O ATOM 225 CB ILE A 14 -11.156 -1.119 -5.937 1.00 0.23 C ATOM 226 CG1 ILE A 14 -11.179 0.181 -5.116 1.00 0.32 C ATOM 227 CG2 ILE A 14 -9.688 -1.545 -6.100 1.00 0.25 C ATOM 228 CD1 ILE A 14 -10.855 -0.074 -3.645 1.00 0.25 C ATOM 0 H ILE A 14 -13.580 -0.979 -6.249 1.00 0.40 H new ATOM 0 HA ILE A 14 -11.419 0.133 -7.634 1.00 0.31 H new ATOM 0 HB ILE A 14 -11.714 -1.915 -5.445 1.00 0.23 H new ATOM 0 HG12 ILE A 14 -10.458 0.886 -5.530 1.00 0.32 H new ATOM 0 HG13 ILE A 14 -12.162 0.645 -5.197 1.00 0.32 H new ATOM 0 HG21 ILE A 14 -9.254 -1.739 -5.119 1.00 0.25 H new ATOM 0 HG22 ILE A 14 -9.637 -2.450 -6.705 1.00 0.25 H new ATOM 0 HG23 ILE A 14 -9.130 -0.748 -6.592 1.00 0.25 H new ATOM 0 HD11 ILE A 14 -10.881 0.868 -3.098 1.00 0.25 H new ATOM 0 HD12 ILE A 14 -11.591 -0.759 -3.224 1.00 0.25 H new ATOM 0 HD13 ILE A 14 -9.861 -0.514 -3.562 1.00 0.25 H new ATOM 240 N ARG A 15 -11.858 -3.103 -8.233 1.00 0.25 N ATOM 241 CA ARG A 15 -11.503 -4.156 -9.174 1.00 0.28 C ATOM 242 C ARG A 15 -11.827 -3.700 -10.592 1.00 0.33 C ATOM 243 O ARG A 15 -10.982 -3.778 -11.485 1.00 0.36 O ATOM 244 CB ARG A 15 -12.215 -5.467 -8.828 1.00 0.45 C ATOM 245 CG ARG A 15 -11.669 -6.066 -7.527 1.00 1.36 C ATOM 246 CD ARG A 15 -12.366 -7.389 -7.188 1.00 1.56 C ATOM 247 NE ARG A 15 -11.700 -8.557 -7.785 1.00 1.49 N ATOM 248 CZ ARG A 15 -12.041 -9.181 -8.919 1.00 1.34 C ATOM 249 NH1 ARG A 15 -11.396 -10.292 -9.282 1.00 1.85 N ATOM 250 NH2 ARG A 15 -13.025 -8.708 -9.684 1.00 2.69 N ATOM 0 H ARG A 15 -12.478 -3.402 -7.480 1.00 0.25 H new ATOM 0 HA ARG A 15 -10.432 -4.349 -9.107 1.00 0.28 H new ATOM 0 HB2 ARG A 15 -13.285 -5.287 -8.728 1.00 0.45 H new ATOM 0 HB3 ARG A 15 -12.086 -6.180 -9.642 1.00 0.45 H new ATOM 0 HG2 ARG A 15 -10.596 -6.232 -7.623 1.00 1.36 H new ATOM 0 HG3 ARG A 15 -11.811 -5.358 -6.710 1.00 1.36 H new ATOM 0 HD2 ARG A 15 -12.398 -7.510 -6.105 1.00 1.56 H new ATOM 0 HD3 ARG A 15 -13.398 -7.349 -7.535 1.00 1.56 H new ATOM 0 HE ARG A 15 -10.895 -8.930 -7.283 1.00 1.49 H new ATOM 0 HH11 ARG A 15 -10.647 -10.662 -8.696 1.00 1.85 H new ATOM 0 HH12 ARG A 15 -11.652 -10.771 -10.145 1.00 1.85 H new ATOM 0 HH21 ARG A 15 -13.525 -7.863 -9.407 1.00 2.69 H new ATOM 0 HH22 ARG A 15 -13.277 -9.191 -10.546 1.00 2.69 H new ATOM 264 N LYS A 16 -13.051 -3.204 -10.786 1.00 0.44 N ATOM 265 CA LYS A 16 -13.525 -2.726 -12.076 1.00 0.59 C ATOM 266 C LYS A 16 -12.779 -1.486 -12.560 1.00 0.63 C ATOM 267 O LYS A 16 -12.731 -1.258 -13.765 1.00 0.72 O ATOM 268 CB LYS A 16 -15.035 -2.452 -12.020 1.00 0.65 C ATOM 269 CG LYS A 16 -15.840 -3.700 -12.395 1.00 0.78 C ATOM 270 CD LYS A 16 -15.473 -4.156 -13.816 1.00 2.64 C ATOM 271 CE LYS A 16 -16.704 -4.581 -14.619 1.00 3.19 C ATOM 272 NZ LYS A 16 -17.320 -5.820 -14.098 1.00 3.02 N ATOM 0 H LYS A 16 -13.744 -3.124 -10.041 1.00 0.44 H new ATOM 0 HA LYS A 16 -13.324 -3.517 -12.799 1.00 0.59 H new ATOM 0 HB2 LYS A 16 -15.311 -2.126 -11.017 1.00 0.65 H new ATOM 0 HB3 LYS A 16 -15.285 -1.637 -12.700 1.00 0.65 H new ATOM 0 HG2 LYS A 16 -15.637 -4.501 -11.684 1.00 0.78 H new ATOM 0 HG3 LYS A 16 -16.907 -3.485 -12.338 1.00 0.78 H new ATOM 0 HD2 LYS A 16 -14.963 -3.345 -14.336 1.00 2.64 H new ATOM 0 HD3 LYS A 16 -14.772 -4.989 -13.760 1.00 2.64 H new ATOM 0 HE2 LYS A 16 -17.440 -3.778 -14.601 1.00 3.19 H new ATOM 0 HE3 LYS A 16 -16.420 -4.730 -15.661 1.00 3.19 H new ATOM 0 HZ1 LYS A 16 -18.149 -6.065 -14.676 1.00 3.02 H new ATOM 0 HZ2 LYS A 16 -16.628 -6.595 -14.139 1.00 3.02 H new ATOM 0 HZ3 LYS A 16 -17.617 -5.672 -13.112 1.00 3.02 H new ATOM 286 N CYS A 17 -12.180 -0.709 -11.662 1.00 0.62 N ATOM 287 CA CYS A 17 -11.417 0.479 -12.003 1.00 0.75 C ATOM 288 C CYS A 17 -10.222 0.060 -12.854 1.00 0.66 C ATOM 289 O CYS A 17 -9.785 0.800 -13.732 1.00 0.83 O ATOM 290 CB CYS A 17 -10.974 1.176 -10.707 1.00 0.83 C ATOM 291 SG CYS A 17 -10.439 2.877 -11.034 1.00 1.29 S ATOM 0 H CYS A 17 -12.214 -0.894 -10.660 1.00 0.62 H new ATOM 0 HA CYS A 17 -12.019 1.183 -12.577 1.00 0.75 H new ATOM 0 HB2 CYS A 17 -11.797 1.181 -9.993 1.00 0.83 H new ATOM 0 HB3 CYS A 17 -10.158 0.616 -10.249 1.00 0.83 H new ATOM 0 HG CYS A 17 -10.073 3.439 -9.920 1.00 1.29 H new ATOM 297 N GLY A 18 -9.715 -1.152 -12.617 1.00 0.42 N ATOM 298 CA GLY A 18 -8.752 -1.783 -13.493 1.00 0.36 C ATOM 299 C GLY A 18 -7.569 -2.222 -12.663 1.00 0.44 C ATOM 300 O GLY A 18 -6.623 -1.456 -12.492 1.00 0.51 O ATOM 0 H GLY A 18 -9.968 -1.717 -11.807 1.00 0.42 H new ATOM 0 HA2 GLY A 18 -9.201 -2.639 -13.996 1.00 0.36 H new ATOM 0 HA3 GLY A 18 -8.433 -1.088 -14.270 1.00 0.36 H new ATOM 304 N MET A 19 -7.629 -3.451 -12.146 1.00 0.45 N ATOM 305 CA MET A 19 -6.546 -4.084 -11.406 1.00 0.55 C ATOM 306 C MET A 19 -5.292 -4.139 -12.278 1.00 0.56 C ATOM 307 O MET A 19 -5.063 -5.115 -12.990 1.00 0.67 O ATOM 308 CB MET A 19 -6.976 -5.495 -10.992 1.00 0.72 C ATOM 309 CG MET A 19 -8.119 -5.446 -9.978 1.00 1.74 C ATOM 310 SD MET A 19 -9.228 -6.882 -10.037 1.00 1.72 S ATOM 311 CE MET A 19 -8.120 -8.186 -9.459 1.00 3.28 C ATOM 0 H MET A 19 -8.454 -4.044 -12.235 1.00 0.45 H new ATOM 0 HA MET A 19 -6.320 -3.505 -10.510 1.00 0.55 H new ATOM 0 HB2 MET A 19 -7.290 -6.056 -11.872 1.00 0.72 H new ATOM 0 HB3 MET A 19 -6.127 -6.026 -10.562 1.00 0.72 H new ATOM 0 HG2 MET A 19 -7.698 -5.367 -8.976 1.00 1.74 H new ATOM 0 HG3 MET A 19 -8.704 -4.542 -10.150 1.00 1.74 H new ATOM 0 HE1 MET A 19 -8.688 -9.103 -9.303 1.00 3.28 H new ATOM 0 HE2 MET A 19 -7.345 -8.362 -10.205 1.00 3.28 H new ATOM 0 HE3 MET A 19 -7.658 -7.881 -8.520 1.00 3.28 H new ATOM 321 N LYS A 20 -4.500 -3.070 -12.255 1.00 0.53 N ATOM 322 CA LYS A 20 -3.187 -2.989 -12.876 1.00 0.52 C ATOM 323 C LYS A 20 -2.135 -2.968 -11.776 1.00 0.49 C ATOM 324 O LYS A 20 -1.334 -3.886 -11.651 1.00 0.72 O ATOM 325 CB LYS A 20 -3.138 -1.802 -13.856 1.00 0.58 C ATOM 326 CG LYS A 20 -3.296 -0.433 -13.178 1.00 2.41 C ATOM 327 CD LYS A 20 -3.746 0.664 -14.142 1.00 2.78 C ATOM 328 CE LYS A 20 -2.658 0.968 -15.175 1.00 2.98 C ATOM 329 NZ LYS A 20 -3.066 2.064 -16.082 1.00 3.76 N ATOM 0 H LYS A 20 -4.768 -2.206 -11.785 1.00 0.53 H new ATOM 0 HA LYS A 20 -2.972 -3.863 -13.491 1.00 0.52 H new ATOM 0 HB2 LYS A 20 -2.189 -1.824 -14.392 1.00 0.58 H new ATOM 0 HB3 LYS A 20 -3.927 -1.923 -14.598 1.00 0.58 H new ATOM 0 HG2 LYS A 20 -4.021 -0.517 -12.368 1.00 2.41 H new ATOM 0 HG3 LYS A 20 -2.346 -0.145 -12.727 1.00 2.41 H new ATOM 0 HD2 LYS A 20 -4.659 0.354 -14.651 1.00 2.78 H new ATOM 0 HD3 LYS A 20 -3.984 1.569 -13.583 1.00 2.78 H new ATOM 0 HE2 LYS A 20 -1.735 1.241 -14.664 1.00 2.98 H new ATOM 0 HE3 LYS A 20 -2.446 0.071 -15.757 1.00 2.98 H new ATOM 0 HZ1 LYS A 20 -2.308 2.246 -16.770 1.00 3.76 H new ATOM 0 HZ2 LYS A 20 -3.934 1.792 -16.587 1.00 3.76 H new ATOM 0 HZ3 LYS A 20 -3.244 2.926 -15.527 1.00 3.76 H new ATOM 343 N ASN A 21 -2.209 -1.944 -10.926 1.00 0.43 N ATOM 344 CA ASN A 21 -1.236 -1.659 -9.886 1.00 0.42 C ATOM 345 C ASN A 21 -1.706 -2.209 -8.554 1.00 0.31 C ATOM 346 O ASN A 21 -1.090 -1.963 -7.525 1.00 0.20 O ATOM 347 CB ASN A 21 -0.997 -0.151 -9.796 1.00 0.49 C ATOM 348 CG ASN A 21 -0.109 0.307 -10.948 1.00 0.76 C ATOM 349 OD1 ASN A 21 -0.017 -0.367 -11.968 1.00 2.10 O ATOM 350 ND2 ASN A 21 0.511 1.469 -10.835 1.00 1.10 N ATOM 0 H ASN A 21 -2.975 -1.271 -10.948 1.00 0.43 H new ATOM 0 HA ASN A 21 -0.295 -2.147 -10.139 1.00 0.42 H new ATOM 0 HB2 ASN A 21 -1.949 0.379 -9.827 1.00 0.49 H new ATOM 0 HB3 ASN A 21 -0.527 0.095 -8.844 1.00 0.49 H new ATOM 0 HD21 ASN A 21 1.079 1.821 -11.605 1.00 1.10 H new ATOM 0 HD22 ASN A 21 0.421 2.014 -9.977 1.00 1.10 H new ATOM 357 N PHE A 22 -2.805 -2.954 -8.559 1.00 0.48 N ATOM 358 CA PHE A 22 -3.406 -3.513 -7.379 1.00 0.38 C ATOM 359 C PHE A 22 -4.068 -4.799 -7.855 1.00 0.41 C ATOM 360 O PHE A 22 -4.999 -4.776 -8.657 1.00 0.56 O ATOM 361 CB PHE A 22 -4.365 -2.482 -6.770 1.00 0.32 C ATOM 362 CG PHE A 22 -5.382 -1.897 -7.729 1.00 0.44 C ATOM 363 CD1 PHE A 22 -6.655 -2.479 -7.833 1.00 0.44 C ATOM 364 CD2 PHE A 22 -5.048 -0.793 -8.536 1.00 0.62 C ATOM 365 CE1 PHE A 22 -7.584 -1.976 -8.756 1.00 0.58 C ATOM 366 CE2 PHE A 22 -5.983 -0.282 -9.452 1.00 0.75 C ATOM 367 CZ PHE A 22 -7.254 -0.872 -9.558 1.00 0.71 C ATOM 0 H PHE A 22 -3.309 -3.186 -9.415 1.00 0.48 H new ATOM 0 HA PHE A 22 -2.707 -3.749 -6.577 1.00 0.38 H new ATOM 0 HB2 PHE A 22 -4.898 -2.950 -5.943 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -3.776 -1.667 -6.349 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -6.919 -3.315 -7.202 1.00 0.44 H new ATOM 0 HD2 PHE A 22 -4.072 -0.338 -8.451 1.00 0.62 H new ATOM 0 HE1 PHE A 22 -8.555 -2.439 -8.850 1.00 0.58 H new ATOM 0 HE2 PHE A 22 -5.725 0.563 -10.074 1.00 0.75 H new ATOM 0 HZ PHE A 22 -7.977 -0.476 -10.256 1.00 0.71 H new ATOM 377 N ARG A 23 -3.510 -5.934 -7.451 1.00 0.39 N ATOM 378 CA ARG A 23 -3.948 -7.263 -7.848 1.00 0.48 C ATOM 379 C ARG A 23 -4.043 -8.085 -6.573 1.00 0.40 C ATOM 380 O ARG A 23 -3.863 -7.550 -5.483 1.00 0.31 O ATOM 381 CB ARG A 23 -2.942 -7.852 -8.855 1.00 0.66 C ATOM 382 CG ARG A 23 -3.130 -7.311 -10.278 1.00 0.89 C ATOM 383 CD ARG A 23 -4.080 -8.220 -11.064 1.00 1.27 C ATOM 384 NE ARG A 23 -4.320 -7.695 -12.411 1.00 2.09 N ATOM 385 CZ ARG A 23 -3.607 -7.957 -13.511 1.00 2.70 C ATOM 386 NH1 ARG A 23 -3.873 -7.334 -14.655 1.00 4.01 N ATOM 387 NH2 ARG A 23 -2.625 -8.843 -13.469 1.00 2.72 N ATOM 0 H ARG A 23 -2.712 -5.953 -6.816 1.00 0.39 H new ATOM 0 HA ARG A 23 -4.918 -7.253 -8.346 1.00 0.48 H new ATOM 0 HB2 ARG A 23 -1.929 -7.631 -8.519 1.00 0.66 H new ATOM 0 HB3 ARG A 23 -3.043 -8.937 -8.869 1.00 0.66 H new ATOM 0 HG2 ARG A 23 -3.531 -6.298 -10.241 1.00 0.89 H new ATOM 0 HG3 ARG A 23 -2.166 -7.254 -10.784 1.00 0.89 H new ATOM 0 HD2 ARG A 23 -3.657 -9.222 -11.131 1.00 1.27 H new ATOM 0 HD3 ARG A 23 -5.027 -8.309 -10.531 1.00 1.27 H new ATOM 0 HE ARG A 23 -5.114 -7.064 -12.521 1.00 2.09 H new ATOM 0 HH11 ARG A 23 -4.627 -6.649 -14.699 1.00 4.01 H new ATOM 0 HH12 ARG A 23 -3.323 -7.541 -15.489 1.00 4.01 H new ATOM 0 HH21 ARG A 23 -2.412 -9.327 -12.597 1.00 2.72 H new ATOM 0 HH22 ARG A 23 -2.082 -9.042 -14.309 1.00 2.72 H new ATOM 401 N ASN A 24 -4.375 -9.371 -6.685 1.00 0.52 N ATOM 402 CA ASN A 24 -4.669 -10.222 -5.539 1.00 0.48 C ATOM 403 C ASN A 24 -5.626 -9.544 -4.557 1.00 0.36 C ATOM 404 O ASN A 24 -5.555 -9.841 -3.375 1.00 0.41 O ATOM 405 CB ASN A 24 -3.371 -10.660 -4.829 1.00 0.63 C ATOM 406 CG ASN A 24 -2.576 -11.676 -5.631 1.00 1.28 C ATOM 407 OD1 ASN A 24 -2.397 -11.530 -6.834 1.00 2.65 O ATOM 408 ND2 ASN A 24 -2.102 -12.731 -4.981 1.00 2.05 N ATOM 0 H ASN A 24 -4.447 -9.852 -7.581 1.00 0.52 H new ATOM 0 HA ASN A 24 -5.169 -11.113 -5.918 1.00 0.48 H new ATOM 0 HB2 ASN A 24 -2.750 -9.784 -4.644 1.00 0.63 H new ATOM 0 HB3 ASN A 24 -3.620 -11.085 -3.857 1.00 0.63 H new ATOM 0 HD21 ASN A 24 -1.574 -13.445 -5.483 1.00 2.05 H new ATOM 0 HD22 ASN A 24 -2.265 -12.828 -3.979 1.00 2.05 H new ATOM 415 N ILE A 25 -6.537 -8.670 -5.002 1.00 0.29 N ATOM 416 CA ILE A 25 -7.564 -8.149 -4.107 1.00 0.26 C ATOM 417 C ILE A 25 -8.360 -9.352 -3.608 1.00 0.28 C ATOM 418 O ILE A 25 -8.879 -10.122 -4.418 1.00 0.35 O ATOM 419 CB ILE A 25 -8.449 -7.110 -4.838 1.00 0.28 C ATOM 420 CG1 ILE A 25 -7.976 -5.680 -4.515 1.00 0.28 C ATOM 421 CG2 ILE A 25 -9.934 -7.225 -4.462 1.00 0.35 C ATOM 422 CD1 ILE A 25 -8.640 -4.615 -5.379 1.00 0.37 C ATOM 0 H ILE A 25 -6.581 -8.317 -5.958 1.00 0.29 H new ATOM 0 HA ILE A 25 -7.130 -7.619 -3.259 1.00 0.26 H new ATOM 0 HB ILE A 25 -8.348 -7.320 -5.903 1.00 0.28 H new ATOM 0 HG12 ILE A 25 -8.180 -5.466 -3.466 1.00 0.28 H new ATOM 0 HG13 ILE A 25 -6.896 -5.624 -4.648 1.00 0.28 H new ATOM 0 HG21 ILE A 25 -10.506 -6.472 -5.004 1.00 0.35 H new ATOM 0 HG22 ILE A 25 -10.300 -8.218 -4.724 1.00 0.35 H new ATOM 0 HG23 ILE A 25 -10.051 -7.067 -3.390 1.00 0.35 H new ATOM 0 HD11 ILE A 25 -8.262 -3.632 -5.099 1.00 0.37 H new ATOM 0 HD12 ILE A 25 -8.415 -4.805 -6.428 1.00 0.37 H new ATOM 0 HD13 ILE A 25 -9.719 -4.645 -5.228 1.00 0.37 H new ATOM 434 N GLN A 26 -8.459 -9.507 -2.289 1.00 0.27 N ATOM 435 CA GLN A 26 -9.289 -10.516 -1.662 1.00 0.29 C ATOM 436 C GLN A 26 -9.961 -9.875 -0.460 1.00 0.31 C ATOM 437 O GLN A 26 -9.433 -8.924 0.124 1.00 0.34 O ATOM 438 CB GLN A 26 -8.487 -11.744 -1.215 1.00 0.42 C ATOM 439 CG GLN A 26 -7.233 -11.977 -2.057 1.00 0.57 C ATOM 440 CD GLN A 26 -6.637 -13.348 -1.804 1.00 0.86 C ATOM 441 OE1 GLN A 26 -6.695 -13.865 -0.694 1.00 2.12 O ATOM 442 NE2 GLN A 26 -6.054 -13.961 -2.825 1.00 0.97 N ATOM 0 H GLN A 26 -7.955 -8.923 -1.622 1.00 0.27 H new ATOM 0 HA GLN A 26 -10.020 -10.871 -2.389 1.00 0.29 H new ATOM 0 HB2 GLN A 26 -8.199 -11.623 -0.171 1.00 0.42 H new ATOM 0 HB3 GLN A 26 -9.124 -12.627 -1.270 1.00 0.42 H new ATOM 0 HG2 GLN A 26 -7.480 -11.877 -3.114 1.00 0.57 H new ATOM 0 HG3 GLN A 26 -6.493 -11.210 -1.828 1.00 0.57 H new ATOM 0 HE21 GLN A 26 -6.019 -13.509 -3.739 1.00 0.97 H new ATOM 0 HE22 GLN A 26 -5.640 -14.885 -2.697 1.00 0.97 H new ATOM 451 N VAL A 27 -11.110 -10.425 -0.088 1.00 0.35 N ATOM 452 CA VAL A 27 -11.886 -9.995 1.051 1.00 0.41 C ATOM 453 C VAL A 27 -12.442 -11.276 1.666 1.00 0.51 C ATOM 454 O VAL A 27 -12.908 -12.150 0.936 1.00 0.64 O ATOM 455 CB VAL A 27 -12.939 -8.983 0.565 1.00 0.41 C ATOM 456 CG1 VAL A 27 -13.887 -9.532 -0.512 1.00 0.66 C ATOM 457 CG2 VAL A 27 -13.759 -8.448 1.728 1.00 0.78 C ATOM 0 H VAL A 27 -11.534 -11.205 -0.590 1.00 0.35 H new ATOM 0 HA VAL A 27 -11.324 -9.468 1.822 1.00 0.41 H new ATOM 0 HB VAL A 27 -12.366 -8.179 0.104 1.00 0.41 H new ATOM 0 HG11 VAL A 27 -14.598 -8.758 -0.800 1.00 0.66 H new ATOM 0 HG12 VAL A 27 -13.309 -9.837 -1.384 1.00 0.66 H new ATOM 0 HG13 VAL A 27 -14.428 -10.392 -0.117 1.00 0.66 H new ATOM 0 HG21 VAL A 27 -14.495 -7.735 1.357 1.00 0.78 H new ATOM 0 HG22 VAL A 27 -14.271 -9.274 2.223 1.00 0.78 H new ATOM 0 HG23 VAL A 27 -13.100 -7.951 2.440 1.00 0.78 H new ATOM 467 N ASP A 28 -12.303 -11.438 2.980 1.00 0.48 N ATOM 468 CA ASP A 28 -12.788 -12.627 3.673 1.00 0.55 C ATOM 469 C ASP A 28 -14.306 -12.513 3.842 1.00 0.54 C ATOM 470 O ASP A 28 -14.854 -11.422 3.713 1.00 0.51 O ATOM 471 CB ASP A 28 -12.057 -12.732 5.011 1.00 0.54 C ATOM 472 CG ASP A 28 -12.312 -14.066 5.701 1.00 0.63 C ATOM 473 OD1 ASP A 28 -13.366 -14.171 6.366 1.00 1.20 O ATOM 474 OD2 ASP A 28 -11.456 -14.961 5.552 1.00 1.25 O ATOM 0 H ASP A 28 -11.854 -10.754 3.589 1.00 0.48 H new ATOM 0 HA ASP A 28 -12.588 -13.537 3.107 1.00 0.55 H new ATOM 0 HB2 ASP A 28 -10.986 -12.607 4.849 1.00 0.54 H new ATOM 0 HB3 ASP A 28 -12.378 -11.920 5.663 1.00 0.54 H new ATOM 479 N GLU A 29 -15.012 -13.613 4.107 1.00 0.63 N ATOM 480 CA GLU A 29 -16.458 -13.553 4.289 1.00 0.68 C ATOM 481 C GLU A 29 -16.794 -12.964 5.658 1.00 0.64 C ATOM 482 O GLU A 29 -17.668 -12.108 5.781 1.00 0.66 O ATOM 483 CB GLU A 29 -17.095 -14.937 4.075 1.00 0.85 C ATOM 484 CG GLU A 29 -16.657 -16.012 5.081 1.00 2.02 C ATOM 485 CD GLU A 29 -17.267 -17.369 4.729 1.00 2.38 C ATOM 486 OE1 GLU A 29 -16.750 -18.001 3.782 1.00 2.90 O ATOM 487 OE2 GLU A 29 -18.246 -17.752 5.407 1.00 3.36 O ATOM 0 H GLU A 29 -14.609 -14.546 4.199 1.00 0.63 H new ATOM 0 HA GLU A 29 -16.884 -12.891 3.535 1.00 0.68 H new ATOM 0 HB2 GLU A 29 -18.179 -14.834 4.124 1.00 0.85 H new ATOM 0 HB3 GLU A 29 -16.853 -15.281 3.069 1.00 0.85 H new ATOM 0 HG2 GLU A 29 -15.570 -16.088 5.088 1.00 2.02 H new ATOM 0 HG3 GLU A 29 -16.962 -15.721 6.086 1.00 2.02 H new ATOM 494 N ALA A 30 -16.096 -13.422 6.695 1.00 0.62 N ATOM 495 CA ALA A 30 -16.285 -12.960 8.058 1.00 0.60 C ATOM 496 C ALA A 30 -15.422 -11.725 8.271 1.00 0.43 C ATOM 497 O ALA A 30 -15.904 -10.675 8.692 1.00 0.48 O ATOM 498 CB ALA A 30 -15.903 -14.075 9.035 1.00 0.69 C ATOM 0 H ALA A 30 -15.373 -14.136 6.605 1.00 0.62 H new ATOM 0 HA ALA A 30 -17.329 -12.701 8.235 1.00 0.60 H new ATOM 0 HB1 ALA A 30 -16.045 -13.727 10.058 1.00 0.69 H new ATOM 0 HB2 ALA A 30 -16.533 -14.946 8.857 1.00 0.69 H new ATOM 0 HB3 ALA A 30 -14.858 -14.347 8.886 1.00 0.69 H new ATOM 504 N ASN A 31 -14.131 -11.830 7.958 1.00 0.35 N ATOM 505 CA ASN A 31 -13.190 -10.733 8.123 1.00 0.30 C ATOM 506 C ASN A 31 -13.227 -9.796 6.913 1.00 0.24 C ATOM 507 O ASN A 31 -12.200 -9.273 6.494 1.00 0.28 O ATOM 508 CB ASN A 31 -11.780 -11.295 8.382 1.00 0.47 C ATOM 509 CG ASN A 31 -11.107 -10.490 9.483 1.00 1.13 C ATOM 510 OD1 ASN A 31 -10.677 -9.361 9.285 1.00 2.27 O ATOM 511 ND2 ASN A 31 -11.054 -11.044 10.687 1.00 1.93 N ATOM 0 H ASN A 31 -13.712 -12.681 7.583 1.00 0.35 H new ATOM 0 HA ASN A 31 -13.478 -10.136 8.989 1.00 0.30 H new ATOM 0 HB2 ASN A 31 -11.843 -12.344 8.671 1.00 0.47 H new ATOM 0 HB3 ASN A 31 -11.186 -11.250 7.469 1.00 0.47 H new ATOM 0 HD21 ASN A 31 -10.650 -10.528 11.468 1.00 1.93 H new ATOM 0 HD22 ASN A 31 -11.418 -11.986 10.831 1.00 1.93 H new ATOM 518 N LEU A 32 -14.410 -9.560 6.337 1.00 0.24 N ATOM 519 CA LEU A 32 -14.566 -8.724 5.149 1.00 0.32 C ATOM 520 C LEU A 32 -14.127 -7.283 5.442 1.00 0.33 C ATOM 521 O LEU A 32 -13.719 -6.540 4.553 1.00 0.39 O ATOM 522 CB LEU A 32 -16.000 -8.878 4.596 1.00 0.46 C ATOM 523 CG LEU A 32 -16.987 -7.736 4.848 1.00 0.52 C ATOM 524 CD1 LEU A 32 -16.717 -6.530 3.934 1.00 0.73 C ATOM 525 CD2 LEU A 32 -18.401 -8.250 4.551 1.00 0.55 C ATOM 0 H LEU A 32 -15.288 -9.946 6.685 1.00 0.24 H new ATOM 0 HA LEU A 32 -13.903 -9.055 4.349 1.00 0.32 H new ATOM 0 HB2 LEU A 32 -15.929 -9.028 3.519 1.00 0.46 H new ATOM 0 HB3 LEU A 32 -16.426 -9.788 5.018 1.00 0.46 H new ATOM 0 HG LEU A 32 -16.877 -7.413 5.883 1.00 0.52 H new ATOM 0 HD11 LEU A 32 -17.441 -5.743 4.147 1.00 0.73 H new ATOM 0 HD12 LEU A 32 -15.710 -6.155 4.114 1.00 0.73 H new ATOM 0 HD13 LEU A 32 -16.809 -6.836 2.892 1.00 0.73 H new ATOM 0 HD21 LEU A 32 -19.122 -7.451 4.724 1.00 0.55 H new ATOM 0 HD22 LEU A 32 -18.460 -8.573 3.512 1.00 0.55 H new ATOM 0 HD23 LEU A 32 -18.627 -9.091 5.206 1.00 0.55 H new ATOM 537 N LEU A 33 -14.140 -6.903 6.722 1.00 0.29 N ATOM 538 CA LEU A 33 -13.549 -5.679 7.250 1.00 0.36 C ATOM 539 C LEU A 33 -12.011 -5.709 7.255 1.00 0.69 C ATOM 540 O LEU A 33 -11.379 -4.929 7.960 1.00 1.81 O ATOM 541 CB LEU A 33 -14.066 -5.495 8.681 1.00 0.40 C ATOM 542 CG LEU A 33 -15.562 -5.170 8.741 1.00 0.40 C ATOM 543 CD1 LEU A 33 -15.956 -5.118 10.210 1.00 0.55 C ATOM 544 CD2 LEU A 33 -15.903 -3.812 8.126 1.00 0.46 C ATOM 0 H LEU A 33 -14.583 -7.467 7.447 1.00 0.29 H new ATOM 0 HA LEU A 33 -13.838 -4.849 6.605 1.00 0.36 H new ATOM 0 HB2 LEU A 33 -13.875 -6.405 9.250 1.00 0.40 H new ATOM 0 HB3 LEU A 33 -13.506 -4.694 9.163 1.00 0.40 H new ATOM 0 HG LEU A 33 -16.095 -5.935 8.176 1.00 0.40 H new ATOM 0 HD11 LEU A 33 -17.018 -4.888 10.294 1.00 0.55 H new ATOM 0 HD12 LEU A 33 -15.756 -6.083 10.675 1.00 0.55 H new ATOM 0 HD13 LEU A 33 -15.377 -4.345 10.715 1.00 0.55 H new ATOM 0 HD21 LEU A 33 -16.977 -3.639 8.199 1.00 0.46 H new ATOM 0 HD22 LEU A 33 -15.372 -3.026 8.663 1.00 0.46 H new ATOM 0 HD23 LEU A 33 -15.604 -3.802 7.078 1.00 0.46 H new ATOM 556 N THR A 34 -11.368 -6.576 6.483 1.00 0.32 N ATOM 557 CA THR A 34 -9.943 -6.496 6.232 1.00 0.25 C ATOM 558 C THR A 34 -9.713 -6.936 4.795 1.00 0.24 C ATOM 559 O THR A 34 -10.403 -7.805 4.267 1.00 0.27 O ATOM 560 CB THR A 34 -9.158 -7.340 7.242 1.00 0.26 C ATOM 561 OG1 THR A 34 -9.279 -6.760 8.521 1.00 0.48 O ATOM 562 CG2 THR A 34 -7.664 -7.349 6.935 1.00 0.33 C ATOM 0 H THR A 34 -11.827 -7.357 6.013 1.00 0.32 H new ATOM 0 HA THR A 34 -9.579 -5.477 6.361 1.00 0.25 H new ATOM 0 HB THR A 34 -9.561 -8.351 7.192 1.00 0.26 H new ATOM 0 HG1 THR A 34 -9.891 -5.996 8.477 1.00 0.48 H new ATOM 0 HG21 THR A 34 -7.144 -7.958 7.674 1.00 0.33 H new ATOM 0 HG22 THR A 34 -7.499 -7.765 5.941 1.00 0.33 H new ATOM 0 HG23 THR A 34 -7.279 -6.330 6.970 1.00 0.33 H new ATOM 570 N TRP A 35 -8.759 -6.274 4.154 1.00 0.22 N ATOM 571 CA TRP A 35 -8.448 -6.460 2.752 1.00 0.21 C ATOM 572 C TRP A 35 -7.034 -7.000 2.681 1.00 0.18 C ATOM 573 O TRP A 35 -6.188 -6.630 3.496 1.00 0.21 O ATOM 574 CB TRP A 35 -8.509 -5.118 2.018 1.00 0.22 C ATOM 575 CG TRP A 35 -9.833 -4.427 1.950 1.00 0.20 C ATOM 576 CD1 TRP A 35 -10.696 -4.245 2.975 1.00 0.22 C ATOM 577 CD2 TRP A 35 -10.441 -3.764 0.803 1.00 0.21 C ATOM 578 NE1 TRP A 35 -11.819 -3.594 2.528 1.00 0.22 N ATOM 579 CE2 TRP A 35 -11.709 -3.248 1.200 1.00 0.20 C ATOM 580 CE3 TRP A 35 -10.039 -3.528 -0.530 1.00 0.28 C ATOM 581 CZ2 TRP A 35 -12.538 -2.547 0.318 1.00 0.23 C ATOM 582 CZ3 TRP A 35 -10.870 -2.837 -1.428 1.00 0.32 C ATOM 583 CH2 TRP A 35 -12.119 -2.354 -1.003 1.00 0.29 C ATOM 0 H TRP A 35 -8.169 -5.578 4.609 1.00 0.22 H new ATOM 0 HA TRP A 35 -9.161 -7.142 2.288 1.00 0.21 H new ATOM 0 HB2 TRP A 35 -7.801 -4.441 2.496 1.00 0.22 H new ATOM 0 HB3 TRP A 35 -8.160 -5.277 0.998 1.00 0.22 H new ATOM 0 HD1 TRP A 35 -10.527 -4.564 3.993 1.00 0.22 H new ATOM 0 HE1 TRP A 35 -12.634 -3.392 3.108 1.00 0.22 H new ATOM 0 HE3 TRP A 35 -9.076 -3.885 -0.865 1.00 0.28 H new ATOM 0 HZ2 TRP A 35 -13.489 -2.160 0.652 1.00 0.23 H new ATOM 0 HZ3 TRP A 35 -10.548 -2.677 -2.446 1.00 0.32 H new ATOM 0 HH2 TRP A 35 -12.759 -1.831 -1.699 1.00 0.29 H new ATOM 594 N GLN A 36 -6.744 -7.820 1.680 1.00 0.14 N ATOM 595 CA GLN A 36 -5.376 -8.214 1.412 1.00 0.25 C ATOM 596 C GLN A 36 -5.186 -8.239 -0.091 1.00 0.29 C ATOM 597 O GLN A 36 -6.140 -8.485 -0.827 1.00 0.45 O ATOM 598 CB GLN A 36 -5.059 -9.559 2.081 1.00 0.42 C ATOM 599 CG GLN A 36 -5.967 -10.715 1.635 1.00 0.77 C ATOM 600 CD GLN A 36 -5.582 -12.024 2.325 1.00 1.01 C ATOM 601 OE1 GLN A 36 -4.639 -12.079 3.112 1.00 1.83 O ATOM 602 NE2 GLN A 36 -6.270 -13.114 2.015 1.00 1.46 N ATOM 0 H GLN A 36 -7.436 -8.221 1.046 1.00 0.14 H new ATOM 0 HA GLN A 36 -4.672 -7.500 1.839 1.00 0.25 H new ATOM 0 HB2 GLN A 36 -4.023 -9.823 1.868 1.00 0.42 H new ATOM 0 HB3 GLN A 36 -5.142 -9.443 3.162 1.00 0.42 H new ATOM 0 HG2 GLN A 36 -7.005 -10.473 1.863 1.00 0.77 H new ATOM 0 HG3 GLN A 36 -5.898 -10.838 0.554 1.00 0.77 H new ATOM 0 HE21 GLN A 36 -7.050 -13.056 1.361 1.00 1.46 H new ATOM 0 HE22 GLN A 36 -6.019 -14.011 2.431 1.00 1.46 H new ATOM 611 N GLY A 37 -3.965 -7.966 -0.540 1.00 0.23 N ATOM 612 CA GLY A 37 -3.608 -8.111 -1.937 1.00 0.22 C ATOM 613 C GLY A 37 -2.172 -7.679 -2.147 1.00 0.21 C ATOM 614 O GLY A 37 -1.399 -7.632 -1.197 1.00 0.25 O ATOM 0 H GLY A 37 -3.203 -7.640 0.055 1.00 0.23 H new ATOM 0 HA2 GLY A 37 -3.735 -9.148 -2.248 1.00 0.22 H new ATOM 0 HA3 GLY A 37 -4.273 -7.509 -2.556 1.00 0.22 H new ATOM 618 N LEU A 38 -1.790 -7.359 -3.376 1.00 0.23 N ATOM 619 CA LEU A 38 -0.477 -6.818 -3.662 1.00 0.24 C ATOM 620 C LEU A 38 -0.656 -5.597 -4.529 1.00 0.26 C ATOM 621 O LEU A 38 -1.698 -5.425 -5.161 1.00 0.31 O ATOM 622 CB LEU A 38 0.452 -7.881 -4.277 1.00 0.25 C ATOM 623 CG LEU A 38 0.043 -8.432 -5.659 1.00 0.27 C ATOM 624 CD1 LEU A 38 0.362 -7.486 -6.821 1.00 0.39 C ATOM 625 CD2 LEU A 38 0.813 -9.729 -5.916 1.00 0.25 C ATOM 0 H LEU A 38 -2.384 -7.469 -4.198 1.00 0.23 H new ATOM 0 HA LEU A 38 0.023 -6.517 -2.741 1.00 0.24 H new ATOM 0 HB2 LEU A 38 1.451 -7.454 -4.361 1.00 0.25 H new ATOM 0 HB3 LEU A 38 0.521 -8.718 -3.582 1.00 0.25 H new ATOM 0 HG LEU A 38 -1.037 -8.572 -5.625 1.00 0.27 H new ATOM 0 HD11 LEU A 38 0.046 -7.942 -7.759 1.00 0.39 H new ATOM 0 HD12 LEU A 38 -0.168 -6.544 -6.679 1.00 0.39 H new ATOM 0 HD13 LEU A 38 1.435 -7.298 -6.853 1.00 0.39 H new ATOM 0 HD21 LEU A 38 0.534 -10.131 -6.890 1.00 0.25 H new ATOM 0 HD22 LEU A 38 1.884 -9.526 -5.900 1.00 0.25 H new ATOM 0 HD23 LEU A 38 0.570 -10.456 -5.141 1.00 0.25 H new ATOM 637 N ILE A 39 0.366 -4.757 -4.570 1.00 0.24 N ATOM 638 CA ILE A 39 0.355 -3.572 -5.390 1.00 0.22 C ATOM 639 C ILE A 39 1.547 -3.682 -6.327 1.00 0.23 C ATOM 640 O ILE A 39 2.686 -3.834 -5.884 1.00 0.32 O ATOM 641 CB ILE A 39 0.287 -2.301 -4.523 1.00 0.20 C ATOM 642 CG1 ILE A 39 1.292 -2.314 -3.355 1.00 0.20 C ATOM 643 CG2 ILE A 39 -1.147 -2.169 -3.986 1.00 0.20 C ATOM 644 CD1 ILE A 39 1.184 -1.058 -2.491 1.00 0.18 C ATOM 0 H ILE A 39 1.224 -4.884 -4.033 1.00 0.24 H new ATOM 0 HA ILE A 39 -0.540 -3.489 -6.007 1.00 0.22 H new ATOM 0 HB ILE A 39 0.557 -1.447 -5.144 1.00 0.20 H new ATOM 0 HG12 ILE A 39 1.118 -3.195 -2.737 1.00 0.20 H new ATOM 0 HG13 ILE A 39 2.305 -2.396 -3.749 1.00 0.20 H new ATOM 0 HG21 ILE A 39 -1.223 -1.275 -3.367 1.00 0.20 H new ATOM 0 HG22 ILE A 39 -1.843 -2.092 -4.822 1.00 0.20 H new ATOM 0 HG23 ILE A 39 -1.394 -3.046 -3.388 1.00 0.20 H new ATOM 0 HD11 ILE A 39 1.911 -1.110 -1.680 1.00 0.18 H new ATOM 0 HD12 ILE A 39 1.385 -0.178 -3.102 1.00 0.18 H new ATOM 0 HD13 ILE A 39 0.179 -0.989 -2.074 1.00 0.18 H new ATOM 656 N VAL A 40 1.250 -3.728 -7.626 1.00 0.24 N ATOM 657 CA VAL A 40 2.234 -3.835 -8.687 1.00 0.24 C ATOM 658 C VAL A 40 2.770 -2.423 -8.912 1.00 0.32 C ATOM 659 O VAL A 40 1.992 -1.527 -9.238 1.00 0.47 O ATOM 660 CB VAL A 40 1.601 -4.392 -9.977 1.00 0.24 C ATOM 661 CG1 VAL A 40 2.681 -4.782 -10.983 1.00 0.25 C ATOM 662 CG2 VAL A 40 0.718 -5.616 -9.716 1.00 0.31 C ATOM 0 H VAL A 40 0.291 -3.690 -7.971 1.00 0.24 H new ATOM 0 HA VAL A 40 3.033 -4.524 -8.413 1.00 0.24 H new ATOM 0 HB VAL A 40 0.977 -3.594 -10.378 1.00 0.24 H new ATOM 0 HG11 VAL A 40 2.213 -5.173 -11.886 1.00 0.25 H new ATOM 0 HG12 VAL A 40 3.278 -3.905 -11.234 1.00 0.25 H new ATOM 0 HG13 VAL A 40 3.324 -5.547 -10.548 1.00 0.25 H new ATOM 0 HG21 VAL A 40 0.297 -5.968 -10.658 1.00 0.31 H new ATOM 0 HG22 VAL A 40 1.318 -6.408 -9.268 1.00 0.31 H new ATOM 0 HG23 VAL A 40 -0.090 -5.344 -9.037 1.00 0.31 H new ATOM 672 N PRO A 41 4.065 -2.186 -8.682 1.00 0.45 N ATOM 673 CA PRO A 41 4.672 -0.904 -8.975 1.00 0.55 C ATOM 674 C PRO A 41 4.983 -0.752 -10.467 1.00 0.43 C ATOM 675 O PRO A 41 4.875 -1.709 -11.230 1.00 0.43 O ATOM 676 CB PRO A 41 5.957 -0.889 -8.158 1.00 0.79 C ATOM 677 CG PRO A 41 6.246 -2.330 -7.729 1.00 0.74 C ATOM 678 CD PRO A 41 5.021 -3.137 -8.147 1.00 0.64 C ATOM 0 HA PRO A 41 4.005 -0.079 -8.725 1.00 0.55 H new ATOM 0 HB2 PRO A 41 6.782 -0.492 -8.749 1.00 0.79 H new ATOM 0 HB3 PRO A 41 5.850 -0.244 -7.286 1.00 0.79 H new ATOM 0 HG2 PRO A 41 7.148 -2.709 -8.210 1.00 0.74 H new ATOM 0 HG3 PRO A 41 6.408 -2.393 -6.653 1.00 0.74 H new ATOM 0 HD2 PRO A 41 5.285 -3.884 -8.895 1.00 0.64 H new ATOM 0 HD3 PRO A 41 4.601 -3.673 -7.296 1.00 0.64 H new ATOM 686 N ASP A 42 5.458 0.441 -10.844 1.00 0.44 N ATOM 687 CA ASP A 42 6.013 0.732 -12.167 1.00 0.46 C ATOM 688 C ASP A 42 7.434 1.273 -11.994 1.00 0.43 C ATOM 689 O ASP A 42 8.374 0.735 -12.568 1.00 0.47 O ATOM 690 CB ASP A 42 5.175 1.748 -12.957 1.00 0.58 C ATOM 691 CG ASP A 42 3.716 1.344 -13.129 1.00 0.73 C ATOM 692 OD1 ASP A 42 3.416 0.605 -14.090 1.00 1.14 O ATOM 693 OD2 ASP A 42 2.916 1.829 -12.296 1.00 1.67 O ATOM 0 H ASP A 42 5.466 1.249 -10.221 1.00 0.44 H new ATOM 0 HA ASP A 42 6.009 -0.196 -12.738 1.00 0.46 H new ATOM 0 HB2 ASP A 42 5.218 2.712 -12.450 1.00 0.58 H new ATOM 0 HB3 ASP A 42 5.622 1.886 -13.941 1.00 0.58 H new ATOM 698 N ASN A 43 7.588 2.349 -11.211 1.00 0.41 N ATOM 699 CA ASN A 43 8.874 3.008 -10.974 1.00 0.40 C ATOM 700 C ASN A 43 9.914 2.068 -10.357 1.00 0.37 C ATOM 701 O ASN A 43 10.972 1.868 -10.950 1.00 0.42 O ATOM 702 CB ASN A 43 8.709 4.273 -10.111 1.00 0.41 C ATOM 703 CG ASN A 43 8.775 5.546 -10.941 1.00 0.41 C ATOM 704 OD1 ASN A 43 9.856 6.064 -11.194 1.00 0.52 O ATOM 705 ND2 ASN A 43 7.640 6.061 -11.391 1.00 0.56 N ATOM 0 H ASN A 43 6.811 2.790 -10.719 1.00 0.41 H new ATOM 0 HA ASN A 43 9.249 3.304 -11.954 1.00 0.40 H new ATOM 0 HB2 ASN A 43 7.754 4.232 -9.587 1.00 0.41 H new ATOM 0 HB3 ASN A 43 9.489 4.296 -9.350 1.00 0.41 H new ATOM 0 HD21 ASN A 43 7.654 6.907 -11.961 1.00 0.56 H new ATOM 0 HD22 ASN A 43 6.752 5.612 -11.167 1.00 0.56 H new ATOM 712 N PRO A 44 9.701 1.537 -9.141 1.00 0.31 N ATOM 713 CA PRO A 44 10.657 0.618 -8.552 1.00 0.31 C ATOM 714 C PRO A 44 10.564 -0.729 -9.281 1.00 0.31 C ATOM 715 O PRO A 44 9.555 -1.012 -9.923 1.00 0.33 O ATOM 716 CB PRO A 44 10.269 0.534 -7.074 1.00 0.30 C ATOM 717 CG PRO A 44 8.759 0.699 -7.136 1.00 0.27 C ATOM 718 CD PRO A 44 8.564 1.724 -8.258 1.00 0.28 C ATOM 0 HA PRO A 44 11.695 0.937 -8.642 1.00 0.31 H new ATOM 0 HB2 PRO A 44 10.558 -0.418 -6.629 1.00 0.30 H new ATOM 0 HB3 PRO A 44 10.742 1.318 -6.483 1.00 0.30 H new ATOM 0 HG2 PRO A 44 8.260 -0.244 -7.361 1.00 0.27 H new ATOM 0 HG3 PRO A 44 8.354 1.056 -6.189 1.00 0.27 H new ATOM 0 HD2 PRO A 44 7.624 1.558 -8.785 1.00 0.28 H new ATOM 0 HD3 PRO A 44 8.534 2.740 -7.864 1.00 0.28 H new ATOM 726 N PRO A 45 11.610 -1.561 -9.175 1.00 0.32 N ATOM 727 CA PRO A 45 11.852 -2.732 -10.014 1.00 0.37 C ATOM 728 C PRO A 45 10.794 -3.838 -9.877 1.00 0.44 C ATOM 729 O PRO A 45 11.026 -4.872 -9.248 1.00 0.71 O ATOM 730 CB PRO A 45 13.265 -3.207 -9.664 1.00 0.41 C ATOM 731 CG PRO A 45 13.505 -2.614 -8.290 1.00 0.35 C ATOM 732 CD PRO A 45 12.774 -1.286 -8.364 1.00 0.34 C ATOM 0 HA PRO A 45 11.771 -2.463 -11.067 1.00 0.37 H new ATOM 0 HB2 PRO A 45 13.331 -4.295 -9.649 1.00 0.41 H new ATOM 0 HB3 PRO A 45 13.999 -2.853 -10.388 1.00 0.41 H new ATOM 0 HG2 PRO A 45 13.108 -3.251 -7.500 1.00 0.35 H new ATOM 0 HG3 PRO A 45 14.568 -2.480 -8.087 1.00 0.35 H new ATOM 0 HD2 PRO A 45 12.493 -0.932 -7.372 1.00 0.34 H new ATOM 0 HD3 PRO A 45 13.398 -0.513 -8.813 1.00 0.34 H new ATOM 740 N TYR A 46 9.644 -3.663 -10.528 1.00 0.37 N ATOM 741 CA TYR A 46 8.564 -4.636 -10.485 1.00 0.45 C ATOM 742 C TYR A 46 8.887 -5.883 -11.303 1.00 0.57 C ATOM 743 O TYR A 46 8.202 -6.890 -11.178 1.00 0.84 O ATOM 744 CB TYR A 46 7.258 -4.019 -10.987 1.00 0.51 C ATOM 745 CG TYR A 46 7.252 -3.712 -12.468 1.00 0.69 C ATOM 746 CD1 TYR A 46 7.560 -2.417 -12.913 1.00 2.27 C ATOM 747 CD2 TYR A 46 6.977 -4.729 -13.401 1.00 2.10 C ATOM 748 CE1 TYR A 46 7.557 -2.120 -14.286 1.00 2.53 C ATOM 749 CE2 TYR A 46 6.981 -4.445 -14.776 1.00 2.16 C ATOM 750 CZ TYR A 46 7.259 -3.136 -15.225 1.00 1.38 C ATOM 751 OH TYR A 46 7.237 -2.866 -16.559 1.00 1.75 O ATOM 0 H TYR A 46 9.440 -2.842 -11.098 1.00 0.37 H new ATOM 0 HA TYR A 46 8.447 -4.934 -9.443 1.00 0.45 H new ATOM 0 HB2 TYR A 46 6.437 -4.701 -10.764 1.00 0.51 H new ATOM 0 HB3 TYR A 46 7.067 -3.099 -10.435 1.00 0.51 H new ATOM 0 HD1 TYR A 46 7.800 -1.645 -12.197 1.00 2.27 H new ATOM 0 HD2 TYR A 46 6.762 -5.730 -13.058 1.00 2.10 H new ATOM 0 HE1 TYR A 46 7.781 -1.119 -14.624 1.00 2.53 H new ATOM 0 HE2 TYR A 46 6.771 -5.228 -15.490 1.00 2.16 H new ATOM 0 HH TYR A 46 7.015 -3.682 -17.054 1.00 1.75 H new ATOM 761 N ASP A 47 9.906 -5.853 -12.161 1.00 0.61 N ATOM 762 CA ASP A 47 10.267 -7.039 -12.937 1.00 0.73 C ATOM 763 C ASP A 47 10.611 -8.201 -12.007 1.00 0.74 C ATOM 764 O ASP A 47 10.449 -9.367 -12.359 1.00 0.97 O ATOM 765 CB ASP A 47 11.432 -6.732 -13.890 1.00 0.80 C ATOM 766 CG ASP A 47 10.958 -6.710 -15.342 1.00 1.26 C ATOM 767 OD1 ASP A 47 9.921 -6.057 -15.588 1.00 2.10 O ATOM 768 OD2 ASP A 47 11.637 -7.346 -16.176 1.00 2.53 O ATOM 0 H ASP A 47 10.488 -5.034 -12.335 1.00 0.61 H new ATOM 0 HA ASP A 47 9.408 -7.330 -13.542 1.00 0.73 H new ATOM 0 HB2 ASP A 47 11.873 -5.769 -13.633 1.00 0.80 H new ATOM 0 HB3 ASP A 47 12.213 -7.483 -13.770 1.00 0.80 H new ATOM 773 N LYS A 48 11.090 -7.893 -10.798 1.00 0.57 N ATOM 774 CA LYS A 48 11.397 -8.907 -9.805 1.00 0.56 C ATOM 775 C LYS A 48 10.158 -9.377 -9.046 1.00 0.34 C ATOM 776 O LYS A 48 10.202 -10.457 -8.462 1.00 0.34 O ATOM 777 CB LYS A 48 12.460 -8.356 -8.845 1.00 0.77 C ATOM 778 CG LYS A 48 13.800 -8.127 -9.544 1.00 1.12 C ATOM 779 CD LYS A 48 14.336 -9.432 -10.121 1.00 2.26 C ATOM 780 CE LYS A 48 15.837 -9.286 -10.396 1.00 2.67 C ATOM 781 NZ LYS A 48 16.373 -10.437 -11.150 1.00 3.50 N ATOM 0 H LYS A 48 11.272 -6.938 -10.489 1.00 0.57 H new ATOM 0 HA LYS A 48 11.784 -9.786 -10.320 1.00 0.56 H new ATOM 0 HB2 LYS A 48 12.110 -7.417 -8.417 1.00 0.77 H new ATOM 0 HB3 LYS A 48 12.597 -9.052 -8.018 1.00 0.77 H new ATOM 0 HG2 LYS A 48 13.679 -7.393 -10.341 1.00 1.12 H new ATOM 0 HG3 LYS A 48 14.519 -7.714 -8.837 1.00 1.12 H new ATOM 0 HD2 LYS A 48 14.160 -10.251 -9.423 1.00 2.26 H new ATOM 0 HD3 LYS A 48 13.808 -9.680 -11.042 1.00 2.26 H new ATOM 0 HE2 LYS A 48 16.016 -8.369 -10.958 1.00 2.67 H new ATOM 0 HE3 LYS A 48 16.372 -9.190 -9.451 1.00 2.67 H new ATOM 0 HZ1 LYS A 48 17.391 -10.300 -11.316 1.00 3.50 H new ATOM 0 HZ2 LYS A 48 16.226 -11.309 -10.603 1.00 3.50 H new ATOM 0 HZ3 LYS A 48 15.881 -10.514 -12.063 1.00 3.50 H new ATOM 795 N GLY A 49 9.090 -8.582 -8.974 1.00 0.34 N ATOM 796 CA GLY A 49 7.973 -8.872 -8.091 1.00 0.35 C ATOM 797 C GLY A 49 7.171 -7.612 -7.771 1.00 0.35 C ATOM 798 O GLY A 49 7.084 -6.686 -8.571 1.00 0.41 O ATOM 0 H GLY A 49 8.980 -7.729 -9.522 1.00 0.34 H new ATOM 0 HA2 GLY A 49 7.321 -9.611 -8.558 1.00 0.35 H new ATOM 0 HA3 GLY A 49 8.344 -9.313 -7.166 1.00 0.35 H new ATOM 802 N ALA A 50 6.540 -7.590 -6.603 1.00 0.33 N ATOM 803 CA ALA A 50 5.626 -6.561 -6.146 1.00 0.33 C ATOM 804 C ALA A 50 5.716 -6.528 -4.624 1.00 0.24 C ATOM 805 O ALA A 50 6.603 -7.147 -4.036 1.00 0.25 O ATOM 806 CB ALA A 50 4.204 -6.910 -6.616 1.00 0.39 C ATOM 0 H ALA A 50 6.662 -8.333 -5.915 1.00 0.33 H new ATOM 0 HA ALA A 50 5.878 -5.581 -6.550 1.00 0.33 H new ATOM 0 HB1 ALA A 50 3.510 -6.141 -6.277 1.00 0.39 H new ATOM 0 HB2 ALA A 50 4.183 -6.963 -7.705 1.00 0.39 H new ATOM 0 HB3 ALA A 50 3.910 -7.874 -6.200 1.00 0.39 H new ATOM 812 N PHE A 51 4.781 -5.845 -3.968 1.00 0.29 N ATOM 813 CA PHE A 51 4.746 -5.797 -2.520 1.00 0.37 C ATOM 814 C PHE A 51 3.351 -6.205 -2.061 1.00 0.27 C ATOM 815 O PHE A 51 2.363 -5.633 -2.523 1.00 0.27 O ATOM 816 CB PHE A 51 5.143 -4.394 -2.068 1.00 0.67 C ATOM 817 CG PHE A 51 6.587 -4.047 -2.389 1.00 0.75 C ATOM 818 CD1 PHE A 51 6.896 -3.243 -3.502 1.00 1.17 C ATOM 819 CD2 PHE A 51 7.630 -4.591 -1.615 1.00 2.36 C ATOM 820 CE1 PHE A 51 8.237 -3.004 -3.852 1.00 1.21 C ATOM 821 CE2 PHE A 51 8.971 -4.334 -1.952 1.00 2.66 C ATOM 822 CZ PHE A 51 9.276 -3.547 -3.076 1.00 1.47 C ATOM 0 H PHE A 51 4.037 -5.317 -4.424 1.00 0.29 H new ATOM 0 HA PHE A 51 5.455 -6.491 -2.069 1.00 0.37 H new ATOM 0 HB2 PHE A 51 4.487 -3.666 -2.545 1.00 0.67 H new ATOM 0 HB3 PHE A 51 4.986 -4.308 -0.993 1.00 0.67 H new ATOM 0 HD1 PHE A 51 6.101 -2.808 -4.089 1.00 1.17 H new ATOM 0 HD2 PHE A 51 7.399 -5.208 -0.759 1.00 2.36 H new ATOM 0 HE1 PHE A 51 8.469 -2.402 -4.718 1.00 1.21 H new ATOM 0 HE2 PHE A 51 9.767 -4.742 -1.347 1.00 2.66 H new ATOM 0 HZ PHE A 51 10.306 -3.360 -3.343 1.00 1.47 H new ATOM 832 N ARG A 52 3.252 -7.216 -1.193 1.00 0.27 N ATOM 833 CA ARG A 52 1.965 -7.643 -0.654 1.00 0.23 C ATOM 834 C ARG A 52 1.658 -6.788 0.559 1.00 0.23 C ATOM 835 O ARG A 52 2.514 -6.624 1.432 1.00 0.31 O ATOM 836 CB ARG A 52 1.974 -9.133 -0.294 1.00 0.31 C ATOM 837 CG ARG A 52 0.733 -9.549 0.501 1.00 0.66 C ATOM 838 CD ARG A 52 0.651 -11.066 0.615 1.00 0.49 C ATOM 839 NE ARG A 52 -0.501 -11.463 1.440 1.00 1.03 N ATOM 840 CZ ARG A 52 -0.951 -12.717 1.535 1.00 1.37 C ATOM 841 NH1 ARG A 52 -2.016 -13.001 2.294 1.00 1.95 N ATOM 842 NH2 ARG A 52 -0.327 -13.683 0.856 1.00 1.68 N ATOM 0 H ARG A 52 4.050 -7.752 -0.851 1.00 0.27 H new ATOM 0 HA ARG A 52 1.189 -7.513 -1.408 1.00 0.23 H new ATOM 0 HB2 ARG A 52 2.032 -9.724 -1.208 1.00 0.31 H new ATOM 0 HB3 ARG A 52 2.867 -9.358 0.288 1.00 0.31 H new ATOM 0 HG2 ARG A 52 0.767 -9.106 1.496 1.00 0.66 H new ATOM 0 HG3 ARG A 52 -0.163 -9.167 0.012 1.00 0.66 H new ATOM 0 HD2 ARG A 52 0.563 -11.506 -0.378 1.00 0.49 H new ATOM 0 HD3 ARG A 52 1.570 -11.453 1.055 1.00 0.49 H new ATOM 0 HE ARG A 52 -0.984 -10.738 1.970 1.00 1.03 H new ATOM 0 HH11 ARG A 52 -2.491 -12.257 2.806 1.00 1.95 H new ATOM 0 HH12 ARG A 52 -2.353 -13.961 2.361 1.00 1.95 H new ATOM 0 HH21 ARG A 52 0.481 -13.458 0.275 1.00 1.68 H new ATOM 0 HH22 ARG A 52 -0.658 -14.646 0.918 1.00 1.68 H new ATOM 856 N ILE A 53 0.430 -6.284 0.632 1.00 0.17 N ATOM 857 CA ILE A 53 -0.024 -5.428 1.702 1.00 0.16 C ATOM 858 C ILE A 53 -1.377 -5.906 2.202 1.00 0.16 C ATOM 859 O ILE A 53 -2.101 -6.630 1.518 1.00 0.22 O ATOM 860 CB ILE A 53 -0.028 -3.956 1.254 1.00 0.16 C ATOM 861 CG1 ILE A 53 -1.073 -3.588 0.189 1.00 0.16 C ATOM 862 CG2 ILE A 53 1.352 -3.616 0.689 1.00 0.19 C ATOM 863 CD1 ILE A 53 -1.373 -2.088 0.263 1.00 0.18 C ATOM 0 H ILE A 53 -0.286 -6.468 -0.070 1.00 0.17 H new ATOM 0 HA ILE A 53 0.667 -5.487 2.543 1.00 0.16 H new ATOM 0 HB ILE A 53 -0.288 -3.384 2.145 1.00 0.16 H new ATOM 0 HG12 ILE A 53 -0.703 -3.847 -0.803 1.00 0.16 H new ATOM 0 HG13 ILE A 53 -1.987 -4.161 0.348 1.00 0.16 H new ATOM 0 HG21 ILE A 53 1.367 -2.575 0.366 1.00 0.19 H new ATOM 0 HG22 ILE A 53 2.108 -3.768 1.459 1.00 0.19 H new ATOM 0 HG23 ILE A 53 1.566 -4.263 -0.162 1.00 0.19 H new ATOM 0 HD11 ILE A 53 -2.114 -1.827 -0.493 1.00 0.18 H new ATOM 0 HD12 ILE A 53 -1.761 -1.843 1.252 1.00 0.18 H new ATOM 0 HD13 ILE A 53 -0.458 -1.525 0.083 1.00 0.18 H new ATOM 875 N GLU A 54 -1.706 -5.504 3.421 1.00 0.15 N ATOM 876 CA GLU A 54 -2.919 -5.901 4.100 1.00 0.16 C ATOM 877 C GLU A 54 -3.418 -4.656 4.810 1.00 0.19 C ATOM 878 O GLU A 54 -2.619 -3.953 5.434 1.00 0.26 O ATOM 879 CB GLU A 54 -2.547 -7.003 5.083 1.00 0.23 C ATOM 880 CG GLU A 54 -3.708 -7.543 5.918 1.00 0.29 C ATOM 881 CD GLU A 54 -3.081 -8.267 7.101 1.00 0.58 C ATOM 882 OE1 GLU A 54 -2.914 -7.611 8.154 1.00 2.08 O ATOM 883 OE2 GLU A 54 -2.531 -9.371 6.898 1.00 2.16 O ATOM 0 H GLU A 54 -1.120 -4.878 3.973 1.00 0.15 H new ATOM 0 HA GLU A 54 -3.696 -6.283 3.437 1.00 0.16 H new ATOM 0 HB2 GLU A 54 -2.103 -7.829 4.528 1.00 0.23 H new ATOM 0 HB3 GLU A 54 -1.780 -6.623 5.758 1.00 0.23 H new ATOM 0 HG2 GLU A 54 -4.354 -6.733 6.256 1.00 0.29 H new ATOM 0 HG3 GLU A 54 -4.327 -8.221 5.331 1.00 0.29 H new ATOM 890 N ILE A 55 -4.706 -4.357 4.659 1.00 0.22 N ATOM 891 CA ILE A 55 -5.313 -3.118 5.114 1.00 0.24 C ATOM 892 C ILE A 55 -6.434 -3.508 6.065 1.00 0.21 C ATOM 893 O ILE A 55 -7.445 -4.067 5.642 1.00 0.36 O ATOM 894 CB ILE A 55 -5.889 -2.330 3.922 1.00 0.25 C ATOM 895 CG1 ILE A 55 -4.879 -2.152 2.774 1.00 0.39 C ATOM 896 CG2 ILE A 55 -6.463 -0.983 4.379 1.00 0.35 C ATOM 897 CD1 ILE A 55 -5.470 -2.668 1.466 1.00 0.67 C ATOM 0 H ILE A 55 -5.368 -4.987 4.206 1.00 0.22 H new ATOM 0 HA ILE A 55 -4.576 -2.482 5.605 1.00 0.24 H new ATOM 0 HB ILE A 55 -6.704 -2.930 3.517 1.00 0.25 H new ATOM 0 HG12 ILE A 55 -4.616 -1.099 2.672 1.00 0.39 H new ATOM 0 HG13 ILE A 55 -3.959 -2.690 3.003 1.00 0.39 H new ATOM 0 HG21 ILE A 55 -6.863 -0.447 3.518 1.00 0.35 H new ATOM 0 HG22 ILE A 55 -7.260 -1.154 5.103 1.00 0.35 H new ATOM 0 HG23 ILE A 55 -5.674 -0.390 4.841 1.00 0.35 H new ATOM 0 HD11 ILE A 55 -4.746 -2.536 0.662 1.00 0.67 H new ATOM 0 HD12 ILE A 55 -5.710 -3.726 1.568 1.00 0.67 H new ATOM 0 HD13 ILE A 55 -6.377 -2.111 1.232 1.00 0.67 H new ATOM 909 N ASN A 56 -6.266 -3.245 7.353 1.00 0.43 N ATOM 910 CA ASN A 56 -7.242 -3.666 8.339 1.00 0.43 C ATOM 911 C ASN A 56 -8.224 -2.513 8.503 1.00 0.44 C ATOM 912 O ASN A 56 -7.814 -1.426 8.922 1.00 0.46 O ATOM 913 CB ASN A 56 -6.533 -4.012 9.659 1.00 0.59 C ATOM 914 CG ASN A 56 -5.217 -4.754 9.441 1.00 0.46 C ATOM 915 OD1 ASN A 56 -4.155 -4.151 9.545 1.00 1.14 O ATOM 916 ND2 ASN A 56 -5.260 -6.037 9.101 1.00 1.06 N ATOM 0 H ASN A 56 -5.464 -2.743 7.736 1.00 0.43 H new ATOM 0 HA ASN A 56 -7.776 -4.563 8.027 1.00 0.43 H new ATOM 0 HB2 ASN A 56 -6.341 -3.095 10.215 1.00 0.59 H new ATOM 0 HB3 ASN A 56 -7.194 -4.624 10.273 1.00 0.59 H new ATOM 0 HD21 ASN A 56 -4.395 -6.546 8.919 1.00 1.06 H new ATOM 0 HD22 ASN A 56 -6.158 -6.514 9.022 1.00 1.06 H new ATOM 923 N PHE A 57 -9.498 -2.726 8.155 1.00 0.46 N ATOM 924 CA PHE A 57 -10.493 -1.650 8.139 1.00 0.45 C ATOM 925 C PHE A 57 -11.695 -2.004 9.009 1.00 0.37 C ATOM 926 O PHE A 57 -12.695 -2.523 8.520 1.00 0.39 O ATOM 927 CB PHE A 57 -10.927 -1.312 6.704 1.00 0.47 C ATOM 928 CG PHE A 57 -11.193 0.153 6.398 1.00 0.79 C ATOM 929 CD1 PHE A 57 -11.339 1.131 7.404 1.00 2.61 C ATOM 930 CD2 PHE A 57 -11.238 0.547 5.053 1.00 1.67 C ATOM 931 CE1 PHE A 57 -11.468 2.486 7.055 1.00 2.91 C ATOM 932 CE2 PHE A 57 -11.405 1.898 4.701 1.00 1.85 C ATOM 933 CZ PHE A 57 -11.506 2.873 5.705 1.00 1.70 C ATOM 0 H PHE A 57 -9.864 -3.637 7.880 1.00 0.46 H new ATOM 0 HA PHE A 57 -10.026 -0.760 8.560 1.00 0.45 H new ATOM 0 HB2 PHE A 57 -10.154 -1.667 6.022 1.00 0.47 H new ATOM 0 HB3 PHE A 57 -11.833 -1.876 6.481 1.00 0.47 H new ATOM 0 HD1 PHE A 57 -11.352 0.838 8.443 1.00 2.61 H new ATOM 0 HD2 PHE A 57 -11.143 -0.198 4.277 1.00 1.67 H new ATOM 0 HE1 PHE A 57 -11.538 3.235 7.830 1.00 2.91 H new ATOM 0 HE2 PHE A 57 -11.455 2.184 3.661 1.00 1.85 H new ATOM 0 HZ PHE A 57 -11.612 3.915 5.441 1.00 1.70 H new ATOM 943 N PRO A 58 -11.622 -1.718 10.313 1.00 0.40 N ATOM 944 CA PRO A 58 -12.607 -2.202 11.259 1.00 0.40 C ATOM 945 C PRO A 58 -13.975 -1.564 11.015 1.00 0.35 C ATOM 946 O PRO A 58 -14.118 -0.615 10.246 1.00 0.34 O ATOM 947 CB PRO A 58 -12.028 -1.862 12.637 1.00 0.48 C ATOM 948 CG PRO A 58 -11.126 -0.658 12.362 1.00 0.52 C ATOM 949 CD PRO A 58 -10.583 -0.940 10.963 1.00 0.48 C ATOM 0 HA PRO A 58 -12.786 -3.273 11.164 1.00 0.40 H new ATOM 0 HB2 PRO A 58 -12.813 -1.619 13.353 1.00 0.48 H new ATOM 0 HB3 PRO A 58 -11.465 -2.698 13.053 1.00 0.48 H new ATOM 0 HG2 PRO A 58 -11.683 0.278 12.396 1.00 0.52 H new ATOM 0 HG3 PRO A 58 -10.325 -0.579 13.097 1.00 0.52 H new ATOM 0 HD2 PRO A 58 -10.384 -0.015 10.422 1.00 0.48 H new ATOM 0 HD3 PRO A 58 -9.644 -1.492 11.007 1.00 0.48 H new ATOM 957 N ALA A 59 -14.998 -2.058 11.721 1.00 0.35 N ATOM 958 CA ALA A 59 -16.340 -1.493 11.636 1.00 0.32 C ATOM 959 C ALA A 59 -16.318 -0.007 11.970 1.00 0.29 C ATOM 960 O ALA A 59 -17.109 0.770 11.440 1.00 0.29 O ATOM 961 CB ALA A 59 -17.297 -2.241 12.561 1.00 0.36 C ATOM 0 H ALA A 59 -14.917 -2.850 12.358 1.00 0.35 H new ATOM 0 HA ALA A 59 -16.697 -1.607 10.612 1.00 0.32 H new ATOM 0 HB1 ALA A 59 -18.293 -1.805 12.484 1.00 0.36 H new ATOM 0 HB2 ALA A 59 -17.337 -3.291 12.271 1.00 0.36 H new ATOM 0 HB3 ALA A 59 -16.945 -2.162 13.590 1.00 0.36 H new ATOM 967 N GLU A 60 -15.363 0.385 12.809 1.00 0.27 N ATOM 968 CA GLU A 60 -15.062 1.753 13.168 1.00 0.24 C ATOM 969 C GLU A 60 -14.399 2.533 12.027 1.00 0.22 C ATOM 970 O GLU A 60 -13.748 3.531 12.303 1.00 0.25 O ATOM 971 CB GLU A 60 -14.118 1.729 14.376 1.00 0.29 C ATOM 972 CG GLU A 60 -14.722 0.944 15.541 1.00 0.42 C ATOM 973 CD GLU A 60 -13.854 1.126 16.784 1.00 0.54 C ATOM 974 OE1 GLU A 60 -12.612 1.027 16.632 1.00 1.57 O ATOM 975 OE2 GLU A 60 -14.413 1.440 17.853 1.00 1.58 O ATOM 0 H GLU A 60 -14.751 -0.284 13.277 1.00 0.27 H new ATOM 0 HA GLU A 60 -16.000 2.259 13.397 1.00 0.24 H new ATOM 0 HB2 GLU A 60 -13.167 1.281 14.088 1.00 0.29 H new ATOM 0 HB3 GLU A 60 -13.906 2.750 14.694 1.00 0.29 H new ATOM 0 HG2 GLU A 60 -15.736 1.290 15.739 1.00 0.42 H new ATOM 0 HG3 GLU A 60 -14.790 -0.113 15.284 1.00 0.42 H new ATOM 982 N TYR A 61 -14.574 2.155 10.759 1.00 0.24 N ATOM 983 CA TYR A 61 -14.091 2.924 9.615 1.00 0.30 C ATOM 984 C TYR A 61 -14.455 4.413 9.731 1.00 0.26 C ATOM 985 O TYR A 61 -13.578 5.269 9.623 1.00 0.27 O ATOM 986 CB TYR A 61 -14.586 2.273 8.307 1.00 0.50 C ATOM 987 CG TYR A 61 -15.101 3.211 7.225 1.00 0.52 C ATOM 988 CD1 TYR A 61 -14.312 4.267 6.740 1.00 1.71 C ATOM 989 CD2 TYR A 61 -16.409 3.051 6.740 1.00 2.17 C ATOM 990 CE1 TYR A 61 -14.818 5.148 5.769 1.00 1.76 C ATOM 991 CE2 TYR A 61 -16.930 3.937 5.790 1.00 2.18 C ATOM 992 CZ TYR A 61 -16.131 4.986 5.281 1.00 0.64 C ATOM 993 OH TYR A 61 -16.634 5.847 4.348 1.00 0.71 O ATOM 0 H TYR A 61 -15.060 1.297 10.497 1.00 0.24 H new ATOM 0 HA TYR A 61 -13.001 2.899 9.602 1.00 0.30 H new ATOM 0 HB2 TYR A 61 -13.767 1.688 7.888 1.00 0.50 H new ATOM 0 HB3 TYR A 61 -15.383 1.573 8.557 1.00 0.50 H new ATOM 0 HD1 TYR A 61 -13.309 4.403 7.116 1.00 1.71 H new ATOM 0 HD2 TYR A 61 -17.019 2.237 7.103 1.00 2.17 H new ATOM 0 HE1 TYR A 61 -14.200 5.951 5.396 1.00 1.76 H new ATOM 0 HE2 TYR A 61 -17.946 3.819 5.445 1.00 2.18 H new ATOM 0 HH TYR A 61 -16.364 6.763 4.569 1.00 0.71 H new ATOM 1003 N PRO A 62 -15.728 4.780 9.938 1.00 0.29 N ATOM 1004 CA PRO A 62 -16.089 6.183 10.000 1.00 0.32 C ATOM 1005 C PRO A 62 -15.729 6.798 11.359 1.00 0.33 C ATOM 1006 O PRO A 62 -15.935 7.991 11.554 1.00 0.41 O ATOM 1007 CB PRO A 62 -17.590 6.207 9.721 1.00 0.36 C ATOM 1008 CG PRO A 62 -18.075 4.886 10.320 1.00 0.39 C ATOM 1009 CD PRO A 62 -16.897 3.933 10.113 1.00 0.36 C ATOM 0 HA PRO A 62 -15.542 6.787 9.276 1.00 0.32 H new ATOM 0 HB2 PRO A 62 -18.074 7.064 10.190 1.00 0.36 H new ATOM 0 HB3 PRO A 62 -17.801 6.267 8.653 1.00 0.36 H new ATOM 0 HG2 PRO A 62 -18.321 4.993 11.376 1.00 0.39 H new ATOM 0 HG3 PRO A 62 -18.973 4.526 9.818 1.00 0.39 H new ATOM 0 HD2 PRO A 62 -16.775 3.270 10.970 1.00 0.36 H new ATOM 0 HD3 PRO A 62 -17.055 3.300 9.240 1.00 0.36 H new ATOM 1017 N PHE A 63 -15.215 6.003 12.302 1.00 0.30 N ATOM 1018 CA PHE A 63 -14.763 6.418 13.624 1.00 0.34 C ATOM 1019 C PHE A 63 -13.248 6.649 13.682 1.00 0.35 C ATOM 1020 O PHE A 63 -12.801 7.433 14.512 1.00 0.42 O ATOM 1021 CB PHE A 63 -15.174 5.358 14.657 1.00 0.35 C ATOM 1022 CG PHE A 63 -16.410 5.700 15.460 1.00 0.42 C ATOM 1023 CD1 PHE A 63 -17.608 6.041 14.806 1.00 1.78 C ATOM 1024 CD2 PHE A 63 -16.369 5.657 16.866 1.00 2.03 C ATOM 1025 CE1 PHE A 63 -18.758 6.346 15.557 1.00 1.85 C ATOM 1026 CE2 PHE A 63 -17.517 5.963 17.616 1.00 2.04 C ATOM 1027 CZ PHE A 63 -18.712 6.308 16.961 1.00 0.70 C ATOM 0 H PHE A 63 -15.099 5.001 12.151 1.00 0.30 H new ATOM 0 HA PHE A 63 -15.238 7.372 13.852 1.00 0.34 H new ATOM 0 HB2 PHE A 63 -15.344 4.414 14.140 1.00 0.35 H new ATOM 0 HB3 PHE A 63 -14.343 5.200 15.345 1.00 0.35 H new ATOM 0 HD1 PHE A 63 -17.645 6.069 13.727 1.00 1.78 H new ATOM 0 HD2 PHE A 63 -15.452 5.388 17.370 1.00 2.03 H new ATOM 0 HE1 PHE A 63 -19.677 6.610 15.054 1.00 1.85 H new ATOM 0 HE2 PHE A 63 -17.481 5.933 18.695 1.00 2.04 H new ATOM 0 HZ PHE A 63 -19.595 6.544 17.537 1.00 0.70 H new ATOM 1037 N LYS A 64 -12.447 5.938 12.882 1.00 0.30 N ATOM 1038 CA LYS A 64 -10.989 5.959 12.927 1.00 0.36 C ATOM 1039 C LYS A 64 -10.466 5.436 11.591 1.00 0.36 C ATOM 1040 O LYS A 64 -11.109 4.596 10.967 1.00 0.36 O ATOM 1041 CB LYS A 64 -10.496 5.052 14.069 1.00 0.45 C ATOM 1042 CG LYS A 64 -10.199 5.850 15.348 1.00 2.18 C ATOM 1043 CD LYS A 64 -10.804 5.248 16.622 1.00 2.60 C ATOM 1044 CE LYS A 64 -10.074 3.978 17.071 1.00 2.61 C ATOM 1045 NZ LYS A 64 -10.650 2.750 16.490 1.00 2.69 N ATOM 0 H LYS A 64 -12.812 5.313 12.163 1.00 0.30 H new ATOM 0 HA LYS A 64 -10.628 6.972 13.103 1.00 0.36 H new ATOM 0 HB2 LYS A 64 -11.250 4.294 14.281 1.00 0.45 H new ATOM 0 HB3 LYS A 64 -9.595 4.526 13.752 1.00 0.45 H new ATOM 0 HG2 LYS A 64 -9.119 5.925 15.473 1.00 2.18 H new ATOM 0 HG3 LYS A 64 -10.577 6.865 15.225 1.00 2.18 H new ATOM 0 HD2 LYS A 64 -10.768 5.987 17.422 1.00 2.60 H new ATOM 0 HD3 LYS A 64 -11.855 5.018 16.448 1.00 2.60 H new ATOM 0 HE2 LYS A 64 -9.024 4.050 16.789 1.00 2.61 H new ATOM 0 HE3 LYS A 64 -10.108 3.910 18.158 1.00 2.61 H new ATOM 0 HZ1 LYS A 64 -10.161 1.919 16.880 1.00 2.69 H new ATOM 0 HZ2 LYS A 64 -11.662 2.697 16.723 1.00 2.69 H new ATOM 0 HZ3 LYS A 64 -10.533 2.767 15.457 1.00 2.69 H new ATOM 1059 N PRO A 65 -9.297 5.901 11.141 1.00 0.38 N ATOM 1060 CA PRO A 65 -8.722 5.448 9.891 1.00 0.40 C ATOM 1061 C PRO A 65 -8.244 3.999 10.038 1.00 0.38 C ATOM 1062 O PRO A 65 -7.997 3.540 11.155 1.00 0.39 O ATOM 1063 CB PRO A 65 -7.567 6.414 9.629 1.00 0.42 C ATOM 1064 CG PRO A 65 -7.099 6.794 11.033 1.00 0.47 C ATOM 1065 CD PRO A 65 -8.392 6.790 11.850 1.00 0.45 C ATOM 0 HA PRO A 65 -9.429 5.449 9.061 1.00 0.40 H new ATOM 0 HB2 PRO A 65 -6.771 5.942 9.054 1.00 0.42 H new ATOM 0 HB3 PRO A 65 -7.893 7.287 9.064 1.00 0.42 H new ATOM 0 HG2 PRO A 65 -6.375 6.078 11.423 1.00 0.47 H new ATOM 0 HG3 PRO A 65 -6.619 7.772 11.046 1.00 0.47 H new ATOM 0 HD2 PRO A 65 -8.213 6.439 12.866 1.00 0.45 H new ATOM 0 HD3 PRO A 65 -8.810 7.794 11.929 1.00 0.45 H new ATOM 1073 N PRO A 66 -8.103 3.265 8.926 1.00 0.38 N ATOM 1074 CA PRO A 66 -7.573 1.916 8.949 1.00 0.38 C ATOM 1075 C PRO A 66 -6.069 1.927 9.197 1.00 0.38 C ATOM 1076 O PRO A 66 -5.418 2.971 9.215 1.00 0.40 O ATOM 1077 CB PRO A 66 -7.887 1.320 7.578 1.00 0.50 C ATOM 1078 CG PRO A 66 -8.028 2.525 6.658 1.00 0.56 C ATOM 1079 CD PRO A 66 -8.363 3.709 7.571 1.00 0.49 C ATOM 0 HA PRO A 66 -8.018 1.330 9.753 1.00 0.38 H new ATOM 0 HB2 PRO A 66 -7.090 0.656 7.242 1.00 0.50 H new ATOM 0 HB3 PRO A 66 -8.804 0.731 7.603 1.00 0.50 H new ATOM 0 HG2 PRO A 66 -7.106 2.706 6.106 1.00 0.56 H new ATOM 0 HG3 PRO A 66 -8.815 2.365 5.921 1.00 0.56 H new ATOM 0 HD2 PRO A 66 -7.752 4.577 7.322 1.00 0.49 H new ATOM 0 HD3 PRO A 66 -9.404 4.008 7.453 1.00 0.49 H new ATOM 1087 N LYS A 67 -5.507 0.729 9.321 1.00 0.40 N ATOM 1088 CA LYS A 67 -4.070 0.513 9.382 1.00 0.42 C ATOM 1089 C LYS A 67 -3.679 -0.235 8.118 1.00 0.25 C ATOM 1090 O LYS A 67 -4.501 -0.949 7.546 1.00 0.32 O ATOM 1091 CB LYS A 67 -3.742 -0.318 10.632 1.00 0.66 C ATOM 1092 CG LYS A 67 -3.419 0.541 11.861 1.00 1.15 C ATOM 1093 CD LYS A 67 -1.994 1.106 11.801 1.00 1.01 C ATOM 1094 CE LYS A 67 -1.521 1.456 13.218 1.00 1.70 C ATOM 1095 NZ LYS A 67 -0.398 2.421 13.235 1.00 2.11 N ATOM 0 H LYS A 67 -6.049 -0.133 9.383 1.00 0.40 H new ATOM 0 HA LYS A 67 -3.521 1.452 9.446 1.00 0.42 H new ATOM 0 HB2 LYS A 67 -4.588 -0.966 10.862 1.00 0.66 H new ATOM 0 HB3 LYS A 67 -2.893 -0.967 10.417 1.00 0.66 H new ATOM 0 HG2 LYS A 67 -4.133 1.362 11.929 1.00 1.15 H new ATOM 0 HG3 LYS A 67 -3.535 -0.058 12.764 1.00 1.15 H new ATOM 0 HD2 LYS A 67 -1.321 0.376 11.352 1.00 1.01 H new ATOM 0 HD3 LYS A 67 -1.970 1.994 11.169 1.00 1.01 H new ATOM 0 HE2 LYS A 67 -2.357 1.871 13.781 1.00 1.70 H new ATOM 0 HE3 LYS A 67 -1.215 0.543 13.728 1.00 1.70 H new ATOM 0 HZ1 LYS A 67 -0.290 2.811 14.193 1.00 2.11 H new ATOM 0 HZ2 LYS A 67 0.480 1.937 12.957 1.00 2.11 H new ATOM 0 HZ3 LYS A 67 -0.594 3.194 12.567 1.00 2.11 H new ATOM 1109 N ILE A 68 -2.422 -0.103 7.699 1.00 0.19 N ATOM 1110 CA ILE A 68 -1.865 -0.945 6.652 1.00 0.19 C ATOM 1111 C ILE A 68 -0.526 -1.449 7.148 1.00 0.18 C ATOM 1112 O ILE A 68 0.175 -0.753 7.892 1.00 0.21 O ATOM 1113 CB ILE A 68 -1.699 -0.197 5.315 1.00 0.18 C ATOM 1114 CG1 ILE A 68 -2.792 0.863 5.120 1.00 0.28 C ATOM 1115 CG2 ILE A 68 -1.698 -1.198 4.152 1.00 0.27 C ATOM 1116 CD1 ILE A 68 -2.535 1.658 3.855 1.00 0.33 C ATOM 0 H ILE A 68 -1.769 0.585 8.074 1.00 0.19 H new ATOM 0 HA ILE A 68 -2.550 -1.768 6.450 1.00 0.19 H new ATOM 0 HB ILE A 68 -0.742 0.325 5.335 1.00 0.18 H new ATOM 0 HG12 ILE A 68 -3.768 0.382 5.063 1.00 0.28 H new ATOM 0 HG13 ILE A 68 -2.816 1.533 5.980 1.00 0.28 H new ATOM 0 HG21 ILE A 68 -1.580 -0.662 3.210 1.00 0.27 H new ATOM 0 HG22 ILE A 68 -0.873 -1.899 4.276 1.00 0.27 H new ATOM 0 HG23 ILE A 68 -2.641 -1.745 4.142 1.00 0.27 H new ATOM 0 HD11 ILE A 68 -3.318 2.406 3.730 1.00 0.33 H new ATOM 0 HD12 ILE A 68 -1.567 2.154 3.928 1.00 0.33 H new ATOM 0 HD13 ILE A 68 -2.535 0.986 2.997 1.00 0.33 H new ATOM 1128 N THR A 69 -0.162 -2.663 6.757 1.00 0.20 N ATOM 1129 CA THR A 69 1.170 -3.170 7.033 1.00 0.23 C ATOM 1130 C THR A 69 1.559 -4.104 5.891 1.00 0.21 C ATOM 1131 O THR A 69 0.845 -5.059 5.583 1.00 0.29 O ATOM 1132 CB THR A 69 1.175 -3.904 8.389 1.00 0.31 C ATOM 1133 OG1 THR A 69 0.385 -3.246 9.357 1.00 0.37 O ATOM 1134 CG2 THR A 69 2.583 -4.002 8.965 1.00 0.35 C ATOM 0 H THR A 69 -0.768 -3.309 6.251 1.00 0.20 H new ATOM 0 HA THR A 69 1.894 -2.358 7.098 1.00 0.23 H new ATOM 0 HB THR A 69 0.768 -4.894 8.182 1.00 0.31 H new ATOM 0 HG1 THR A 69 0.416 -3.746 10.199 1.00 0.37 H new ATOM 0 HG21 THR A 69 2.550 -4.525 9.921 1.00 0.35 H new ATOM 0 HG22 THR A 69 3.222 -4.551 8.273 1.00 0.35 H new ATOM 0 HG23 THR A 69 2.986 -3.000 9.114 1.00 0.35 H new ATOM 1142 N PHE A 70 2.677 -3.810 5.232 1.00 0.19 N ATOM 1143 CA PHE A 70 3.212 -4.640 4.178 1.00 0.19 C ATOM 1144 C PHE A 70 3.678 -5.944 4.805 1.00 0.19 C ATOM 1145 O PHE A 70 4.409 -5.944 5.792 1.00 0.38 O ATOM 1146 CB PHE A 70 4.367 -3.946 3.436 1.00 0.23 C ATOM 1147 CG PHE A 70 3.980 -2.771 2.549 1.00 0.20 C ATOM 1148 CD1 PHE A 70 3.174 -1.704 2.998 1.00 0.17 C ATOM 1149 CD2 PHE A 70 4.444 -2.759 1.225 1.00 0.28 C ATOM 1150 CE1 PHE A 70 2.871 -0.635 2.139 1.00 0.16 C ATOM 1151 CE2 PHE A 70 4.148 -1.692 0.361 1.00 0.30 C ATOM 1152 CZ PHE A 70 3.367 -0.624 0.827 1.00 0.21 C ATOM 0 H PHE A 70 3.236 -2.979 5.423 1.00 0.19 H new ATOM 0 HA PHE A 70 2.438 -4.829 3.434 1.00 0.19 H new ATOM 0 HB2 PHE A 70 5.089 -3.596 4.174 1.00 0.23 H new ATOM 0 HB3 PHE A 70 4.875 -4.688 2.821 1.00 0.23 H new ATOM 0 HD1 PHE A 70 2.788 -1.709 4.007 1.00 0.17 H new ATOM 0 HD2 PHE A 70 5.039 -3.585 0.864 1.00 0.28 H new ATOM 0 HE1 PHE A 70 2.255 0.180 2.489 1.00 0.16 H new ATOM 0 HE2 PHE A 70 4.519 -1.694 -0.653 1.00 0.30 H new ATOM 0 HZ PHE A 70 3.147 0.208 0.175 1.00 0.21 H new ATOM 1162 N LYS A 71 3.240 -7.062 4.237 1.00 0.25 N ATOM 1163 CA LYS A 71 3.710 -8.372 4.649 1.00 0.28 C ATOM 1164 C LYS A 71 5.153 -8.534 4.180 1.00 0.30 C ATOM 1165 O LYS A 71 6.003 -9.050 4.901 1.00 0.40 O ATOM 1166 CB LYS A 71 2.814 -9.455 4.038 1.00 0.30 C ATOM 1167 CG LYS A 71 1.318 -9.248 4.329 1.00 0.42 C ATOM 1168 CD LYS A 71 0.944 -9.332 5.816 1.00 0.66 C ATOM 1169 CE LYS A 71 0.608 -7.950 6.395 1.00 0.93 C ATOM 1170 NZ LYS A 71 -0.145 -8.067 7.667 1.00 1.34 N ATOM 0 H LYS A 71 2.553 -7.082 3.483 1.00 0.25 H new ATOM 0 HA LYS A 71 3.669 -8.470 5.734 1.00 0.28 H new ATOM 0 HB2 LYS A 71 2.967 -9.476 2.959 1.00 0.30 H new ATOM 0 HB3 LYS A 71 3.120 -10.428 4.422 1.00 0.30 H new ATOM 0 HG2 LYS A 71 1.017 -8.273 3.946 1.00 0.42 H new ATOM 0 HG3 LYS A 71 0.746 -9.996 3.780 1.00 0.42 H new ATOM 0 HD2 LYS A 71 0.089 -9.996 5.939 1.00 0.66 H new ATOM 0 HD3 LYS A 71 1.771 -9.770 6.375 1.00 0.66 H new ATOM 0 HE2 LYS A 71 1.528 -7.391 6.565 1.00 0.93 H new ATOM 0 HE3 LYS A 71 0.020 -7.384 5.673 1.00 0.93 H new ATOM 0 HZ1 LYS A 71 -0.724 -7.214 7.808 1.00 1.34 H new ATOM 0 HZ2 LYS A 71 -0.763 -8.902 7.629 1.00 1.34 H new ATOM 0 HZ3 LYS A 71 0.523 -8.166 8.458 1.00 1.34 H new ATOM 1184 N THR A 72 5.423 -8.120 2.944 1.00 0.30 N ATOM 1185 CA THR A 72 6.741 -8.247 2.360 1.00 0.30 C ATOM 1186 C THR A 72 7.596 -7.061 2.787 1.00 0.33 C ATOM 1187 O THR A 72 7.118 -5.929 2.738 1.00 0.56 O ATOM 1188 CB THR A 72 6.588 -8.292 0.839 1.00 0.29 C ATOM 1189 OG1 THR A 72 5.824 -7.185 0.391 1.00 0.36 O ATOM 1190 CG2 THR A 72 5.833 -9.566 0.455 1.00 0.31 C ATOM 0 H THR A 72 4.733 -7.690 2.328 1.00 0.30 H new ATOM 0 HA THR A 72 7.231 -9.160 2.699 1.00 0.30 H new ATOM 0 HB THR A 72 7.579 -8.268 0.385 1.00 0.29 H new ATOM 0 HG1 THR A 72 5.989 -6.416 0.975 1.00 0.36 H new ATOM 0 HG21 THR A 72 5.718 -9.608 -0.628 1.00 0.31 H new ATOM 0 HG22 THR A 72 6.393 -10.437 0.795 1.00 0.31 H new ATOM 0 HG23 THR A 72 4.849 -9.561 0.924 1.00 0.31 H new ATOM 1198 N LYS A 73 8.860 -7.307 3.147 1.00 0.47 N ATOM 1199 CA LYS A 73 9.844 -6.265 3.422 1.00 0.36 C ATOM 1200 C LYS A 73 9.847 -5.226 2.304 1.00 0.39 C ATOM 1201 O LYS A 73 9.685 -5.569 1.134 1.00 0.76 O ATOM 1202 CB LYS A 73 11.238 -6.899 3.546 1.00 0.54 C ATOM 1203 CG LYS A 73 11.658 -7.221 4.978 1.00 0.97 C ATOM 1204 CD LYS A 73 10.573 -7.925 5.792 1.00 0.81 C ATOM 1205 CE LYS A 73 11.211 -8.504 7.056 1.00 1.14 C ATOM 1206 NZ LYS A 73 10.189 -8.958 8.020 1.00 1.97 N ATOM 0 H LYS A 73 9.230 -8.251 3.256 1.00 0.47 H new ATOM 0 HA LYS A 73 9.583 -5.769 4.357 1.00 0.36 H new ATOM 0 HB2 LYS A 73 11.260 -7.817 2.958 1.00 0.54 H new ATOM 0 HB3 LYS A 73 11.972 -6.222 3.108 1.00 0.54 H new ATOM 0 HG2 LYS A 73 12.548 -7.850 4.954 1.00 0.97 H new ATOM 0 HG3 LYS A 73 11.936 -6.296 5.483 1.00 0.97 H new ATOM 0 HD2 LYS A 73 9.782 -7.223 6.055 1.00 0.81 H new ATOM 0 HD3 LYS A 73 10.113 -8.718 5.203 1.00 0.81 H new ATOM 0 HE2 LYS A 73 11.857 -9.340 6.788 1.00 1.14 H new ATOM 0 HE3 LYS A 73 11.844 -7.750 7.524 1.00 1.14 H new ATOM 0 HZ1 LYS A 73 10.656 -9.345 8.865 1.00 1.97 H new ATOM 0 HZ2 LYS A 73 9.589 -8.154 8.294 1.00 1.97 H new ATOM 0 HZ3 LYS A 73 9.601 -9.695 7.581 1.00 1.97 H new ATOM 1220 N ILE A 74 10.084 -3.967 2.670 1.00 0.27 N ATOM 1221 CA ILE A 74 10.048 -2.849 1.747 1.00 0.46 C ATOM 1222 C ILE A 74 11.340 -2.054 1.801 1.00 0.40 C ATOM 1223 O ILE A 74 12.128 -2.204 2.730 1.00 0.50 O ATOM 1224 CB ILE A 74 8.836 -1.954 2.021 1.00 0.71 C ATOM 1225 CG1 ILE A 74 8.760 -1.370 3.443 1.00 0.78 C ATOM 1226 CG2 ILE A 74 7.569 -2.757 1.771 1.00 0.92 C ATOM 1227 CD1 ILE A 74 9.496 -0.037 3.568 1.00 0.81 C ATOM 0 H ILE A 74 10.308 -3.699 3.628 1.00 0.27 H new ATOM 0 HA ILE A 74 9.948 -3.249 0.738 1.00 0.46 H new ATOM 0 HB ILE A 74 8.942 -1.104 1.347 1.00 0.71 H new ATOM 0 HG12 ILE A 74 7.715 -1.232 3.720 1.00 0.78 H new ATOM 0 HG13 ILE A 74 9.185 -2.084 4.149 1.00 0.78 H new ATOM 0 HG21 ILE A 74 6.698 -2.131 1.963 1.00 0.92 H new ATOM 0 HG22 ILE A 74 7.552 -3.096 0.735 1.00 0.92 H new ATOM 0 HG23 ILE A 74 7.548 -3.621 2.436 1.00 0.92 H new ATOM 0 HD11 ILE A 74 9.411 0.331 4.591 1.00 0.81 H new ATOM 0 HD12 ILE A 74 10.548 -0.177 3.319 1.00 0.81 H new ATOM 0 HD13 ILE A 74 9.055 0.688 2.884 1.00 0.81 H new ATOM 1239 N TYR A 75 11.523 -1.174 0.815 1.00 0.31 N ATOM 1240 CA TYR A 75 12.668 -0.282 0.736 1.00 0.33 C ATOM 1241 C TYR A 75 12.202 1.117 0.337 1.00 0.53 C ATOM 1242 O TYR A 75 12.830 1.799 -0.463 1.00 1.20 O ATOM 1243 CB TYR A 75 13.680 -0.865 -0.259 1.00 0.36 C ATOM 1244 CG TYR A 75 15.097 -0.652 0.204 1.00 0.70 C ATOM 1245 CD1 TYR A 75 15.930 0.312 -0.393 1.00 2.15 C ATOM 1246 CD2 TYR A 75 15.558 -1.420 1.283 1.00 1.73 C ATOM 1247 CE1 TYR A 75 17.244 0.480 0.079 1.00 2.67 C ATOM 1248 CE2 TYR A 75 16.874 -1.278 1.740 1.00 2.10 C ATOM 1249 CZ TYR A 75 17.728 -0.335 1.129 1.00 2.08 C ATOM 1250 OH TYR A 75 19.030 -0.244 1.511 1.00 2.73 O ATOM 0 H TYR A 75 10.868 -1.064 0.041 1.00 0.31 H new ATOM 0 HA TYR A 75 13.159 -0.194 1.705 1.00 0.33 H new ATOM 0 HB2 TYR A 75 13.494 -1.932 -0.385 1.00 0.36 H new ATOM 0 HB3 TYR A 75 13.541 -0.400 -1.235 1.00 0.36 H new ATOM 0 HD1 TYR A 75 15.563 0.918 -1.208 1.00 2.15 H new ATOM 0 HD2 TYR A 75 14.895 -2.124 1.764 1.00 1.73 H new ATOM 0 HE1 TYR A 75 17.884 1.231 -0.360 1.00 2.67 H new ATOM 0 HE2 TYR A 75 17.234 -1.887 2.556 1.00 2.10 H new ATOM 0 HH TYR A 75 19.541 -0.976 1.107 1.00 2.73 H new ATOM 1260 N HIS A 76 11.059 1.538 0.877 1.00 0.20 N ATOM 1261 CA HIS A 76 10.384 2.771 0.506 1.00 0.19 C ATOM 1262 C HIS A 76 10.189 3.584 1.774 1.00 0.17 C ATOM 1263 O HIS A 76 9.671 3.053 2.748 1.00 0.19 O ATOM 1264 CB HIS A 76 9.021 2.444 -0.110 1.00 0.33 C ATOM 1265 CG HIS A 76 9.092 1.963 -1.533 1.00 0.42 C ATOM 1266 ND1 HIS A 76 9.045 0.647 -1.965 1.00 0.56 N ATOM 1267 CD2 HIS A 76 9.126 2.776 -2.630 1.00 0.98 C ATOM 1268 CE1 HIS A 76 9.082 0.668 -3.311 1.00 0.92 C ATOM 1269 NE2 HIS A 76 9.105 1.948 -3.732 1.00 1.25 N ATOM 0 H HIS A 76 10.568 1.015 1.602 1.00 0.20 H new ATOM 0 HA HIS A 76 10.972 3.329 -0.223 1.00 0.19 H new ATOM 0 HB2 HIS A 76 8.533 1.681 0.497 1.00 0.33 H new ATOM 0 HB3 HIS A 76 8.392 3.334 -0.069 1.00 0.33 H new ATOM 0 HD2 HIS A 76 9.162 3.855 -2.633 1.00 0.98 H new ATOM 0 HE1 HIS A 76 9.092 -0.202 -3.951 1.00 0.92 H new ATOM 0 HE2 HIS A 76 9.107 2.254 -4.705 1.00 1.25 H new ATOM 1278 N PRO A 77 10.541 4.872 1.772 1.00 0.22 N ATOM 1279 CA PRO A 77 10.527 5.678 2.978 1.00 0.22 C ATOM 1280 C PRO A 77 9.118 5.970 3.463 1.00 0.22 C ATOM 1281 O PRO A 77 8.915 6.271 4.631 1.00 0.21 O ATOM 1282 CB PRO A 77 11.235 6.966 2.584 1.00 0.24 C ATOM 1283 CG PRO A 77 10.946 7.099 1.089 1.00 0.25 C ATOM 1284 CD PRO A 77 10.970 5.647 0.621 1.00 0.28 C ATOM 0 HA PRO A 77 11.013 5.160 3.805 1.00 0.22 H new ATOM 0 HB2 PRO A 77 10.852 7.820 3.143 1.00 0.24 H new ATOM 0 HB3 PRO A 77 12.306 6.910 2.781 1.00 0.24 H new ATOM 0 HG2 PRO A 77 9.981 7.570 0.902 1.00 0.25 H new ATOM 0 HG3 PRO A 77 11.699 7.702 0.582 1.00 0.25 H new ATOM 0 HD2 PRO A 77 10.303 5.495 -0.228 1.00 0.28 H new ATOM 0 HD3 PRO A 77 11.969 5.353 0.298 1.00 0.28 H new ATOM 1292 N ASN A 78 8.140 5.932 2.561 1.00 0.26 N ATOM 1293 CA ASN A 78 6.751 6.250 2.863 1.00 0.28 C ATOM 1294 C ASN A 78 6.058 5.134 3.647 1.00 0.36 C ATOM 1295 O ASN A 78 4.857 5.218 3.898 1.00 0.68 O ATOM 1296 CB ASN A 78 6.020 6.485 1.544 1.00 0.38 C ATOM 1297 CG ASN A 78 6.696 7.587 0.745 1.00 0.90 C ATOM 1298 OD1 ASN A 78 7.392 7.235 -0.323 1.00 1.77 O flip ATOM 1299 ND2 ASN A 78 6.650 8.754 1.102 1.00 2.13 N flip ATOM 0 H ASN A 78 8.295 5.675 1.586 1.00 0.26 H new ATOM 0 HA ASN A 78 6.727 7.141 3.490 1.00 0.28 H new ATOM 0 HB2 ASN A 78 6.005 5.564 0.962 1.00 0.38 H new ATOM 0 HB3 ASN A 78 4.982 6.755 1.740 1.00 0.38 H new ATOM 0 HD21 ASN A 78 6.110 9.014 1.927 1.00 2.13 H new ATOM 0 HD22 ASN A 78 7.152 9.469 0.575 1.00 2.13 H new ATOM 1306 N ILE A 79 6.786 4.064 3.966 1.00 0.25 N ATOM 1307 CA ILE A 79 6.375 2.873 4.675 1.00 0.30 C ATOM 1308 C ILE A 79 7.537 2.606 5.654 1.00 0.29 C ATOM 1309 O ILE A 79 8.571 3.272 5.607 1.00 0.38 O ATOM 1310 CB ILE A 79 6.132 1.740 3.644 1.00 0.39 C ATOM 1311 CG1 ILE A 79 5.149 2.162 2.533 1.00 0.41 C ATOM 1312 CG2 ILE A 79 5.618 0.413 4.247 1.00 0.52 C ATOM 1313 CD1 ILE A 79 5.540 1.599 1.168 1.00 0.58 C ATOM 0 H ILE A 79 7.771 4.014 3.705 1.00 0.25 H new ATOM 0 HA ILE A 79 5.439 2.958 5.228 1.00 0.30 H new ATOM 0 HB ILE A 79 7.127 1.562 3.235 1.00 0.39 H new ATOM 0 HG12 ILE A 79 4.146 1.822 2.790 1.00 0.41 H new ATOM 0 HG13 ILE A 79 5.112 3.250 2.478 1.00 0.41 H new ATOM 0 HG21 ILE A 79 5.478 -0.318 3.451 1.00 0.52 H new ATOM 0 HG22 ILE A 79 6.346 0.033 4.964 1.00 0.52 H new ATOM 0 HG23 ILE A 79 4.668 0.587 4.752 1.00 0.52 H new ATOM 0 HD11 ILE A 79 4.817 1.924 0.420 1.00 0.58 H new ATOM 0 HD12 ILE A 79 6.532 1.960 0.896 1.00 0.58 H new ATOM 0 HD13 ILE A 79 5.550 0.510 1.213 1.00 0.58 H new ATOM 1325 N ASP A 80 7.368 1.669 6.573 1.00 0.42 N ATOM 1326 CA ASP A 80 8.288 1.333 7.643 1.00 0.41 C ATOM 1327 C ASP A 80 8.859 -0.045 7.319 1.00 0.40 C ATOM 1328 O ASP A 80 8.258 -0.810 6.563 1.00 0.48 O ATOM 1329 CB ASP A 80 7.467 1.320 8.936 1.00 0.60 C ATOM 1330 CG ASP A 80 8.248 1.146 10.238 1.00 0.63 C ATOM 1331 OD1 ASP A 80 9.027 0.173 10.324 1.00 1.60 O ATOM 1332 OD2 ASP A 80 7.972 1.915 11.182 1.00 1.87 O ATOM 0 H ASP A 80 6.531 1.087 6.591 1.00 0.42 H new ATOM 0 HA ASP A 80 9.113 2.037 7.753 1.00 0.41 H new ATOM 0 HB2 ASP A 80 6.909 2.254 8.995 1.00 0.60 H new ATOM 0 HB3 ASP A 80 6.735 0.515 8.867 1.00 0.60 H new ATOM 1337 N GLU A 81 9.996 -0.394 7.903 1.00 0.38 N ATOM 1338 CA GLU A 81 10.605 -1.706 7.773 1.00 0.39 C ATOM 1339 C GLU A 81 9.675 -2.823 8.256 1.00 0.38 C ATOM 1340 O GLU A 81 9.714 -3.928 7.714 1.00 0.44 O ATOM 1341 CB GLU A 81 11.936 -1.698 8.530 1.00 0.47 C ATOM 1342 CG GLU A 81 13.008 -1.066 7.634 1.00 0.93 C ATOM 1343 CD GLU A 81 14.167 -0.503 8.450 1.00 2.17 C ATOM 1344 OE1 GLU A 81 14.138 0.725 8.704 1.00 3.41 O ATOM 1345 OE2 GLU A 81 15.057 -1.304 8.809 1.00 2.65 O ATOM 0 H GLU A 81 10.531 0.243 8.493 1.00 0.38 H new ATOM 0 HA GLU A 81 10.789 -1.916 6.719 1.00 0.39 H new ATOM 0 HB2 GLU A 81 11.839 -1.135 9.458 1.00 0.47 H new ATOM 0 HB3 GLU A 81 12.222 -2.714 8.802 1.00 0.47 H new ATOM 0 HG2 GLU A 81 13.384 -1.813 6.935 1.00 0.93 H new ATOM 0 HG3 GLU A 81 12.561 -0.269 7.039 1.00 0.93 H new ATOM 1352 N LYS A 82 8.788 -2.562 9.224 1.00 0.42 N ATOM 1353 CA LYS A 82 7.802 -3.548 9.651 1.00 0.48 C ATOM 1354 C LYS A 82 6.570 -3.530 8.746 1.00 0.54 C ATOM 1355 O LYS A 82 5.515 -4.006 9.144 1.00 0.70 O ATOM 1356 CB LYS A 82 7.418 -3.244 11.102 1.00 0.51 C ATOM 1357 CG LYS A 82 6.629 -1.932 11.198 1.00 2.81 C ATOM 1358 CD LYS A 82 6.999 -1.089 12.418 1.00 3.08 C ATOM 1359 CE LYS A 82 6.384 -1.658 13.696 1.00 3.94 C ATOM 1360 NZ LYS A 82 6.613 -0.748 14.837 1.00 4.66 N ATOM 0 H LYS A 82 8.737 -1.674 9.723 1.00 0.42 H new ATOM 0 HA LYS A 82 8.231 -4.548 9.580 1.00 0.48 H new ATOM 0 HB2 LYS A 82 6.820 -4.062 11.503 1.00 0.51 H new ATOM 0 HB3 LYS A 82 8.318 -3.177 11.714 1.00 0.51 H new ATOM 0 HG2 LYS A 82 6.801 -1.346 10.295 1.00 2.81 H new ATOM 0 HG3 LYS A 82 5.563 -2.159 11.232 1.00 2.81 H new ATOM 0 HD2 LYS A 82 8.084 -1.050 12.520 1.00 3.08 H new ATOM 0 HD3 LYS A 82 6.656 -0.065 12.272 1.00 3.08 H new ATOM 0 HE2 LYS A 82 5.314 -1.809 13.554 1.00 3.94 H new ATOM 0 HE3 LYS A 82 6.818 -2.635 13.911 1.00 3.94 H new ATOM 0 HZ1 LYS A 82 6.187 -1.153 15.695 1.00 4.66 H new ATOM 0 HZ2 LYS A 82 7.635 -0.624 14.983 1.00 4.66 H new ATOM 0 HZ3 LYS A 82 6.178 0.175 14.638 1.00 4.66 H new ATOM 1374 N GLY A 83 6.665 -2.903 7.575 1.00 0.40 N ATOM 1375 CA GLY A 83 5.581 -2.710 6.638 1.00 0.40 C ATOM 1376 C GLY A 83 4.632 -1.576 7.018 1.00 0.40 C ATOM 1377 O GLY A 83 3.725 -1.277 6.248 1.00 0.42 O ATOM 0 H GLY A 83 7.543 -2.501 7.247 1.00 0.40 H new ATOM 0 HA2 GLY A 83 5.998 -2.507 5.651 1.00 0.40 H new ATOM 0 HA3 GLY A 83 5.012 -3.636 6.559 1.00 0.40 H new ATOM 1381 N GLN A 84 4.765 -0.967 8.194 1.00 0.38 N ATOM 1382 CA GLN A 84 3.818 0.033 8.656 1.00 0.39 C ATOM 1383 C GLN A 84 3.761 1.260 7.760 1.00 0.34 C ATOM 1384 O GLN A 84 4.680 1.539 7.005 1.00 0.49 O ATOM 1385 CB GLN A 84 4.146 0.436 10.097 1.00 0.40 C ATOM 1386 CG GLN A 84 3.382 -0.456 11.066 1.00 0.81 C ATOM 1387 CD GLN A 84 2.041 0.205 11.385 1.00 2.69 C ATOM 1388 OE1 GLN A 84 1.835 0.744 12.467 1.00 2.20 O ATOM 1389 NE2 GLN A 84 1.127 0.289 10.424 1.00 5.11 N ATOM 0 H GLN A 84 5.527 -1.154 8.846 1.00 0.38 H new ATOM 0 HA GLN A 84 2.829 -0.423 8.616 1.00 0.39 H new ATOM 0 HB2 GLN A 84 5.218 0.348 10.274 1.00 0.40 H new ATOM 0 HB3 GLN A 84 3.880 1.480 10.262 1.00 0.40 H new ATOM 0 HG2 GLN A 84 3.223 -1.441 10.628 1.00 0.81 H new ATOM 0 HG3 GLN A 84 3.958 -0.603 11.980 1.00 0.81 H new ATOM 0 HE21 GLN A 84 1.293 -0.157 9.522 1.00 5.11 H new ATOM 0 HE22 GLN A 84 0.260 0.800 10.588 1.00 5.11 H new ATOM 1398 N VAL A 85 2.676 2.020 7.858 1.00 0.21 N ATOM 1399 CA VAL A 85 2.467 3.171 7.000 1.00 0.16 C ATOM 1400 C VAL A 85 1.994 4.343 7.852 1.00 0.23 C ATOM 1401 O VAL A 85 1.347 4.135 8.879 1.00 0.32 O ATOM 1402 CB VAL A 85 1.445 2.809 5.915 1.00 0.18 C ATOM 1403 CG1 VAL A 85 1.844 1.548 5.145 1.00 0.18 C ATOM 1404 CG2 VAL A 85 0.045 2.604 6.490 1.00 0.24 C ATOM 0 H VAL A 85 1.926 1.855 8.529 1.00 0.21 H new ATOM 0 HA VAL A 85 3.395 3.461 6.506 1.00 0.16 H new ATOM 0 HB VAL A 85 1.433 3.658 5.232 1.00 0.18 H new ATOM 0 HG11 VAL A 85 1.091 1.331 4.388 1.00 0.18 H new ATOM 0 HG12 VAL A 85 2.809 1.706 4.663 1.00 0.18 H new ATOM 0 HG13 VAL A 85 1.917 0.708 5.836 1.00 0.18 H new ATOM 0 HG21 VAL A 85 -0.645 2.349 5.686 1.00 0.24 H new ATOM 0 HG22 VAL A 85 0.066 1.794 7.220 1.00 0.24 H new ATOM 0 HG23 VAL A 85 -0.287 3.522 6.976 1.00 0.24 H new ATOM 1414 N CYS A 86 2.295 5.570 7.426 1.00 0.28 N ATOM 1415 CA CYS A 86 1.719 6.772 8.005 1.00 0.40 C ATOM 1416 C CYS A 86 1.525 7.797 6.886 1.00 0.38 C ATOM 1417 O CYS A 86 2.374 8.660 6.684 1.00 0.51 O ATOM 1418 CB CYS A 86 2.628 7.288 9.130 1.00 0.56 C ATOM 1419 SG CYS A 86 1.640 8.151 10.377 1.00 1.02 S ATOM 0 H CYS A 86 2.949 5.753 6.665 1.00 0.28 H new ATOM 0 HA CYS A 86 0.746 6.570 8.454 1.00 0.40 H new ATOM 0 HB2 CYS A 86 3.161 6.455 9.589 1.00 0.56 H new ATOM 0 HB3 CYS A 86 3.381 7.962 8.720 1.00 0.56 H new ATOM 0 HG CYS A 86 2.418 8.582 11.325 1.00 1.02 H new ATOM 1425 N LEU A 87 0.442 7.682 6.114 1.00 0.28 N ATOM 1426 CA LEU A 87 0.140 8.610 5.032 1.00 0.25 C ATOM 1427 C LEU A 87 -1.067 9.432 5.461 1.00 0.28 C ATOM 1428 O LEU A 87 -1.892 8.930 6.223 1.00 0.28 O ATOM 1429 CB LEU A 87 -0.181 7.856 3.730 1.00 0.18 C ATOM 1430 CG LEU A 87 0.966 7.056 3.103 1.00 0.18 C ATOM 1431 CD1 LEU A 87 2.268 7.852 3.066 1.00 0.26 C ATOM 1432 CD2 LEU A 87 1.211 5.721 3.797 1.00 0.17 C ATOM 0 H LEU A 87 -0.249 6.940 6.225 1.00 0.28 H new ATOM 0 HA LEU A 87 1.003 9.247 4.839 1.00 0.25 H new ATOM 0 HB2 LEU A 87 -1.007 7.172 3.926 1.00 0.18 H new ATOM 0 HB3 LEU A 87 -0.534 8.579 2.995 1.00 0.18 H new ATOM 0 HG LEU A 87 0.644 6.852 2.082 1.00 0.18 H new ATOM 0 HD11 LEU A 87 3.053 7.245 2.614 1.00 0.26 H new ATOM 0 HD12 LEU A 87 2.124 8.758 2.477 1.00 0.26 H new ATOM 0 HD13 LEU A 87 2.558 8.122 4.081 1.00 0.26 H new ATOM 0 HD21 LEU A 87 2.035 5.202 3.307 1.00 0.17 H new ATOM 0 HD22 LEU A 87 1.463 5.896 4.843 1.00 0.17 H new ATOM 0 HD23 LEU A 87 0.311 5.110 3.738 1.00 0.17 H new ATOM 1444 N PRO A 88 -1.231 10.661 4.952 1.00 0.32 N ATOM 1445 CA PRO A 88 -2.315 11.539 5.362 1.00 0.38 C ATOM 1446 C PRO A 88 -3.690 10.906 5.147 1.00 0.46 C ATOM 1447 O PRO A 88 -4.595 11.147 5.938 1.00 0.69 O ATOM 1448 CB PRO A 88 -2.122 12.849 4.596 1.00 0.43 C ATOM 1449 CG PRO A 88 -1.203 12.474 3.433 1.00 0.40 C ATOM 1450 CD PRO A 88 -0.362 11.332 4.002 1.00 0.35 C ATOM 0 HA PRO A 88 -2.283 11.727 6.435 1.00 0.38 H new ATOM 0 HB2 PRO A 88 -3.073 13.245 4.240 1.00 0.43 H new ATOM 0 HB3 PRO A 88 -1.673 13.616 5.227 1.00 0.43 H new ATOM 0 HG2 PRO A 88 -1.771 12.158 2.558 1.00 0.40 H new ATOM 0 HG3 PRO A 88 -0.582 13.315 3.124 1.00 0.40 H new ATOM 0 HD2 PRO A 88 -0.037 10.651 3.215 1.00 0.35 H new ATOM 0 HD3 PRO A 88 0.538 11.709 4.488 1.00 0.35 H new ATOM 1458 N VAL A 89 -3.835 10.057 4.127 1.00 0.34 N ATOM 1459 CA VAL A 89 -5.085 9.365 3.804 1.00 0.32 C ATOM 1460 C VAL A 89 -5.642 8.591 5.004 1.00 0.31 C ATOM 1461 O VAL A 89 -6.852 8.426 5.122 1.00 0.35 O ATOM 1462 CB VAL A 89 -4.908 8.456 2.565 1.00 0.26 C ATOM 1463 CG1 VAL A 89 -4.689 9.306 1.310 1.00 0.29 C ATOM 1464 CG2 VAL A 89 -3.718 7.500 2.701 1.00 0.21 C ATOM 0 H VAL A 89 -3.072 9.827 3.490 1.00 0.34 H new ATOM 0 HA VAL A 89 -5.826 10.125 3.556 1.00 0.32 H new ATOM 0 HB VAL A 89 -5.822 7.867 2.485 1.00 0.26 H new ATOM 0 HG11 VAL A 89 -4.566 8.654 0.446 1.00 0.29 H new ATOM 0 HG12 VAL A 89 -5.551 9.955 1.155 1.00 0.29 H new ATOM 0 HG13 VAL A 89 -3.794 9.915 1.435 1.00 0.29 H new ATOM 0 HG21 VAL A 89 -3.640 6.886 1.804 1.00 0.21 H new ATOM 0 HG22 VAL A 89 -2.801 8.076 2.827 1.00 0.21 H new ATOM 0 HG23 VAL A 89 -3.865 6.857 3.569 1.00 0.21 H new ATOM 1474 N ILE A 90 -4.768 8.107 5.889 1.00 0.29 N ATOM 1475 CA ILE A 90 -5.142 7.349 7.077 1.00 0.33 C ATOM 1476 C ILE A 90 -4.465 7.916 8.322 1.00 0.39 C ATOM 1477 O ILE A 90 -4.384 7.246 9.350 1.00 0.44 O ATOM 1478 CB ILE A 90 -4.804 5.868 6.860 1.00 0.29 C ATOM 1479 CG1 ILE A 90 -3.297 5.684 6.600 1.00 0.26 C ATOM 1480 CG2 ILE A 90 -5.640 5.363 5.677 1.00 0.24 C ATOM 1481 CD1 ILE A 90 -2.926 4.233 6.321 1.00 0.27 C ATOM 0 H ILE A 90 -3.761 8.236 5.795 1.00 0.29 H new ATOM 0 HA ILE A 90 -6.216 7.435 7.241 1.00 0.33 H new ATOM 0 HB ILE A 90 -5.042 5.290 7.753 1.00 0.29 H new ATOM 0 HG12 ILE A 90 -3.000 6.301 5.752 1.00 0.26 H new ATOM 0 HG13 ILE A 90 -2.736 6.039 7.465 1.00 0.26 H new ATOM 0 HG21 ILE A 90 -5.420 4.310 5.499 1.00 0.24 H new ATOM 0 HG22 ILE A 90 -6.700 5.479 5.905 1.00 0.24 H new ATOM 0 HG23 ILE A 90 -5.395 5.941 4.786 1.00 0.24 H new ATOM 0 HD11 ILE A 90 -1.853 4.159 6.145 1.00 0.27 H new ATOM 0 HD12 ILE A 90 -3.196 3.617 7.179 1.00 0.27 H new ATOM 0 HD13 ILE A 90 -3.463 3.883 5.440 1.00 0.27 H new ATOM 1493 N SER A 91 -3.960 9.144 8.244 1.00 0.40 N ATOM 1494 CA SER A 91 -3.334 9.771 9.388 1.00 0.49 C ATOM 1495 C SER A 91 -4.429 10.162 10.373 1.00 0.51 C ATOM 1496 O SER A 91 -5.540 10.478 9.958 1.00 0.50 O ATOM 1497 CB SER A 91 -2.562 10.988 8.897 1.00 0.54 C ATOM 1498 OG SER A 91 -2.020 11.703 9.991 1.00 0.85 O ATOM 0 H SER A 91 -3.975 9.717 7.401 1.00 0.40 H new ATOM 0 HA SER A 91 -2.639 9.099 9.892 1.00 0.49 H new ATOM 0 HB2 SER A 91 -1.761 10.673 8.228 1.00 0.54 H new ATOM 0 HB3 SER A 91 -3.222 11.637 8.321 1.00 0.54 H new ATOM 0 HG SER A 91 -1.525 12.481 9.660 1.00 0.85 H new ATOM 1504 N ALA A 92 -4.131 10.184 11.673 1.00 0.57 N ATOM 1505 CA ALA A 92 -5.107 10.624 12.662 1.00 0.58 C ATOM 1506 C ALA A 92 -5.451 12.094 12.422 1.00 0.60 C ATOM 1507 O ALA A 92 -6.617 12.475 12.412 1.00 0.57 O ATOM 1508 CB ALA A 92 -4.561 10.401 14.075 1.00 0.68 C ATOM 0 H ALA A 92 -3.229 9.904 12.060 1.00 0.57 H new ATOM 0 HA ALA A 92 -6.021 10.038 12.562 1.00 0.58 H new ATOM 0 HB1 ALA A 92 -5.298 10.733 14.806 1.00 0.68 H new ATOM 0 HB2 ALA A 92 -4.356 9.341 14.223 1.00 0.68 H new ATOM 0 HB3 ALA A 92 -3.640 10.970 14.203 1.00 0.68 H new ATOM 1514 N GLU A 93 -4.428 12.915 12.180 1.00 0.71 N ATOM 1515 CA GLU A 93 -4.572 14.346 11.934 1.00 0.81 C ATOM 1516 C GLU A 93 -5.357 14.626 10.652 1.00 0.74 C ATOM 1517 O GLU A 93 -5.850 15.732 10.453 1.00 0.91 O ATOM 1518 CB GLU A 93 -3.174 14.973 11.828 1.00 1.02 C ATOM 1519 CG GLU A 93 -2.458 15.051 13.182 1.00 1.39 C ATOM 1520 CD GLU A 93 -2.907 16.261 14.003 1.00 1.90 C ATOM 1521 OE1 GLU A 93 -4.132 16.503 14.044 1.00 3.27 O ATOM 1522 OE2 GLU A 93 -2.015 16.924 14.577 1.00 2.36 O ATOM 0 H GLU A 93 -3.460 12.596 12.149 1.00 0.71 H new ATOM 0 HA GLU A 93 -5.128 14.783 12.763 1.00 0.81 H new ATOM 0 HB2 GLU A 93 -2.569 14.388 11.135 1.00 1.02 H new ATOM 0 HB3 GLU A 93 -3.260 15.975 11.409 1.00 1.02 H new ATOM 0 HG2 GLU A 93 -2.651 14.139 13.747 1.00 1.39 H new ATOM 0 HG3 GLU A 93 -1.381 15.103 13.020 1.00 1.39 H new ATOM 1529 N ASN A 94 -5.428 13.668 9.724 1.00 0.59 N ATOM 1530 CA ASN A 94 -6.215 13.813 8.502 1.00 0.55 C ATOM 1531 C ASN A 94 -7.229 12.675 8.404 1.00 0.50 C ATOM 1532 O ASN A 94 -7.635 12.288 7.310 1.00 0.51 O ATOM 1533 CB ASN A 94 -5.291 13.901 7.276 1.00 0.51 C ATOM 1534 CG ASN A 94 -4.846 15.325 6.970 1.00 0.84 C ATOM 1535 OD1 ASN A 94 -5.094 15.835 5.884 1.00 1.64 O ATOM 1536 ND2 ASN A 94 -4.189 15.995 7.905 1.00 0.82 N ATOM 0 H ASN A 94 -4.943 12.774 9.800 1.00 0.59 H new ATOM 0 HA ASN A 94 -6.779 14.745 8.531 1.00 0.55 H new ATOM 0 HB2 ASN A 94 -4.412 13.279 7.445 1.00 0.51 H new ATOM 0 HB3 ASN A 94 -5.808 13.493 6.408 1.00 0.51 H new ATOM 0 HD21 ASN A 94 -3.881 16.951 7.726 1.00 0.82 H new ATOM 0 HD22 ASN A 94 -3.991 15.555 8.804 1.00 0.82 H new ATOM 1543 N TRP A 95 -7.685 12.157 9.545 1.00 0.50 N ATOM 1544 CA TRP A 95 -8.672 11.092 9.564 1.00 0.49 C ATOM 1545 C TRP A 95 -9.947 11.636 8.933 1.00 0.50 C ATOM 1546 O TRP A 95 -10.644 12.466 9.513 1.00 0.60 O ATOM 1547 CB TRP A 95 -8.904 10.603 10.998 1.00 0.52 C ATOM 1548 CG TRP A 95 -10.243 9.984 11.275 1.00 0.48 C ATOM 1549 CD1 TRP A 95 -10.852 9.005 10.566 1.00 0.41 C ATOM 1550 CD2 TRP A 95 -11.191 10.384 12.306 1.00 0.52 C ATOM 1551 NE1 TRP A 95 -12.120 8.790 11.075 1.00 0.39 N ATOM 1552 CE2 TRP A 95 -12.397 9.649 12.121 1.00 0.45 C ATOM 1553 CE3 TRP A 95 -11.156 11.319 13.363 1.00 0.63 C ATOM 1554 CZ2 TRP A 95 -13.526 9.872 12.923 1.00 0.48 C ATOM 1555 CZ3 TRP A 95 -12.272 11.519 14.196 1.00 0.67 C ATOM 1556 CH2 TRP A 95 -13.459 10.802 13.972 1.00 0.59 C ATOM 0 H TRP A 95 -7.381 12.464 10.469 1.00 0.50 H new ATOM 0 HA TRP A 95 -8.326 10.229 8.995 1.00 0.49 H new ATOM 0 HB2 TRP A 95 -8.132 9.873 11.241 1.00 0.52 H new ATOM 0 HB3 TRP A 95 -8.769 11.447 11.675 1.00 0.52 H new ATOM 0 HD1 TRP A 95 -10.416 8.474 9.733 1.00 0.41 H new ATOM 0 HE1 TRP A 95 -12.769 8.086 10.723 1.00 0.39 H new ATOM 0 HE3 TRP A 95 -10.256 11.891 13.535 1.00 0.63 H new ATOM 0 HZ2 TRP A 95 -14.442 9.331 12.734 1.00 0.48 H new ATOM 0 HZ3 TRP A 95 -12.216 12.226 15.010 1.00 0.67 H new ATOM 0 HH2 TRP A 95 -14.318 10.966 14.606 1.00 0.59 H new ATOM 1567 N LYS A 96 -10.246 11.184 7.716 1.00 0.47 N ATOM 1568 CA LYS A 96 -11.429 11.607 6.993 1.00 0.49 C ATOM 1569 C LYS A 96 -12.311 10.379 6.864 1.00 0.43 C ATOM 1570 O LYS A 96 -11.936 9.457 6.148 1.00 0.40 O ATOM 1571 CB LYS A 96 -11.038 12.179 5.618 1.00 0.57 C ATOM 1572 CG LYS A 96 -11.024 13.713 5.616 1.00 0.72 C ATOM 1573 CD LYS A 96 -9.912 14.305 6.490 1.00 0.91 C ATOM 1574 CE LYS A 96 -10.133 15.798 6.746 1.00 1.48 C ATOM 1575 NZ LYS A 96 -10.010 16.604 5.515 1.00 1.98 N ATOM 0 H LYS A 96 -9.669 10.513 7.209 1.00 0.47 H new ATOM 0 HA LYS A 96 -11.962 12.402 7.515 1.00 0.49 H new ATOM 0 HB2 LYS A 96 -10.052 11.807 5.338 1.00 0.57 H new ATOM 0 HB3 LYS A 96 -11.740 11.822 4.864 1.00 0.57 H new ATOM 0 HG2 LYS A 96 -10.902 14.068 4.593 1.00 0.72 H new ATOM 0 HG3 LYS A 96 -11.988 14.080 5.967 1.00 0.72 H new ATOM 0 HD2 LYS A 96 -9.874 13.774 7.441 1.00 0.91 H new ATOM 0 HD3 LYS A 96 -8.948 14.157 6.003 1.00 0.91 H new ATOM 0 HE2 LYS A 96 -11.123 15.947 7.178 1.00 1.48 H new ATOM 0 HE3 LYS A 96 -9.409 16.149 7.481 1.00 1.48 H new ATOM 0 HZ1 LYS A 96 -10.168 17.607 5.740 1.00 1.98 H new ATOM 0 HZ2 LYS A 96 -9.057 16.484 5.115 1.00 1.98 H new ATOM 0 HZ3 LYS A 96 -10.718 16.289 4.822 1.00 1.98 H new ATOM 1589 N PRO A 97 -13.496 10.348 7.483 1.00 0.42 N ATOM 1590 CA PRO A 97 -14.416 9.230 7.331 1.00 0.38 C ATOM 1591 C PRO A 97 -14.988 9.159 5.911 1.00 0.42 C ATOM 1592 O PRO A 97 -15.549 8.141 5.511 1.00 0.56 O ATOM 1593 CB PRO A 97 -15.483 9.452 8.404 1.00 0.41 C ATOM 1594 CG PRO A 97 -15.498 10.968 8.589 1.00 0.47 C ATOM 1595 CD PRO A 97 -14.037 11.357 8.376 1.00 0.47 C ATOM 0 HA PRO A 97 -13.927 8.265 7.465 1.00 0.38 H new ATOM 0 HB2 PRO A 97 -16.456 9.078 8.085 1.00 0.41 H new ATOM 0 HB3 PRO A 97 -15.232 8.938 9.332 1.00 0.41 H new ATOM 0 HG2 PRO A 97 -16.154 11.456 7.868 1.00 0.47 H new ATOM 0 HG3 PRO A 97 -15.850 11.250 9.582 1.00 0.47 H new ATOM 0 HD2 PRO A 97 -13.955 12.353 7.940 1.00 0.47 H new ATOM 0 HD3 PRO A 97 -13.494 11.377 9.321 1.00 0.47 H new ATOM 1603 N ALA A 98 -14.837 10.221 5.119 1.00 0.45 N ATOM 1604 CA ALA A 98 -15.180 10.199 3.708 1.00 0.49 C ATOM 1605 C ALA A 98 -14.182 9.384 2.876 1.00 0.46 C ATOM 1606 O ALA A 98 -14.509 9.000 1.756 1.00 0.51 O ATOM 1607 CB ALA A 98 -15.236 11.639 3.200 1.00 0.57 C ATOM 0 H ALA A 98 -14.473 11.117 5.443 1.00 0.45 H new ATOM 0 HA ALA A 98 -16.149 9.713 3.598 1.00 0.49 H new ATOM 0 HB1 ALA A 98 -15.493 11.641 2.141 1.00 0.57 H new ATOM 0 HB2 ALA A 98 -15.992 12.192 3.758 1.00 0.57 H new ATOM 0 HB3 ALA A 98 -14.264 12.112 3.339 1.00 0.57 H new ATOM 1613 N THR A 99 -12.963 9.156 3.380 1.00 0.44 N ATOM 1614 CA THR A 99 -11.959 8.383 2.665 1.00 0.42 C ATOM 1615 C THR A 99 -12.402 6.926 2.575 1.00 0.39 C ATOM 1616 O THR A 99 -13.329 6.508 3.269 1.00 0.42 O ATOM 1617 CB THR A 99 -10.583 8.529 3.341 1.00 0.45 C ATOM 1618 OG1 THR A 99 -9.574 8.392 2.371 1.00 0.51 O ATOM 1619 CG2 THR A 99 -10.298 7.484 4.426 1.00 0.45 C ATOM 0 H THR A 99 -12.654 9.502 4.288 1.00 0.44 H new ATOM 0 HA THR A 99 -11.858 8.766 1.650 1.00 0.42 H new ATOM 0 HB THR A 99 -10.594 9.511 3.814 1.00 0.45 H new ATOM 0 HG1 THR A 99 -9.698 9.068 1.672 1.00 0.51 H new ATOM 0 HG21 THR A 99 -9.309 7.660 4.850 1.00 0.45 H new ATOM 0 HG22 THR A 99 -11.049 7.562 5.212 1.00 0.45 H new ATOM 0 HG23 THR A 99 -10.333 6.486 3.988 1.00 0.45 H new ATOM 1627 N LYS A 100 -11.724 6.144 1.737 1.00 0.40 N ATOM 1628 CA LYS A 100 -12.022 4.740 1.507 1.00 0.30 C ATOM 1629 C LYS A 100 -10.764 4.062 0.991 1.00 0.22 C ATOM 1630 O LYS A 100 -9.734 4.702 0.780 1.00 0.21 O ATOM 1631 CB LYS A 100 -13.134 4.624 0.460 1.00 0.38 C ATOM 1632 CG LYS A 100 -14.544 4.593 1.057 1.00 1.53 C ATOM 1633 CD LYS A 100 -15.396 5.633 0.330 1.00 1.74 C ATOM 1634 CE LYS A 100 -16.877 5.293 0.441 1.00 2.42 C ATOM 1635 NZ LYS A 100 -17.631 5.996 -0.614 1.00 2.82 N ATOM 0 H LYS A 100 -10.934 6.482 1.188 1.00 0.40 H new ATOM 0 HA LYS A 100 -12.350 4.265 2.432 1.00 0.30 H new ATOM 0 HB2 LYS A 100 -13.060 5.465 -0.230 1.00 0.38 H new ATOM 0 HB3 LYS A 100 -12.977 3.717 -0.124 1.00 0.38 H new ATOM 0 HG2 LYS A 100 -14.981 3.600 0.947 1.00 1.53 H new ATOM 0 HG3 LYS A 100 -14.509 4.810 2.125 1.00 1.53 H new ATOM 0 HD2 LYS A 100 -15.212 6.620 0.753 1.00 1.74 H new ATOM 0 HD3 LYS A 100 -15.106 5.677 -0.720 1.00 1.74 H new ATOM 0 HE2 LYS A 100 -17.020 4.217 0.348 1.00 2.42 H new ATOM 0 HE3 LYS A 100 -17.253 5.581 1.423 1.00 2.42 H new ATOM 0 HZ1 LYS A 100 -18.629 6.076 -0.333 1.00 2.82 H new ATOM 0 HZ2 LYS A 100 -17.232 6.947 -0.751 1.00 2.82 H new ATOM 0 HZ3 LYS A 100 -17.564 5.461 -1.504 1.00 2.82 H new ATOM 1649 N THR A 101 -10.842 2.753 0.793 1.00 0.21 N ATOM 1650 CA THR A 101 -9.724 1.957 0.336 1.00 0.20 C ATOM 1651 C THR A 101 -9.253 2.328 -1.060 1.00 0.19 C ATOM 1652 O THR A 101 -8.125 1.999 -1.399 1.00 0.29 O ATOM 1653 CB THR A 101 -10.093 0.484 0.359 1.00 0.29 C ATOM 1654 OG1 THR A 101 -11.475 0.368 0.097 1.00 0.47 O ATOM 1655 CG2 THR A 101 -9.793 -0.086 1.737 1.00 0.39 C ATOM 0 H THR A 101 -11.694 2.214 0.948 1.00 0.21 H new ATOM 0 HA THR A 101 -8.901 2.161 1.021 1.00 0.20 H new ATOM 0 HB THR A 101 -9.520 -0.061 -0.391 1.00 0.29 H new ATOM 0 HG1 THR A 101 -11.723 -0.579 0.065 1.00 0.47 H new ATOM 0 HG21 THR A 101 -10.056 -1.143 1.759 1.00 0.39 H new ATOM 0 HG22 THR A 101 -8.731 0.028 1.955 1.00 0.39 H new ATOM 0 HG23 THR A 101 -10.376 0.448 2.487 1.00 0.39 H new ATOM 1663 N ASP A 102 -10.065 2.998 -1.874 1.00 0.17 N ATOM 1664 CA ASP A 102 -9.586 3.545 -3.133 1.00 0.18 C ATOM 1665 C ASP A 102 -8.488 4.563 -2.826 1.00 0.17 C ATOM 1666 O ASP A 102 -7.401 4.490 -3.393 1.00 0.23 O ATOM 1667 CB ASP A 102 -10.748 4.146 -3.940 1.00 0.26 C ATOM 1668 CG ASP A 102 -11.296 5.412 -3.285 1.00 1.08 C ATOM 1669 OD1 ASP A 102 -11.582 5.313 -2.071 1.00 2.32 O ATOM 1670 OD2 ASP A 102 -11.316 6.476 -3.938 1.00 1.77 O ATOM 0 H ASP A 102 -11.052 3.173 -1.683 1.00 0.17 H new ATOM 0 HA ASP A 102 -9.162 2.759 -3.758 1.00 0.18 H new ATOM 0 HB2 ASP A 102 -10.409 4.377 -4.950 1.00 0.26 H new ATOM 0 HB3 ASP A 102 -11.546 3.409 -4.032 1.00 0.26 H new ATOM 1675 N GLN A 103 -8.739 5.462 -1.874 1.00 0.17 N ATOM 1676 CA GLN A 103 -7.812 6.502 -1.459 1.00 0.19 C ATOM 1677 C GLN A 103 -6.615 5.896 -0.753 1.00 0.18 C ATOM 1678 O GLN A 103 -5.503 6.404 -0.890 1.00 0.22 O ATOM 1679 CB GLN A 103 -8.515 7.550 -0.589 1.00 0.24 C ATOM 1680 CG GLN A 103 -9.825 7.970 -1.264 1.00 0.35 C ATOM 1681 CD GLN A 103 -10.470 9.229 -0.705 1.00 0.54 C ATOM 1682 OE1 GLN A 103 -9.890 9.978 0.077 1.00 0.99 O ATOM 1683 NE2 GLN A 103 -11.727 9.449 -1.065 1.00 1.53 N ATOM 0 H GLN A 103 -9.619 5.483 -1.359 1.00 0.17 H new ATOM 0 HA GLN A 103 -7.447 7.015 -2.349 1.00 0.19 H new ATOM 0 HB2 GLN A 103 -8.717 7.142 0.401 1.00 0.24 H new ATOM 0 HB3 GLN A 103 -7.869 8.417 -0.450 1.00 0.24 H new ATOM 0 HG2 GLN A 103 -9.635 8.120 -2.327 1.00 0.35 H new ATOM 0 HG3 GLN A 103 -10.537 7.149 -1.180 1.00 0.35 H new ATOM 0 HE21 GLN A 103 -12.190 8.814 -1.716 1.00 1.53 H new ATOM 0 HE22 GLN A 103 -12.231 10.253 -0.691 1.00 1.53 H new ATOM 1692 N VAL A 104 -6.816 4.804 -0.018 1.00 0.17 N ATOM 1693 CA VAL A 104 -5.713 4.163 0.666 1.00 0.17 C ATOM 1694 C VAL A 104 -4.772 3.529 -0.355 1.00 0.16 C ATOM 1695 O VAL A 104 -3.582 3.834 -0.379 1.00 0.17 O ATOM 1696 CB VAL A 104 -6.265 3.152 1.673 1.00 0.20 C ATOM 1697 CG1 VAL A 104 -5.117 2.399 2.311 1.00 0.18 C ATOM 1698 CG2 VAL A 104 -7.033 3.876 2.779 1.00 0.26 C ATOM 0 H VAL A 104 -7.722 4.355 0.114 1.00 0.17 H new ATOM 0 HA VAL A 104 -5.128 4.894 1.224 1.00 0.17 H new ATOM 0 HB VAL A 104 -6.930 2.466 1.148 1.00 0.20 H new ATOM 0 HG11 VAL A 104 -5.509 1.678 3.029 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -4.553 1.874 1.540 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.461 3.102 2.824 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -7.421 3.147 3.490 1.00 0.26 H new ATOM 0 HG22 VAL A 104 -6.365 4.565 3.295 1.00 0.26 H new ATOM 0 HG23 VAL A 104 -7.862 4.433 2.342 1.00 0.26 H new ATOM 1708 N ILE A 105 -5.296 2.645 -1.200 1.00 0.15 N ATOM 1709 CA ILE A 105 -4.506 1.860 -2.133 1.00 0.14 C ATOM 1710 C ILE A 105 -3.798 2.789 -3.097 1.00 0.15 C ATOM 1711 O ILE A 105 -2.590 2.663 -3.295 1.00 0.15 O ATOM 1712 CB ILE A 105 -5.394 0.828 -2.851 1.00 0.14 C ATOM 1713 CG1 ILE A 105 -5.641 -0.353 -1.903 1.00 0.16 C ATOM 1714 CG2 ILE A 105 -4.828 0.314 -4.184 1.00 0.14 C ATOM 1715 CD1 ILE A 105 -4.355 -1.048 -1.420 1.00 0.17 C ATOM 0 H ILE A 105 -6.297 2.454 -1.253 1.00 0.15 H new ATOM 0 HA ILE A 105 -3.744 1.296 -1.595 1.00 0.14 H new ATOM 0 HB ILE A 105 -6.321 1.341 -3.107 1.00 0.14 H new ATOM 0 HG12 ILE A 105 -6.198 0.001 -1.036 1.00 0.16 H new ATOM 0 HG13 ILE A 105 -6.270 -1.086 -2.408 1.00 0.16 H new ATOM 0 HG21 ILE A 105 -5.519 -0.408 -4.619 1.00 0.14 H new ATOM 0 HG22 ILE A 105 -4.698 1.150 -4.871 1.00 0.14 H new ATOM 0 HG23 ILE A 105 -3.865 -0.166 -4.010 1.00 0.14 H new ATOM 0 HD11 ILE A 105 -4.614 -1.871 -0.754 1.00 0.17 H new ATOM 0 HD12 ILE A 105 -3.806 -1.435 -2.279 1.00 0.17 H new ATOM 0 HD13 ILE A 105 -3.733 -0.331 -0.884 1.00 0.17 H new ATOM 1727 N GLN A 106 -4.535 3.737 -3.679 1.00 0.15 N ATOM 1728 CA GLN A 106 -3.921 4.710 -4.567 1.00 0.17 C ATOM 1729 C GLN A 106 -2.820 5.475 -3.838 1.00 0.19 C ATOM 1730 O GLN A 106 -1.867 5.876 -4.485 1.00 0.24 O ATOM 1731 CB GLN A 106 -4.953 5.636 -5.231 1.00 0.22 C ATOM 1732 CG GLN A 106 -5.540 6.699 -4.296 1.00 0.58 C ATOM 1733 CD GLN A 106 -4.658 7.935 -4.118 1.00 1.22 C ATOM 1734 OE1 GLN A 106 -4.239 8.559 -5.083 1.00 1.81 O ATOM 1735 NE2 GLN A 106 -4.369 8.318 -2.880 1.00 2.16 N ATOM 0 H GLN A 106 -5.541 3.847 -3.551 1.00 0.15 H new ATOM 0 HA GLN A 106 -3.455 4.167 -5.389 1.00 0.17 H new ATOM 0 HB2 GLN A 106 -4.484 6.134 -6.079 1.00 0.22 H new ATOM 0 HB3 GLN A 106 -5.767 5.029 -5.628 1.00 0.22 H new ATOM 0 HG2 GLN A 106 -6.510 7.012 -4.683 1.00 0.58 H new ATOM 0 HG3 GLN A 106 -5.717 6.249 -3.319 1.00 0.58 H new ATOM 0 HE21 GLN A 106 -4.726 7.787 -2.086 1.00 2.16 H new ATOM 0 HE22 GLN A 106 -3.790 9.143 -2.723 1.00 2.16 H new ATOM 1744 N SER A 107 -2.909 5.664 -2.517 1.00 0.19 N ATOM 1745 CA SER A 107 -1.838 6.267 -1.747 1.00 0.20 C ATOM 1746 C SER A 107 -0.615 5.367 -1.768 1.00 0.17 C ATOM 1747 O SER A 107 0.461 5.848 -2.097 1.00 0.20 O ATOM 1748 CB SER A 107 -2.247 6.537 -0.298 1.00 0.22 C ATOM 1749 OG SER A 107 -1.536 7.648 0.216 1.00 0.42 O ATOM 0 H SER A 107 -3.724 5.402 -1.963 1.00 0.19 H new ATOM 0 HA SER A 107 -1.607 7.226 -2.211 1.00 0.20 H new ATOM 0 HB2 SER A 107 -3.319 6.727 -0.245 1.00 0.22 H new ATOM 0 HB3 SER A 107 -2.049 5.656 0.313 1.00 0.22 H new ATOM 0 HG SER A 107 -1.416 7.541 1.183 1.00 0.42 H new ATOM 1755 N LEU A 108 -0.720 4.087 -1.392 1.00 0.13 N ATOM 1756 CA LEU A 108 0.483 3.263 -1.356 1.00 0.12 C ATOM 1757 C LEU A 108 1.135 3.266 -2.717 1.00 0.15 C ATOM 1758 O LEU A 108 2.322 3.529 -2.809 1.00 0.23 O ATOM 1759 CB LEU A 108 0.226 1.800 -1.004 1.00 0.11 C ATOM 1760 CG LEU A 108 -0.142 1.507 0.450 1.00 0.13 C ATOM 1761 CD1 LEU A 108 0.444 2.509 1.441 1.00 0.12 C ATOM 1762 CD2 LEU A 108 -1.646 1.379 0.627 1.00 0.20 C ATOM 0 H LEU A 108 -1.585 3.620 -1.121 1.00 0.13 H new ATOM 0 HA LEU A 108 1.110 3.700 -0.579 1.00 0.12 H new ATOM 0 HB2 LEU A 108 -0.578 1.431 -1.641 1.00 0.11 H new ATOM 0 HB3 LEU A 108 1.119 1.226 -1.253 1.00 0.11 H new ATOM 0 HG LEU A 108 0.317 0.546 0.684 1.00 0.13 H new ATOM 0 HD11 LEU A 108 0.142 2.239 2.453 1.00 0.12 H new ATOM 0 HD12 LEU A 108 1.532 2.496 1.371 1.00 0.12 H new ATOM 0 HD13 LEU A 108 0.077 3.509 1.207 1.00 0.12 H new ATOM 0 HD21 LEU A 108 -1.873 1.171 1.673 1.00 0.20 H new ATOM 0 HD22 LEU A 108 -2.128 2.310 0.330 1.00 0.20 H new ATOM 0 HD23 LEU A 108 -2.017 0.564 0.006 1.00 0.20 H new ATOM 1774 N ILE A 109 0.371 2.975 -3.766 1.00 0.15 N ATOM 1775 CA ILE A 109 0.905 2.966 -5.114 1.00 0.16 C ATOM 1776 C ILE A 109 1.553 4.315 -5.379 1.00 0.20 C ATOM 1777 O ILE A 109 2.709 4.352 -5.764 1.00 0.27 O ATOM 1778 CB ILE A 109 -0.205 2.617 -6.111 1.00 0.17 C ATOM 1779 CG1 ILE A 109 -0.632 1.163 -5.863 1.00 0.15 C ATOM 1780 CG2 ILE A 109 0.259 2.756 -7.567 1.00 0.19 C ATOM 1781 CD1 ILE A 109 -2.088 0.951 -6.249 1.00 0.16 C ATOM 0 H ILE A 109 -0.620 2.743 -3.703 1.00 0.15 H new ATOM 0 HA ILE A 109 1.671 2.200 -5.234 1.00 0.16 H new ATOM 0 HB ILE A 109 -1.032 3.311 -5.960 1.00 0.17 H new ATOM 0 HG12 ILE A 109 0.003 0.490 -6.439 1.00 0.15 H new ATOM 0 HG13 ILE A 109 -0.490 0.912 -4.812 1.00 0.15 H new ATOM 0 HG21 ILE A 109 -0.562 2.498 -8.237 1.00 0.19 H new ATOM 0 HG22 ILE A 109 0.570 3.784 -7.753 1.00 0.19 H new ATOM 0 HG23 ILE A 109 1.099 2.085 -7.747 1.00 0.19 H new ATOM 0 HD11 ILE A 109 -2.366 -0.087 -6.064 1.00 0.16 H new ATOM 0 HD12 ILE A 109 -2.722 1.608 -5.654 1.00 0.16 H new ATOM 0 HD13 ILE A 109 -2.221 1.179 -7.307 1.00 0.16 H new ATOM 1793 N ALA A 110 0.860 5.417 -5.114 1.00 0.21 N ATOM 1794 CA ALA A 110 1.365 6.762 -5.328 1.00 0.23 C ATOM 1795 C ALA A 110 2.729 6.963 -4.668 1.00 0.20 C ATOM 1796 O ALA A 110 3.599 7.570 -5.263 1.00 0.21 O ATOM 1797 CB ALA A 110 0.337 7.790 -4.838 1.00 0.25 C ATOM 0 H ALA A 110 -0.087 5.396 -4.737 1.00 0.21 H new ATOM 0 HA ALA A 110 1.514 6.910 -6.398 1.00 0.23 H new ATOM 0 HB1 ALA A 110 0.722 8.796 -5.002 1.00 0.25 H new ATOM 0 HB2 ALA A 110 -0.595 7.664 -5.389 1.00 0.25 H new ATOM 0 HB3 ALA A 110 0.152 7.641 -3.774 1.00 0.25 H new ATOM 1803 N LEU A 111 2.936 6.458 -3.455 1.00 0.19 N ATOM 1804 CA LEU A 111 4.145 6.656 -2.664 1.00 0.18 C ATOM 1805 C LEU A 111 5.220 5.586 -2.914 1.00 0.25 C ATOM 1806 O LEU A 111 6.382 5.761 -2.547 1.00 0.64 O ATOM 1807 CB LEU A 111 3.756 6.647 -1.177 1.00 0.17 C ATOM 1808 CG LEU A 111 3.204 7.952 -0.573 1.00 0.17 C ATOM 1809 CD1 LEU A 111 3.727 9.225 -1.224 1.00 0.28 C ATOM 1810 CD2 LEU A 111 1.680 7.994 -0.557 1.00 0.24 C ATOM 0 H LEU A 111 2.242 5.880 -2.980 1.00 0.19 H new ATOM 0 HA LEU A 111 4.581 7.609 -2.963 1.00 0.18 H new ATOM 0 HB2 LEU A 111 3.008 5.867 -1.031 1.00 0.17 H new ATOM 0 HB3 LEU A 111 4.636 6.357 -0.602 1.00 0.17 H new ATOM 0 HG LEU A 111 3.580 7.931 0.450 1.00 0.17 H new ATOM 0 HD11 LEU A 111 3.284 10.092 -0.734 1.00 0.28 H new ATOM 0 HD12 LEU A 111 4.812 9.266 -1.124 1.00 0.28 H new ATOM 0 HD13 LEU A 111 3.460 9.229 -2.281 1.00 0.28 H new ATOM 0 HD21 LEU A 111 1.347 8.936 -0.121 1.00 0.24 H new ATOM 0 HD22 LEU A 111 1.303 7.913 -1.576 1.00 0.24 H new ATOM 0 HD23 LEU A 111 1.299 7.164 0.038 1.00 0.24 H new ATOM 1822 N VAL A 112 4.840 4.436 -3.460 1.00 0.31 N ATOM 1823 CA VAL A 112 5.736 3.341 -3.811 1.00 0.29 C ATOM 1824 C VAL A 112 6.335 3.639 -5.188 1.00 0.30 C ATOM 1825 O VAL A 112 7.497 3.329 -5.453 1.00 0.34 O ATOM 1826 CB VAL A 112 4.938 2.021 -3.767 1.00 0.30 C ATOM 1827 CG1 VAL A 112 5.665 0.812 -4.360 1.00 0.39 C ATOM 1828 CG2 VAL A 112 4.634 1.642 -2.311 1.00 0.28 C ATOM 0 H VAL A 112 3.864 4.234 -3.678 1.00 0.31 H new ATOM 0 HA VAL A 112 6.563 3.240 -3.108 1.00 0.29 H new ATOM 0 HB VAL A 112 4.049 2.224 -4.363 1.00 0.30 H new ATOM 0 HG11 VAL A 112 5.027 -0.069 -4.285 1.00 0.39 H new ATOM 0 HG12 VAL A 112 5.896 1.004 -5.408 1.00 0.39 H new ATOM 0 HG13 VAL A 112 6.590 0.638 -3.810 1.00 0.39 H new ATOM 0 HG21 VAL A 112 4.070 0.709 -2.288 1.00 0.28 H new ATOM 0 HG22 VAL A 112 5.569 1.515 -1.765 1.00 0.28 H new ATOM 0 HG23 VAL A 112 4.046 2.433 -1.844 1.00 0.28 H new ATOM 1838 N ASN A 113 5.522 4.222 -6.064 1.00 0.31 N ATOM 1839 CA ASN A 113 5.850 4.592 -7.426 1.00 0.40 C ATOM 1840 C ASN A 113 6.530 5.958 -7.403 1.00 0.51 C ATOM 1841 O ASN A 113 7.596 6.128 -7.986 1.00 0.62 O ATOM 1842 CB ASN A 113 4.558 4.625 -8.266 1.00 0.48 C ATOM 1843 CG ASN A 113 4.691 3.937 -9.608 1.00 1.13 C ATOM 1844 OD1 ASN A 113 5.485 4.336 -10.448 1.00 1.92 O ATOM 1845 ND2 ASN A 113 3.923 2.876 -9.823 1.00 1.69 N ATOM 0 H ASN A 113 4.560 4.461 -5.822 1.00 0.31 H new ATOM 0 HA ASN A 113 6.529 3.867 -7.876 1.00 0.40 H new ATOM 0 HB2 ASN A 113 3.755 4.151 -7.702 1.00 0.48 H new ATOM 0 HB3 ASN A 113 4.265 5.663 -8.426 1.00 0.48 H new ATOM 0 HD21 ASN A 113 3.986 2.371 -10.707 1.00 1.69 H new ATOM 0 HD22 ASN A 113 3.269 2.565 -9.104 1.00 1.69 H new ATOM 1852 N ASP A 114 5.924 6.919 -6.701 1.00 0.49 N ATOM 1853 CA ASP A 114 6.355 8.317 -6.675 1.00 0.61 C ATOM 1854 C ASP A 114 6.584 8.765 -5.227 1.00 0.54 C ATOM 1855 O ASP A 114 5.759 9.442 -4.615 1.00 0.46 O ATOM 1856 CB ASP A 114 5.333 9.200 -7.406 1.00 0.72 C ATOM 1857 CG ASP A 114 5.897 10.590 -7.698 1.00 0.99 C ATOM 1858 OD1 ASP A 114 7.140 10.693 -7.804 1.00 1.12 O ATOM 1859 OD2 ASP A 114 5.077 11.520 -7.864 1.00 1.50 O ATOM 0 H ASP A 114 5.103 6.742 -6.123 1.00 0.49 H new ATOM 0 HA ASP A 114 7.303 8.420 -7.202 1.00 0.61 H new ATOM 0 HB2 ASP A 114 5.041 8.722 -8.341 1.00 0.72 H new ATOM 0 HB3 ASP A 114 4.432 9.292 -6.800 1.00 0.72 H new ATOM 1864 N PRO A 115 7.690 8.330 -4.614 1.00 0.58 N ATOM 1865 CA PRO A 115 7.928 8.533 -3.197 1.00 0.54 C ATOM 1866 C PRO A 115 8.233 9.998 -2.886 1.00 0.53 C ATOM 1867 O PRO A 115 8.971 10.649 -3.620 1.00 0.57 O ATOM 1868 CB PRO A 115 9.124 7.632 -2.869 1.00 0.64 C ATOM 1869 CG PRO A 115 9.870 7.547 -4.198 1.00 0.74 C ATOM 1870 CD PRO A 115 8.736 7.525 -5.214 1.00 0.69 C ATOM 0 HA PRO A 115 7.052 8.285 -2.597 1.00 0.54 H new ATOM 0 HB2 PRO A 115 9.747 8.060 -2.084 1.00 0.64 H new ATOM 0 HB3 PRO A 115 8.805 6.649 -2.523 1.00 0.64 H new ATOM 0 HG2 PRO A 115 10.531 8.401 -4.347 1.00 0.74 H new ATOM 0 HG3 PRO A 115 10.487 6.651 -4.260 1.00 0.74 H new ATOM 0 HD2 PRO A 115 9.054 7.938 -6.171 1.00 0.69 H new ATOM 0 HD3 PRO A 115 8.394 6.508 -5.404 1.00 0.69 H new ATOM 1878 N GLN A 116 7.737 10.502 -1.749 1.00 0.53 N ATOM 1879 CA GLN A 116 7.920 11.897 -1.373 1.00 0.56 C ATOM 1880 C GLN A 116 8.961 12.006 -0.252 1.00 0.52 C ATOM 1881 O GLN A 116 8.634 11.766 0.908 1.00 0.59 O ATOM 1882 CB GLN A 116 6.566 12.502 -0.970 1.00 0.67 C ATOM 1883 CG GLN A 116 5.537 12.375 -2.107 1.00 2.20 C ATOM 1884 CD GLN A 116 4.246 13.157 -1.861 1.00 2.39 C ATOM 1885 OE1 GLN A 116 3.854 13.381 -0.616 1.00 3.09 O flip ATOM 1886 NE2 GLN A 116 3.569 13.554 -2.801 1.00 2.42 N flip ATOM 0 H GLN A 116 7.203 9.955 -1.074 1.00 0.53 H new ATOM 0 HA GLN A 116 8.299 12.466 -2.222 1.00 0.56 H new ATOM 0 HB2 GLN A 116 6.191 11.998 -0.079 1.00 0.67 H new ATOM 0 HB3 GLN A 116 6.697 13.553 -0.711 1.00 0.67 H new ATOM 0 HG2 GLN A 116 5.990 12.723 -3.035 1.00 2.20 H new ATOM 0 HG3 GLN A 116 5.292 11.322 -2.247 1.00 2.20 H new ATOM 0 HE21 GLN A 116 3.874 13.380 -3.759 1.00 2.42 H new ATOM 0 HE22 GLN A 116 2.700 14.059 -2.626 1.00 2.42 H new ATOM 1895 N PRO A 117 10.210 12.408 -0.547 1.00 0.48 N ATOM 1896 CA PRO A 117 11.245 12.610 0.463 1.00 0.49 C ATOM 1897 C PRO A 117 11.043 13.901 1.273 1.00 0.60 C ATOM 1898 O PRO A 117 11.930 14.286 2.027 1.00 0.77 O ATOM 1899 CB PRO A 117 12.568 12.605 -0.311 1.00 0.49 C ATOM 1900 CG PRO A 117 12.162 13.191 -1.663 1.00 0.52 C ATOM 1901 CD PRO A 117 10.754 12.633 -1.876 1.00 0.49 C ATOM 0 HA PRO A 117 11.219 11.824 1.217 1.00 0.49 H new ATOM 0 HB2 PRO A 117 13.329 13.210 0.182 1.00 0.49 H new ATOM 0 HB3 PRO A 117 12.976 11.599 -0.411 1.00 0.49 H new ATOM 0 HG2 PRO A 117 12.165 14.281 -1.647 1.00 0.52 H new ATOM 0 HG3 PRO A 117 12.842 12.882 -2.457 1.00 0.52 H new ATOM 0 HD2 PRO A 117 10.137 13.334 -2.437 1.00 0.49 H new ATOM 0 HD3 PRO A 117 10.784 11.706 -2.448 1.00 0.49 H new ATOM 1909 N GLU A 118 9.889 14.562 1.149 1.00 0.64 N ATOM 1910 CA GLU A 118 9.540 15.771 1.884 1.00 0.76 C ATOM 1911 C GLU A 118 9.554 15.526 3.396 1.00 0.65 C ATOM 1912 O GLU A 118 10.177 16.277 4.140 1.00 0.92 O ATOM 1913 CB GLU A 118 8.180 16.286 1.373 1.00 0.87 C ATOM 1914 CG GLU A 118 7.031 15.305 1.668 1.00 2.62 C ATOM 1915 CD GLU A 118 5.714 15.608 0.957 1.00 3.37 C ATOM 1916 OE1 GLU A 118 4.710 14.986 1.380 1.00 4.38 O ATOM 1917 OE2 GLU A 118 5.732 16.370 -0.030 1.00 3.73 O ATOM 0 H GLU A 118 9.152 14.257 0.513 1.00 0.64 H new ATOM 0 HA GLU A 118 10.287 16.544 1.706 1.00 0.76 H new ATOM 0 HB2 GLU A 118 7.961 17.247 1.838 1.00 0.87 H new ATOM 0 HB3 GLU A 118 8.240 16.458 0.298 1.00 0.87 H new ATOM 0 HG2 GLU A 118 7.352 14.301 1.390 1.00 2.62 H new ATOM 0 HG3 GLU A 118 6.851 15.296 2.743 1.00 2.62 H new ATOM 1924 N HIS A 119 8.855 14.481 3.848 1.00 0.39 N ATOM 1925 CA HIS A 119 8.768 14.081 5.249 1.00 0.33 C ATOM 1926 C HIS A 119 8.024 12.741 5.353 1.00 0.30 C ATOM 1927 O HIS A 119 6.912 12.671 5.876 1.00 0.31 O ATOM 1928 CB HIS A 119 8.103 15.179 6.101 1.00 0.33 C ATOM 1929 CG HIS A 119 6.851 15.774 5.503 1.00 0.87 C ATOM 1930 ND1 HIS A 119 5.689 15.095 5.217 1.00 2.15 N ATOM 1931 CD2 HIS A 119 6.691 17.068 5.090 1.00 1.43 C ATOM 1932 CE1 HIS A 119 4.850 15.963 4.625 1.00 2.44 C ATOM 1933 NE2 HIS A 119 5.409 17.183 4.546 1.00 1.88 N ATOM 0 H HIS A 119 8.319 13.874 3.228 1.00 0.39 H new ATOM 0 HA HIS A 119 9.774 13.947 5.647 1.00 0.33 H new ATOM 0 HB2 HIS A 119 7.859 14.763 7.079 1.00 0.33 H new ATOM 0 HB3 HIS A 119 8.825 15.979 6.266 1.00 0.33 H new ATOM 0 HD1 HIS A 119 5.499 14.113 5.417 1.00 2.15 H new ATOM 0 HD2 HIS A 119 7.423 17.858 5.170 1.00 1.43 H new ATOM 0 HE1 HIS A 119 3.863 15.714 4.263 1.00 2.44 H new ATOM 1941 N PRO A 120 8.615 11.668 4.818 1.00 0.32 N ATOM 1942 CA PRO A 120 8.049 10.329 4.879 1.00 0.28 C ATOM 1943 C PRO A 120 8.366 9.674 6.233 1.00 0.26 C ATOM 1944 O PRO A 120 8.884 10.332 7.131 1.00 0.34 O ATOM 1945 CB PRO A 120 8.719 9.623 3.706 1.00 0.31 C ATOM 1946 CG PRO A 120 10.116 10.227 3.700 1.00 0.36 C ATOM 1947 CD PRO A 120 9.856 11.679 4.066 1.00 0.41 C ATOM 0 HA PRO A 120 6.962 10.296 4.806 1.00 0.28 H new ATOM 0 HB2 PRO A 120 8.746 8.542 3.847 1.00 0.31 H new ATOM 0 HB3 PRO A 120 8.194 9.809 2.769 1.00 0.31 H new ATOM 0 HG2 PRO A 120 10.771 9.739 4.422 1.00 0.36 H new ATOM 0 HG3 PRO A 120 10.592 10.135 2.724 1.00 0.36 H new ATOM 0 HD2 PRO A 120 10.673 12.087 4.661 1.00 0.41 H new ATOM 0 HD3 PRO A 120 9.770 12.300 3.174 1.00 0.41 H new ATOM 1955 N LEU A 121 8.061 8.377 6.394 1.00 0.21 N ATOM 1956 CA LEU A 121 8.279 7.653 7.646 1.00 0.23 C ATOM 1957 C LEU A 121 9.775 7.558 7.924 1.00 0.34 C ATOM 1958 O LEU A 121 10.292 8.181 8.849 1.00 0.72 O ATOM 1959 CB LEU A 121 7.651 6.241 7.621 1.00 0.19 C ATOM 1960 CG LEU A 121 6.160 6.246 7.978 1.00 0.63 C ATOM 1961 CD1 LEU A 121 5.306 6.542 6.745 1.00 2.23 C ATOM 1962 CD2 LEU A 121 5.755 4.878 8.537 1.00 2.00 C ATOM 0 H LEU A 121 7.655 7.803 5.655 1.00 0.21 H new ATOM 0 HA LEU A 121 7.787 8.209 8.444 1.00 0.23 H new ATOM 0 HB2 LEU A 121 7.781 5.808 6.629 1.00 0.19 H new ATOM 0 HB3 LEU A 121 8.185 5.599 8.321 1.00 0.19 H new ATOM 0 HG LEU A 121 5.995 7.023 8.724 1.00 0.63 H new ATOM 0 HD11 LEU A 121 4.252 6.540 7.023 1.00 2.23 H new ATOM 0 HD12 LEU A 121 5.574 7.519 6.343 1.00 2.23 H new ATOM 0 HD13 LEU A 121 5.483 5.778 5.988 1.00 2.23 H new ATOM 0 HD21 LEU A 121 4.695 4.887 8.789 1.00 2.00 H new ATOM 0 HD22 LEU A 121 5.943 4.109 7.788 1.00 2.00 H new ATOM 0 HD23 LEU A 121 6.339 4.663 9.432 1.00 2.00 H new ATOM 1974 N ARG A 122 10.489 6.756 7.135 1.00 0.33 N ATOM 1975 CA ARG A 122 11.937 6.704 7.244 1.00 0.35 C ATOM 1976 C ARG A 122 12.508 7.710 6.268 1.00 0.34 C ATOM 1977 O ARG A 122 12.746 7.373 5.111 1.00 0.35 O ATOM 1978 CB ARG A 122 12.463 5.302 6.933 1.00 0.39 C ATOM 1979 CG ARG A 122 12.267 4.350 8.125 1.00 0.47 C ATOM 1980 CD ARG A 122 13.610 3.793 8.620 1.00 0.56 C ATOM 1981 NE ARG A 122 14.488 4.848 9.171 1.00 0.99 N ATOM 1982 CZ ARG A 122 14.509 5.255 10.447 1.00 1.26 C ATOM 1983 NH1 ARG A 122 15.394 6.162 10.854 1.00 1.78 N ATOM 1984 NH2 ARG A 122 13.638 4.759 11.326 1.00 2.00 N ATOM 0 H ARG A 122 10.090 6.143 6.424 1.00 0.33 H new ATOM 0 HA ARG A 122 12.241 6.943 8.263 1.00 0.35 H new ATOM 0 HB2 ARG A 122 11.947 4.904 6.059 1.00 0.39 H new ATOM 0 HB3 ARG A 122 13.522 5.357 6.680 1.00 0.39 H new ATOM 0 HG2 ARG A 122 11.768 4.879 8.937 1.00 0.47 H new ATOM 0 HG3 ARG A 122 11.615 3.527 7.833 1.00 0.47 H new ATOM 0 HD2 ARG A 122 13.428 3.039 9.386 1.00 0.56 H new ATOM 0 HD3 ARG A 122 14.119 3.294 7.796 1.00 0.56 H new ATOM 0 HE ARG A 122 15.132 5.304 8.525 1.00 0.99 H new ATOM 0 HH11 ARG A 122 16.064 6.554 10.192 1.00 1.78 H new ATOM 0 HH12 ARG A 122 15.402 6.466 11.828 1.00 1.78 H new ATOM 0 HH21 ARG A 122 12.951 4.066 11.028 1.00 2.00 H new ATOM 0 HH22 ARG A 122 13.658 5.072 12.296 1.00 2.00 H new ATOM 1998 N ALA A 123 12.776 8.926 6.745 1.00 0.35 N ATOM 1999 CA ALA A 123 13.465 9.923 5.941 1.00 0.37 C ATOM 2000 C ALA A 123 14.733 9.331 5.323 1.00 0.42 C ATOM 2001 O ALA A 123 15.019 9.627 4.175 1.00 0.39 O ATOM 2002 CB ALA A 123 13.764 11.172 6.774 1.00 0.39 C ATOM 0 H ALA A 123 12.525 9.239 7.683 1.00 0.35 H new ATOM 0 HA ALA A 123 12.814 10.227 5.121 1.00 0.37 H new ATOM 0 HB1 ALA A 123 14.280 11.907 6.156 1.00 0.39 H new ATOM 0 HB2 ALA A 123 12.830 11.597 7.140 1.00 0.39 H new ATOM 0 HB3 ALA A 123 14.396 10.902 7.620 1.00 0.39 H new ATOM 2008 N ASP A 124 15.453 8.455 6.029 1.00 0.53 N ATOM 2009 CA ASP A 124 16.670 7.801 5.540 1.00 0.62 C ATOM 2010 C ASP A 124 16.472 7.126 4.188 1.00 0.63 C ATOM 2011 O ASP A 124 17.267 7.324 3.278 1.00 0.65 O ATOM 2012 CB ASP A 124 17.152 6.728 6.521 1.00 0.83 C ATOM 2013 CG ASP A 124 17.351 7.275 7.921 1.00 1.08 C ATOM 2014 OD1 ASP A 124 16.293 7.459 8.569 1.00 2.74 O ATOM 2015 OD2 ASP A 124 18.509 7.459 8.342 1.00 1.87 O ATOM 0 H ASP A 124 15.201 8.175 6.977 1.00 0.53 H new ATOM 0 HA ASP A 124 17.408 8.597 5.441 1.00 0.62 H new ATOM 0 HB2 ASP A 124 16.427 5.915 6.551 1.00 0.83 H new ATOM 0 HB3 ASP A 124 18.090 6.306 6.162 1.00 0.83 H new ATOM 2020 N LEU A 125 15.429 6.310 4.023 1.00 0.64 N ATOM 2021 CA LEU A 125 15.187 5.655 2.742 1.00 0.67 C ATOM 2022 C LEU A 125 14.955 6.709 1.650 1.00 0.63 C ATOM 2023 O LEU A 125 15.269 6.489 0.484 1.00 0.71 O ATOM 2024 CB LEU A 125 13.996 4.691 2.871 1.00 0.67 C ATOM 2025 CG LEU A 125 14.338 3.271 3.341 1.00 1.07 C ATOM 2026 CD1 LEU A 125 15.193 2.532 2.311 1.00 2.83 C ATOM 2027 CD2 LEU A 125 15.030 3.246 4.703 1.00 1.35 C ATOM 0 H LEU A 125 14.749 6.091 4.751 1.00 0.64 H new ATOM 0 HA LEU A 125 16.061 5.070 2.454 1.00 0.67 H new ATOM 0 HB2 LEU A 125 13.277 5.122 3.568 1.00 0.67 H new ATOM 0 HB3 LEU A 125 13.500 4.624 1.903 1.00 0.67 H new ATOM 0 HG LEU A 125 13.383 2.756 3.448 1.00 1.07 H new ATOM 0 HD11 LEU A 125 15.417 1.530 2.676 1.00 2.83 H new ATOM 0 HD12 LEU A 125 14.649 2.462 1.369 1.00 2.83 H new ATOM 0 HD13 LEU A 125 16.124 3.077 2.153 1.00 2.83 H new ATOM 0 HD21 LEU A 125 15.247 2.215 4.982 1.00 1.35 H new ATOM 0 HD22 LEU A 125 15.961 3.811 4.649 1.00 1.35 H new ATOM 0 HD23 LEU A 125 14.377 3.695 5.451 1.00 1.35 H new ATOM 2039 N ALA A 126 14.398 7.859 2.029 1.00 0.53 N ATOM 2040 CA ALA A 126 14.124 8.984 1.150 1.00 0.49 C ATOM 2041 C ALA A 126 15.395 9.760 0.835 1.00 0.49 C ATOM 2042 O ALA A 126 15.492 10.405 -0.203 1.00 0.48 O ATOM 2043 CB ALA A 126 13.097 9.904 1.811 1.00 0.38 C ATOM 0 H ALA A 126 14.117 8.034 2.994 1.00 0.53 H new ATOM 0 HA ALA A 126 13.726 8.602 0.210 1.00 0.49 H new ATOM 0 HB1 ALA A 126 12.889 10.749 1.154 1.00 0.38 H new ATOM 0 HB2 ALA A 126 12.176 9.350 1.992 1.00 0.38 H new ATOM 0 HB3 ALA A 126 13.493 10.270 2.758 1.00 0.38 H new ATOM 2049 N GLU A 127 16.357 9.725 1.744 1.00 0.50 N ATOM 2050 CA GLU A 127 17.634 10.390 1.633 1.00 0.46 C ATOM 2051 C GLU A 127 18.496 9.617 0.661 1.00 0.47 C ATOM 2052 O GLU A 127 18.929 10.179 -0.332 1.00 0.49 O ATOM 2053 CB GLU A 127 18.309 10.460 3.002 1.00 0.49 C ATOM 2054 CG GLU A 127 17.522 11.403 3.915 1.00 0.51 C ATOM 2055 CD GLU A 127 18.301 12.699 4.085 1.00 0.96 C ATOM 2056 OE1 GLU A 127 19.438 12.638 4.604 1.00 1.37 O ATOM 2057 OE2 GLU A 127 17.902 13.713 3.469 1.00 2.45 O ATOM 0 H GLU A 127 16.258 9.207 2.617 1.00 0.50 H new ATOM 0 HA GLU A 127 17.494 11.408 1.270 1.00 0.46 H new ATOM 0 HB2 GLU A 127 18.359 9.466 3.445 1.00 0.49 H new ATOM 0 HB3 GLU A 127 19.335 10.813 2.895 1.00 0.49 H new ATOM 0 HG2 GLU A 127 16.541 11.608 3.487 1.00 0.51 H new ATOM 0 HG3 GLU A 127 17.355 10.935 4.885 1.00 0.51 H new ATOM 2064 N GLU A 128 18.710 8.326 0.911 1.00 0.48 N ATOM 2065 CA GLU A 128 19.416 7.434 0.000 1.00 0.50 C ATOM 2066 C GLU A 128 18.764 7.515 -1.378 1.00 0.50 C ATOM 2067 O GLU A 128 19.451 7.493 -2.388 1.00 0.53 O ATOM 2068 CB GLU A 128 19.372 6.010 0.578 1.00 0.55 C ATOM 2069 CG GLU A 128 20.176 4.970 -0.216 1.00 0.75 C ATOM 2070 CD GLU A 128 21.695 5.144 -0.116 1.00 1.69 C ATOM 2071 OE1 GLU A 128 22.381 4.198 0.332 1.00 2.47 O ATOM 2072 OE2 GLU A 128 22.225 6.166 -0.605 1.00 3.12 O ATOM 0 H GLU A 128 18.392 7.867 1.764 1.00 0.48 H new ATOM 0 HA GLU A 128 20.461 7.724 -0.109 1.00 0.50 H new ATOM 0 HB2 GLU A 128 19.748 6.036 1.601 1.00 0.55 H new ATOM 0 HB3 GLU A 128 18.333 5.685 0.628 1.00 0.55 H new ATOM 0 HG2 GLU A 128 19.911 3.974 0.139 1.00 0.75 H new ATOM 0 HG3 GLU A 128 19.883 5.023 -1.265 1.00 0.75 H new ATOM 2079 N TYR A 129 17.439 7.665 -1.439 1.00 0.48 N ATOM 2080 CA TYR A 129 16.755 7.817 -2.717 1.00 0.48 C ATOM 2081 C TYR A 129 17.134 9.142 -3.384 1.00 0.49 C ATOM 2082 O TYR A 129 17.578 9.189 -4.525 1.00 0.47 O ATOM 2083 CB TYR A 129 15.244 7.761 -2.477 1.00 0.47 C ATOM 2084 CG TYR A 129 14.393 7.863 -3.726 1.00 0.87 C ATOM 2085 CD1 TYR A 129 14.291 6.753 -4.576 1.00 1.88 C ATOM 2086 CD2 TYR A 129 13.689 9.042 -4.032 1.00 1.97 C ATOM 2087 CE1 TYR A 129 13.479 6.791 -5.722 1.00 2.29 C ATOM 2088 CE2 TYR A 129 12.887 9.100 -5.186 1.00 2.37 C ATOM 2089 CZ TYR A 129 12.767 7.971 -6.029 1.00 2.03 C ATOM 2090 OH TYR A 129 11.977 8.039 -7.136 1.00 2.61 O ATOM 0 H TYR A 129 16.826 7.684 -0.624 1.00 0.48 H new ATOM 0 HA TYR A 129 17.056 7.009 -3.384 1.00 0.48 H new ATOM 0 HB2 TYR A 129 15.006 6.826 -1.969 1.00 0.47 H new ATOM 0 HB3 TYR A 129 14.968 8.570 -1.801 1.00 0.47 H new ATOM 0 HD1 TYR A 129 14.845 5.855 -4.346 1.00 1.88 H new ATOM 0 HD2 TYR A 129 13.764 9.901 -3.382 1.00 1.97 H new ATOM 0 HE1 TYR A 129 13.400 5.925 -6.363 1.00 2.29 H new ATOM 0 HE2 TYR A 129 12.360 10.011 -5.429 1.00 2.37 H new ATOM 0 HH TYR A 129 11.563 8.926 -7.189 1.00 2.61 H new ATOM 2100 N SER A 130 16.906 10.242 -2.679 1.00 0.53 N ATOM 2101 CA SER A 130 16.979 11.592 -3.208 1.00 0.57 C ATOM 2102 C SER A 130 18.405 11.859 -3.689 1.00 0.63 C ATOM 2103 O SER A 130 18.627 12.297 -4.819 1.00 0.87 O ATOM 2104 CB SER A 130 16.499 12.552 -2.107 1.00 0.53 C ATOM 2105 OG SER A 130 16.482 13.886 -2.565 1.00 0.67 O ATOM 0 H SER A 130 16.657 10.215 -1.690 1.00 0.53 H new ATOM 0 HA SER A 130 16.334 11.740 -4.074 1.00 0.57 H new ATOM 0 HB2 SER A 130 15.500 12.264 -1.780 1.00 0.53 H new ATOM 0 HB3 SER A 130 17.154 12.471 -1.239 1.00 0.53 H new ATOM 0 HG SER A 130 16.171 14.475 -1.846 1.00 0.67 H new ATOM 2111 N LYS A 131 19.367 11.523 -2.829 1.00 0.59 N ATOM 2112 CA LYS A 131 20.793 11.558 -3.107 1.00 0.56 C ATOM 2113 C LYS A 131 21.126 10.608 -4.255 1.00 0.55 C ATOM 2114 O LYS A 131 21.817 11.018 -5.184 1.00 0.65 O ATOM 2115 CB LYS A 131 21.613 11.214 -1.848 1.00 0.58 C ATOM 2116 CG LYS A 131 21.802 12.404 -0.888 1.00 0.71 C ATOM 2117 CD LYS A 131 20.761 12.522 0.234 1.00 0.86 C ATOM 2118 CE LYS A 131 21.129 13.736 1.101 1.00 1.32 C ATOM 2119 NZ LYS A 131 20.354 13.813 2.357 1.00 1.97 N ATOM 0 H LYS A 131 19.159 11.207 -1.882 1.00 0.59 H new ATOM 0 HA LYS A 131 21.062 12.571 -3.406 1.00 0.56 H new ATOM 0 HB2 LYS A 131 21.119 10.403 -1.314 1.00 0.58 H new ATOM 0 HB3 LYS A 131 22.592 10.845 -2.153 1.00 0.58 H new ATOM 0 HG2 LYS A 131 22.791 12.329 -0.436 1.00 0.71 H new ATOM 0 HG3 LYS A 131 21.787 13.325 -1.472 1.00 0.71 H new ATOM 0 HD2 LYS A 131 19.762 12.642 -0.185 1.00 0.86 H new ATOM 0 HD3 LYS A 131 20.747 11.614 0.837 1.00 0.86 H new ATOM 0 HE2 LYS A 131 22.192 13.695 1.340 1.00 1.32 H new ATOM 0 HE3 LYS A 131 20.967 14.647 0.526 1.00 1.32 H new ATOM 0 HZ1 LYS A 131 20.562 14.711 2.838 1.00 1.97 H new ATOM 0 HZ2 LYS A 131 19.338 13.762 2.142 1.00 1.97 H new ATOM 0 HZ3 LYS A 131 20.617 13.020 2.976 1.00 1.97 H new ATOM 2133 N ASP A 132 20.678 9.352 -4.201 1.00 0.47 N ATOM 2134 CA ASP A 132 20.974 8.401 -5.267 1.00 0.59 C ATOM 2135 C ASP A 132 19.915 7.312 -5.428 1.00 0.46 C ATOM 2136 O ASP A 132 20.017 6.198 -4.904 1.00 0.40 O ATOM 2137 CB ASP A 132 22.324 7.720 -5.065 1.00 0.76 C ATOM 2138 CG ASP A 132 22.568 6.788 -6.258 1.00 0.95 C ATOM 2139 OD1 ASP A 132 23.178 5.716 -6.061 1.00 1.27 O ATOM 2140 OD2 ASP A 132 22.059 7.111 -7.359 1.00 2.36 O ATOM 0 H ASP A 132 20.115 8.975 -3.438 1.00 0.47 H new ATOM 0 HA ASP A 132 20.987 9.008 -6.173 1.00 0.59 H new ATOM 0 HB2 ASP A 132 23.118 8.463 -4.993 1.00 0.76 H new ATOM 0 HB3 ASP A 132 22.330 7.155 -4.133 1.00 0.76 H new ATOM 2145 N ARG A 133 18.952 7.574 -6.304 1.00 0.45 N ATOM 2146 CA ARG A 133 17.931 6.591 -6.618 1.00 0.37 C ATOM 2147 C ARG A 133 18.527 5.292 -7.134 1.00 0.32 C ATOM 2148 O ARG A 133 17.828 4.290 -7.094 1.00 0.32 O ATOM 2149 CB ARG A 133 16.889 7.101 -7.620 1.00 0.48 C ATOM 2150 CG ARG A 133 16.107 8.310 -7.097 1.00 0.64 C ATOM 2151 CD ARG A 133 16.722 9.675 -7.426 1.00 1.05 C ATOM 2152 NE ARG A 133 16.084 10.284 -8.600 1.00 1.52 N ATOM 2153 CZ ARG A 133 16.380 11.496 -9.078 1.00 2.08 C ATOM 2154 NH1 ARG A 133 15.719 11.968 -10.138 1.00 2.87 N ATOM 2155 NH2 ARG A 133 17.330 12.232 -8.497 1.00 2.96 N ATOM 0 H ARG A 133 18.860 8.457 -6.806 1.00 0.45 H new ATOM 0 HA ARG A 133 17.424 6.402 -5.672 1.00 0.37 H new ATOM 0 HB2 ARG A 133 17.388 7.371 -8.551 1.00 0.48 H new ATOM 0 HB3 ARG A 133 16.192 6.296 -7.854 1.00 0.48 H new ATOM 0 HG2 ARG A 133 15.098 8.275 -7.507 1.00 0.64 H new ATOM 0 HG3 ARG A 133 16.014 8.222 -6.015 1.00 0.64 H new ATOM 0 HD2 ARG A 133 16.617 10.339 -6.568 1.00 1.05 H new ATOM 0 HD3 ARG A 133 17.790 9.559 -7.610 1.00 1.05 H new ATOM 0 HE ARG A 133 15.366 9.745 -9.084 1.00 1.52 H new ATOM 0 HH11 ARG A 133 14.992 11.404 -10.578 1.00 2.87 H new ATOM 0 HH12 ARG A 133 15.941 12.893 -10.507 1.00 2.87 H new ATOM 0 HH21 ARG A 133 17.832 11.869 -7.686 1.00 2.96 H new ATOM 0 HH22 ARG A 133 17.554 13.157 -8.864 1.00 2.96 H new ATOM 2169 N LYS A 134 19.764 5.258 -7.637 1.00 0.34 N ATOM 2170 CA LYS A 134 20.349 4.010 -8.107 1.00 0.30 C ATOM 2171 C LYS A 134 20.514 3.041 -6.950 1.00 0.31 C ATOM 2172 O LYS A 134 20.097 1.896 -7.091 1.00 0.39 O ATOM 2173 CB LYS A 134 21.669 4.261 -8.836 1.00 0.33 C ATOM 2174 CG LYS A 134 21.376 5.016 -10.139 1.00 0.45 C ATOM 2175 CD LYS A 134 22.594 5.789 -10.640 1.00 1.63 C ATOM 2176 CE LYS A 134 22.163 6.583 -11.875 1.00 2.16 C ATOM 2177 NZ LYS A 134 23.265 7.408 -12.413 1.00 3.05 N ATOM 0 H LYS A 134 20.370 6.073 -7.727 1.00 0.34 H new ATOM 0 HA LYS A 134 19.671 3.555 -8.829 1.00 0.30 H new ATOM 0 HB2 LYS A 134 22.344 4.841 -8.207 1.00 0.33 H new ATOM 0 HB3 LYS A 134 22.168 3.316 -9.051 1.00 0.33 H new ATOM 0 HG2 LYS A 134 21.056 4.308 -10.904 1.00 0.45 H new ATOM 0 HG3 LYS A 134 20.549 5.707 -9.979 1.00 0.45 H new ATOM 0 HD2 LYS A 134 22.967 6.459 -9.865 1.00 1.63 H new ATOM 0 HD3 LYS A 134 23.406 5.105 -10.889 1.00 1.63 H new ATOM 0 HE2 LYS A 134 21.815 5.895 -12.646 1.00 2.16 H new ATOM 0 HE3 LYS A 134 21.321 7.225 -11.618 1.00 2.16 H new ATOM 0 HZ1 LYS A 134 22.932 7.930 -13.249 1.00 3.05 H new ATOM 0 HZ2 LYS A 134 23.580 8.082 -11.687 1.00 3.05 H new ATOM 0 HZ3 LYS A 134 24.059 6.793 -12.683 1.00 3.05 H new ATOM 2191 N LYS A 135 21.075 3.447 -5.806 1.00 0.33 N ATOM 2192 CA LYS A 135 21.157 2.527 -4.670 1.00 0.40 C ATOM 2193 C LYS A 135 19.789 2.025 -4.250 1.00 0.38 C ATOM 2194 O LYS A 135 19.657 0.845 -3.942 1.00 0.52 O ATOM 2195 CB LYS A 135 21.866 3.156 -3.464 1.00 0.54 C ATOM 2196 CG LYS A 135 23.381 2.940 -3.565 1.00 0.59 C ATOM 2197 CD LYS A 135 24.185 4.241 -3.694 1.00 1.28 C ATOM 2198 CE LYS A 135 25.166 4.445 -2.536 1.00 1.55 C ATOM 2199 NZ LYS A 135 24.498 4.924 -1.304 1.00 2.75 N ATOM 0 H LYS A 135 21.467 4.375 -5.645 1.00 0.33 H new ATOM 0 HA LYS A 135 21.751 1.680 -5.014 1.00 0.40 H new ATOM 0 HB2 LYS A 135 21.646 4.223 -3.420 1.00 0.54 H new ATOM 0 HB3 LYS A 135 21.490 2.714 -2.541 1.00 0.54 H new ATOM 0 HG2 LYS A 135 23.721 2.400 -2.682 1.00 0.59 H new ATOM 0 HG3 LYS A 135 23.592 2.307 -4.427 1.00 0.59 H new ATOM 0 HD2 LYS A 135 24.736 4.231 -4.634 1.00 1.28 H new ATOM 0 HD3 LYS A 135 23.498 5.086 -3.736 1.00 1.28 H new ATOM 0 HE2 LYS A 135 25.676 3.505 -2.327 1.00 1.55 H new ATOM 0 HE3 LYS A 135 25.930 5.163 -2.834 1.00 1.55 H new ATOM 0 HZ1 LYS A 135 25.201 5.363 -0.676 1.00 2.75 H new ATOM 0 HZ2 LYS A 135 23.771 5.625 -1.553 1.00 2.75 H new ATOM 0 HZ3 LYS A 135 24.052 4.121 -0.816 1.00 2.75 H new ATOM 2213 N PHE A 136 18.782 2.890 -4.229 1.00 0.33 N ATOM 2214 CA PHE A 136 17.430 2.493 -3.860 1.00 0.35 C ATOM 2215 C PHE A 136 16.930 1.457 -4.853 1.00 0.39 C ATOM 2216 O PHE A 136 16.341 0.459 -4.460 1.00 0.46 O ATOM 2217 CB PHE A 136 16.506 3.714 -3.829 1.00 0.34 C ATOM 2218 CG PHE A 136 15.040 3.414 -4.101 1.00 0.71 C ATOM 2219 CD1 PHE A 136 14.139 3.198 -3.043 1.00 2.00 C ATOM 2220 CD2 PHE A 136 14.567 3.416 -5.429 1.00 2.27 C ATOM 2221 CE1 PHE A 136 12.774 3.002 -3.316 1.00 2.22 C ATOM 2222 CE2 PHE A 136 13.207 3.203 -5.700 1.00 2.76 C ATOM 2223 CZ PHE A 136 12.309 3.009 -4.641 1.00 1.98 C ATOM 0 H PHE A 136 18.878 3.878 -4.465 1.00 0.33 H new ATOM 0 HA PHE A 136 17.435 2.056 -2.861 1.00 0.35 H new ATOM 0 HB2 PHE A 136 16.589 4.190 -2.852 1.00 0.34 H new ATOM 0 HB3 PHE A 136 16.857 4.436 -4.566 1.00 0.34 H new ATOM 0 HD1 PHE A 136 14.495 3.183 -2.023 1.00 2.00 H new ATOM 0 HD2 PHE A 136 15.256 3.583 -6.243 1.00 2.27 H new ATOM 0 HE1 PHE A 136 12.080 2.845 -2.503 1.00 2.22 H new ATOM 0 HE2 PHE A 136 12.853 3.189 -6.720 1.00 2.76 H new ATOM 0 HZ PHE A 136 11.258 2.865 -4.845 1.00 1.98 H new ATOM 2233 N CYS A 137 17.135 1.712 -6.143 1.00 0.38 N ATOM 2234 CA CYS A 137 16.592 0.899 -7.208 1.00 0.41 C ATOM 2235 C CYS A 137 17.224 -0.484 -7.130 1.00 0.41 C ATOM 2236 O CYS A 137 16.528 -1.486 -7.199 1.00 0.50 O ATOM 2237 CB CYS A 137 16.861 1.570 -8.562 1.00 0.41 C ATOM 2238 SG CYS A 137 15.591 1.088 -9.759 1.00 1.53 S ATOM 0 H CYS A 137 17.691 2.501 -6.473 1.00 0.38 H new ATOM 0 HA CYS A 137 15.512 0.797 -7.103 1.00 0.41 H new ATOM 0 HB2 CYS A 137 16.868 2.654 -8.444 1.00 0.41 H new ATOM 0 HB3 CYS A 137 17.846 1.283 -8.930 1.00 0.41 H new ATOM 0 HG CYS A 137 15.829 1.664 -10.900 1.00 1.53 H new ATOM 2244 N LYS A 138 18.544 -0.554 -6.959 1.00 0.37 N ATOM 2245 CA LYS A 138 19.236 -1.841 -6.948 1.00 0.43 C ATOM 2246 C LYS A 138 18.834 -2.607 -5.694 1.00 0.41 C ATOM 2247 O LYS A 138 18.438 -3.767 -5.774 1.00 0.42 O ATOM 2248 CB LYS A 138 20.758 -1.661 -7.054 1.00 0.51 C ATOM 2249 CG LYS A 138 21.232 -1.625 -8.516 1.00 0.72 C ATOM 2250 CD LYS A 138 20.754 -0.392 -9.295 1.00 1.34 C ATOM 2251 CE LYS A 138 21.068 -0.510 -10.790 1.00 1.65 C ATOM 2252 NZ LYS A 138 22.519 -0.610 -11.058 1.00 2.24 N ATOM 0 H LYS A 138 19.149 0.256 -6.828 1.00 0.37 H new ATOM 0 HA LYS A 138 18.939 -2.421 -7.822 1.00 0.43 H new ATOM 0 HB2 LYS A 138 21.050 -0.737 -6.555 1.00 0.51 H new ATOM 0 HB3 LYS A 138 21.257 -2.477 -6.531 1.00 0.51 H new ATOM 0 HG2 LYS A 138 22.321 -1.655 -8.535 1.00 0.72 H new ATOM 0 HG3 LYS A 138 20.880 -2.523 -9.024 1.00 0.72 H new ATOM 0 HD2 LYS A 138 19.680 -0.268 -9.157 1.00 1.34 H new ATOM 0 HD3 LYS A 138 21.232 0.501 -8.892 1.00 1.34 H new ATOM 0 HE2 LYS A 138 20.566 -1.388 -11.195 1.00 1.65 H new ATOM 0 HE3 LYS A 138 20.664 0.357 -11.312 1.00 1.65 H new ATOM 0 HZ1 LYS A 138 22.681 -0.636 -12.085 1.00 2.24 H new ATOM 0 HZ2 LYS A 138 23.005 0.215 -10.652 1.00 2.24 H new ATOM 0 HZ3 LYS A 138 22.893 -1.479 -10.626 1.00 2.24 H new ATOM 2266 N ASN A 139 18.880 -1.938 -4.538 1.00 0.41 N ATOM 2267 CA ASN A 139 18.383 -2.524 -3.300 1.00 0.40 C ATOM 2268 C ASN A 139 16.966 -3.045 -3.485 1.00 0.38 C ATOM 2269 O ASN A 139 16.652 -4.087 -2.933 1.00 0.55 O ATOM 2270 CB ASN A 139 18.381 -1.537 -2.128 1.00 0.49 C ATOM 2271 CG ASN A 139 19.673 -1.567 -1.329 1.00 0.82 C ATOM 2272 OD1 ASN A 139 19.775 -2.264 -0.324 1.00 1.95 O ATOM 2273 ND2 ASN A 139 20.670 -0.797 -1.732 1.00 1.13 N ATOM 0 H ASN A 139 19.255 -0.995 -4.439 1.00 0.41 H new ATOM 0 HA ASN A 139 19.067 -3.338 -3.061 1.00 0.40 H new ATOM 0 HB2 ASN A 139 18.218 -0.529 -2.509 1.00 0.49 H new ATOM 0 HB3 ASN A 139 17.545 -1.767 -1.467 1.00 0.49 H new ATOM 0 HD21 ASN A 139 21.543 -0.775 -1.205 1.00 1.13 H new ATOM 0 HD22 ASN A 139 20.566 -0.225 -2.570 1.00 1.13 H new ATOM 2280 N ALA A 140 16.100 -2.327 -4.206 1.00 0.29 N ATOM 2281 CA ALA A 140 14.707 -2.699 -4.385 1.00 0.31 C ATOM 2282 C ALA A 140 14.585 -3.939 -5.250 1.00 0.31 C ATOM 2283 O ALA A 140 13.750 -4.783 -4.967 1.00 0.33 O ATOM 2284 CB ALA A 140 13.896 -1.572 -5.015 1.00 0.31 C ATOM 0 H ALA A 140 16.356 -1.463 -4.684 1.00 0.29 H new ATOM 0 HA ALA A 140 14.307 -2.904 -3.392 1.00 0.31 H new ATOM 0 HB1 ALA A 140 12.860 -1.890 -5.132 1.00 0.31 H new ATOM 0 HB2 ALA A 140 13.935 -0.692 -4.372 1.00 0.31 H new ATOM 0 HB3 ALA A 140 14.312 -1.326 -5.992 1.00 0.31 H new ATOM 2290 N GLU A 141 15.367 -4.049 -6.319 1.00 0.33 N ATOM 2291 CA GLU A 141 15.430 -5.225 -7.173 1.00 0.37 C ATOM 2292 C GLU A 141 15.663 -6.459 -6.299 1.00 0.43 C ATOM 2293 O GLU A 141 14.982 -7.480 -6.419 1.00 0.53 O ATOM 2294 CB GLU A 141 16.553 -4.988 -8.202 1.00 0.41 C ATOM 2295 CG GLU A 141 16.302 -5.681 -9.542 1.00 0.76 C ATOM 2296 CD GLU A 141 17.281 -5.199 -10.615 1.00 0.82 C ATOM 2297 OE1 GLU A 141 17.970 -6.079 -11.176 1.00 2.20 O ATOM 2298 OE2 GLU A 141 17.320 -3.972 -10.860 1.00 1.40 O ATOM 0 H GLU A 141 15.991 -3.301 -6.622 1.00 0.33 H new ATOM 0 HA GLU A 141 14.501 -5.398 -7.717 1.00 0.37 H new ATOM 0 HB2 GLU A 141 16.662 -3.917 -8.370 1.00 0.41 H new ATOM 0 HB3 GLU A 141 17.497 -5.344 -7.788 1.00 0.41 H new ATOM 0 HG2 GLU A 141 16.398 -6.760 -9.419 1.00 0.76 H new ATOM 0 HG3 GLU A 141 15.280 -5.487 -9.867 1.00 0.76 H new ATOM 2305 N GLU A 142 16.599 -6.346 -5.359 1.00 0.44 N ATOM 2306 CA GLU A 142 16.915 -7.443 -4.469 1.00 0.50 C ATOM 2307 C GLU A 142 15.796 -7.652 -3.458 1.00 0.49 C ATOM 2308 O GLU A 142 15.366 -8.776 -3.237 1.00 0.52 O ATOM 2309 CB GLU A 142 18.242 -7.185 -3.756 1.00 0.54 C ATOM 2310 CG GLU A 142 19.425 -7.405 -4.699 1.00 0.70 C ATOM 2311 CD GLU A 142 20.714 -7.509 -3.888 1.00 1.34 C ATOM 2312 OE1 GLU A 142 21.501 -6.540 -3.920 1.00 2.96 O ATOM 2313 OE2 GLU A 142 20.866 -8.558 -3.220 1.00 1.88 O ATOM 0 H GLU A 142 17.148 -5.501 -5.200 1.00 0.44 H new ATOM 0 HA GLU A 142 17.013 -8.352 -5.063 1.00 0.50 H new ATOM 0 HB2 GLU A 142 18.261 -6.164 -3.375 1.00 0.54 H new ATOM 0 HB3 GLU A 142 18.331 -7.848 -2.895 1.00 0.54 H new ATOM 0 HG2 GLU A 142 19.275 -8.315 -5.281 1.00 0.70 H new ATOM 0 HG3 GLU A 142 19.495 -6.581 -5.409 1.00 0.70 H new ATOM 2320 N PHE A 143 15.342 -6.588 -2.801 1.00 0.46 N ATOM 2321 CA PHE A 143 14.356 -6.621 -1.728 1.00 0.46 C ATOM 2322 C PHE A 143 13.104 -7.325 -2.214 1.00 0.41 C ATOM 2323 O PHE A 143 12.574 -8.212 -1.549 1.00 0.44 O ATOM 2324 CB PHE A 143 14.055 -5.200 -1.241 1.00 0.47 C ATOM 2325 CG PHE A 143 14.544 -4.958 0.169 1.00 1.07 C ATOM 2326 CD1 PHE A 143 13.628 -4.786 1.220 1.00 1.09 C ATOM 2327 CD2 PHE A 143 15.927 -4.932 0.429 1.00 2.06 C ATOM 2328 CE1 PHE A 143 14.096 -4.589 2.532 1.00 1.90 C ATOM 2329 CE2 PHE A 143 16.393 -4.752 1.743 1.00 2.88 C ATOM 2330 CZ PHE A 143 15.477 -4.583 2.796 1.00 2.75 C ATOM 0 H PHE A 143 15.664 -5.643 -3.011 1.00 0.46 H new ATOM 0 HA PHE A 143 14.753 -7.179 -0.880 1.00 0.46 H new ATOM 0 HB2 PHE A 143 14.524 -4.482 -1.913 1.00 0.47 H new ATOM 0 HB3 PHE A 143 12.980 -5.024 -1.285 1.00 0.47 H new ATOM 0 HD1 PHE A 143 12.567 -4.805 1.021 1.00 1.09 H new ATOM 0 HD2 PHE A 143 16.631 -5.050 -0.382 1.00 2.06 H new ATOM 0 HE1 PHE A 143 13.393 -4.442 3.338 1.00 1.90 H new ATOM 0 HE2 PHE A 143 17.454 -4.744 1.943 1.00 2.88 H new ATOM 0 HZ PHE A 143 15.834 -4.449 3.807 1.00 2.75 H new ATOM 2340 N THR A 144 12.677 -6.950 -3.410 1.00 0.36 N ATOM 2341 CA THR A 144 11.658 -7.636 -4.157 1.00 0.38 C ATOM 2342 C THR A 144 11.982 -9.130 -4.249 1.00 0.49 C ATOM 2343 O THR A 144 11.203 -9.936 -3.754 1.00 0.63 O ATOM 2344 CB THR A 144 11.492 -6.942 -5.506 1.00 0.39 C ATOM 2345 OG1 THR A 144 11.084 -5.609 -5.285 1.00 0.38 O ATOM 2346 CG2 THR A 144 10.425 -7.633 -6.334 1.00 0.45 C ATOM 0 H THR A 144 13.048 -6.133 -3.895 1.00 0.36 H new ATOM 0 HA THR A 144 10.693 -7.584 -3.652 1.00 0.38 H new ATOM 0 HB THR A 144 12.443 -6.979 -6.038 1.00 0.39 H new ATOM 0 HG1 THR A 144 11.872 -5.047 -5.131 1.00 0.38 H new ATOM 0 HG21 THR A 144 10.321 -7.124 -7.292 1.00 0.45 H new ATOM 0 HG22 THR A 144 10.712 -8.671 -6.504 1.00 0.45 H new ATOM 0 HG23 THR A 144 9.474 -7.602 -5.802 1.00 0.45 H new ATOM 2354 N LYS A 145 13.115 -9.559 -4.817 1.00 0.47 N ATOM 2355 CA LYS A 145 13.347 -11.003 -4.896 1.00 0.58 C ATOM 2356 C LYS A 145 13.611 -11.690 -3.546 1.00 0.63 C ATOM 2357 O LYS A 145 13.679 -12.916 -3.514 1.00 0.81 O ATOM 2358 CB LYS A 145 14.440 -11.339 -5.911 1.00 0.64 C ATOM 2359 CG LYS A 145 15.858 -10.950 -5.480 1.00 2.11 C ATOM 2360 CD LYS A 145 16.853 -12.040 -5.870 1.00 2.03 C ATOM 2361 CE LYS A 145 16.661 -13.268 -4.965 1.00 2.60 C ATOM 2362 NZ LYS A 145 17.745 -13.406 -3.969 1.00 4.15 N ATOM 0 H LYS A 145 13.847 -8.966 -5.208 1.00 0.47 H new ATOM 0 HA LYS A 145 12.401 -11.418 -5.244 1.00 0.58 H new ATOM 0 HB2 LYS A 145 14.416 -12.411 -6.108 1.00 0.64 H new ATOM 0 HB3 LYS A 145 14.210 -10.837 -6.851 1.00 0.64 H new ATOM 0 HG2 LYS A 145 16.141 -10.007 -5.948 1.00 2.11 H new ATOM 0 HG3 LYS A 145 15.886 -10.792 -4.402 1.00 2.11 H new ATOM 0 HD2 LYS A 145 16.709 -12.320 -6.914 1.00 2.03 H new ATOM 0 HD3 LYS A 145 17.872 -11.665 -5.778 1.00 2.03 H new ATOM 0 HE2 LYS A 145 15.704 -13.190 -4.449 1.00 2.60 H new ATOM 0 HE3 LYS A 145 16.619 -14.167 -5.580 1.00 2.60 H new ATOM 0 HZ1 LYS A 145 17.572 -14.247 -3.382 1.00 4.15 H new ATOM 0 HZ2 LYS A 145 18.656 -13.507 -4.460 1.00 4.15 H new ATOM 0 HZ3 LYS A 145 17.770 -12.561 -3.363 1.00 4.15 H new ATOM 2376 N LYS A 146 13.842 -10.962 -2.449 1.00 0.56 N ATOM 2377 CA LYS A 146 14.009 -11.562 -1.127 1.00 0.59 C ATOM 2378 C LYS A 146 12.643 -11.861 -0.521 1.00 0.58 C ATOM 2379 O LYS A 146 12.407 -12.970 -0.059 1.00 0.72 O ATOM 2380 CB LYS A 146 14.837 -10.638 -0.214 1.00 0.60 C ATOM 2381 CG LYS A 146 16.334 -10.764 -0.539 1.00 0.63 C ATOM 2382 CD LYS A 146 17.047 -9.430 -0.782 1.00 1.27 C ATOM 2383 CE LYS A 146 17.862 -8.901 0.403 1.00 2.17 C ATOM 2384 NZ LYS A 146 17.016 -8.304 1.460 1.00 4.25 N ATOM 0 H LYS A 146 13.918 -9.945 -2.455 1.00 0.56 H new ATOM 0 HA LYS A 146 14.554 -12.501 -1.226 1.00 0.59 H new ATOM 0 HB2 LYS A 146 14.516 -9.605 -0.345 1.00 0.60 H new ATOM 0 HB3 LYS A 146 14.662 -10.897 0.830 1.00 0.60 H new ATOM 0 HG2 LYS A 146 16.829 -11.281 0.283 1.00 0.63 H new ATOM 0 HG3 LYS A 146 16.449 -11.389 -1.424 1.00 0.63 H new ATOM 0 HD2 LYS A 146 17.712 -9.542 -1.638 1.00 1.27 H new ATOM 0 HD3 LYS A 146 16.302 -8.682 -1.053 1.00 1.27 H new ATOM 0 HE2 LYS A 146 18.446 -9.717 0.829 1.00 2.17 H new ATOM 0 HE3 LYS A 146 18.571 -8.154 0.046 1.00 2.17 H new ATOM 0 HZ1 LYS A 146 17.477 -8.427 2.384 1.00 4.25 H new ATOM 0 HZ2 LYS A 146 16.887 -7.290 1.270 1.00 4.25 H new ATOM 0 HZ3 LYS A 146 16.089 -8.775 1.470 1.00 4.25 H new ATOM 2398 N TYR A 147 11.786 -10.845 -0.448 1.00 0.45 N ATOM 2399 CA TYR A 147 10.491 -10.909 0.216 1.00 0.40 C ATOM 2400 C TYR A 147 9.331 -10.518 -0.692 1.00 0.31 C ATOM 2401 O TYR A 147 8.224 -10.984 -0.457 1.00 0.31 O ATOM 2402 CB TYR A 147 10.502 -10.010 1.450 1.00 0.46 C ATOM 2403 CG TYR A 147 10.725 -10.809 2.710 1.00 0.49 C ATOM 2404 CD1 TYR A 147 12.020 -11.244 3.036 1.00 1.73 C ATOM 2405 CD2 TYR A 147 9.625 -11.232 3.478 1.00 1.95 C ATOM 2406 CE1 TYR A 147 12.219 -12.100 4.129 1.00 1.75 C ATOM 2407 CE2 TYR A 147 9.818 -12.086 4.575 1.00 1.94 C ATOM 2408 CZ TYR A 147 11.120 -12.525 4.908 1.00 0.51 C ATOM 2409 OH TYR A 147 11.326 -13.367 5.958 1.00 0.53 O ATOM 0 H TYR A 147 11.980 -9.932 -0.860 1.00 0.45 H new ATOM 0 HA TYR A 147 10.333 -11.949 0.501 1.00 0.40 H new ATOM 0 HB2 TYR A 147 11.287 -9.260 1.349 1.00 0.46 H new ATOM 0 HB3 TYR A 147 9.556 -9.474 1.520 1.00 0.46 H new ATOM 0 HD1 TYR A 147 12.863 -10.919 2.445 1.00 1.73 H new ATOM 0 HD2 TYR A 147 8.630 -10.899 3.223 1.00 1.95 H new ATOM 0 HE1 TYR A 147 13.216 -12.435 4.376 1.00 1.75 H new ATOM 0 HE2 TYR A 147 8.972 -12.408 5.165 1.00 1.94 H new ATOM 0 HH TYR A 147 10.470 -13.564 6.392 1.00 0.53 H new ATOM 2419 N GLY A 148 9.543 -9.593 -1.631 1.00 0.36 N ATOM 2420 CA GLY A 148 8.499 -9.058 -2.495 1.00 0.29 C ATOM 2421 C GLY A 148 7.637 -10.152 -3.114 1.00 0.28 C ATOM 2422 O GLY A 148 8.107 -11.233 -3.458 1.00 0.30 O ATOM 0 H GLY A 148 10.463 -9.191 -1.812 1.00 0.36 H new ATOM 0 HA2 GLY A 148 7.866 -8.383 -1.919 1.00 0.29 H new ATOM 0 HA3 GLY A 148 8.956 -8.467 -3.289 1.00 0.29 H new ATOM 2426 N GLU A 149 6.348 -9.856 -3.243 1.00 0.28 N ATOM 2427 CA GLU A 149 5.365 -10.818 -3.697 1.00 0.27 C ATOM 2428 C GLU A 149 5.540 -11.056 -5.193 1.00 0.32 C ATOM 2429 O GLU A 149 6.053 -10.220 -5.936 1.00 0.44 O ATOM 2430 CB GLU A 149 3.976 -10.270 -3.365 1.00 0.40 C ATOM 2431 CG GLU A 149 2.803 -11.237 -3.545 1.00 0.85 C ATOM 2432 CD GLU A 149 2.948 -12.525 -2.740 1.00 0.50 C ATOM 2433 OE1 GLU A 149 3.699 -13.387 -3.248 1.00 1.41 O ATOM 2434 OE2 GLU A 149 2.293 -12.634 -1.674 1.00 1.39 O ATOM 0 H GLU A 149 5.960 -8.936 -3.033 1.00 0.28 H new ATOM 0 HA GLU A 149 5.492 -11.778 -3.198 1.00 0.27 H new ATOM 0 HB2 GLU A 149 3.982 -9.928 -2.330 1.00 0.40 H new ATOM 0 HB3 GLU A 149 3.796 -9.394 -3.989 1.00 0.40 H new ATOM 0 HG2 GLU A 149 1.881 -10.736 -3.251 1.00 0.85 H new ATOM 0 HG3 GLU A 149 2.707 -11.487 -4.602 1.00 0.85 H new ATOM 2441 N LYS A 150 5.092 -12.211 -5.661 1.00 0.31 N ATOM 2442 CA LYS A 150 5.273 -12.563 -7.063 1.00 0.40 C ATOM 2443 C LYS A 150 4.204 -11.869 -7.908 1.00 0.41 C ATOM 2444 O LYS A 150 3.065 -12.328 -7.992 1.00 0.47 O ATOM 2445 CB LYS A 150 5.316 -14.084 -7.258 1.00 0.50 C ATOM 2446 CG LYS A 150 4.226 -14.827 -6.483 1.00 1.44 C ATOM 2447 CD LYS A 150 4.166 -16.293 -6.916 1.00 2.19 C ATOM 2448 CE LYS A 150 2.897 -16.947 -6.366 1.00 3.50 C ATOM 2449 NZ LYS A 150 1.682 -16.397 -7.008 1.00 5.34 N ATOM 0 H LYS A 150 4.607 -12.912 -5.101 1.00 0.31 H new ATOM 0 HA LYS A 150 6.242 -12.202 -7.407 1.00 0.40 H new ATOM 0 HB2 LYS A 150 5.215 -14.310 -8.320 1.00 0.50 H new ATOM 0 HB3 LYS A 150 6.292 -14.456 -6.945 1.00 0.50 H new ATOM 0 HG2 LYS A 150 4.426 -14.765 -5.413 1.00 1.44 H new ATOM 0 HG3 LYS A 150 3.261 -14.351 -6.655 1.00 1.44 H new ATOM 0 HD2 LYS A 150 4.178 -16.361 -8.004 1.00 2.19 H new ATOM 0 HD3 LYS A 150 5.046 -16.825 -6.554 1.00 2.19 H new ATOM 0 HE2 LYS A 150 2.941 -18.024 -6.530 1.00 3.50 H new ATOM 0 HE3 LYS A 150 2.843 -16.790 -5.289 1.00 3.50 H new ATOM 0 HZ1 LYS A 150 0.901 -17.077 -6.912 1.00 5.34 H new ATOM 0 HZ2 LYS A 150 1.421 -15.502 -6.547 1.00 5.34 H new ATOM 0 HZ3 LYS A 150 1.870 -16.225 -8.016 1.00 5.34 H new ATOM 2463 N ARG A 151 4.567 -10.744 -8.527 1.00 0.40 N ATOM 2464 CA ARG A 151 3.662 -9.995 -9.394 1.00 0.42 C ATOM 2465 C ARG A 151 3.178 -10.873 -10.549 1.00 0.51 C ATOM 2466 O ARG A 151 3.941 -11.698 -11.048 1.00 0.64 O ATOM 2467 CB ARG A 151 4.338 -8.706 -9.888 1.00 0.48 C ATOM 2468 CG ARG A 151 5.553 -8.884 -10.814 1.00 0.85 C ATOM 2469 CD ARG A 151 5.250 -8.747 -12.310 1.00 1.25 C ATOM 2470 NE ARG A 151 4.755 -7.403 -12.674 1.00 3.20 N ATOM 2471 CZ ARG A 151 4.275 -7.056 -13.881 1.00 4.55 C ATOM 2472 NH1 ARG A 151 4.045 -5.774 -14.173 1.00 6.59 N ATOM 2473 NH2 ARG A 151 4.033 -7.991 -14.795 1.00 4.49 N ATOM 0 H ARG A 151 5.495 -10.329 -8.440 1.00 0.40 H new ATOM 0 HA ARG A 151 2.782 -9.701 -8.822 1.00 0.42 H new ATOM 0 HB2 ARG A 151 3.593 -8.109 -10.413 1.00 0.48 H new ATOM 0 HB3 ARG A 151 4.653 -8.130 -9.018 1.00 0.48 H new ATOM 0 HG2 ARG A 151 6.309 -8.148 -10.542 1.00 0.85 H new ATOM 0 HG3 ARG A 151 5.987 -9.868 -10.635 1.00 0.85 H new ATOM 0 HD2 ARG A 151 6.154 -8.963 -12.880 1.00 1.25 H new ATOM 0 HD3 ARG A 151 4.507 -9.492 -12.595 1.00 1.25 H new ATOM 0 HE ARG A 151 4.779 -6.682 -11.953 1.00 3.20 H new ATOM 0 HH11 ARG A 151 4.233 -5.051 -13.479 1.00 6.59 H new ATOM 0 HH12 ARG A 151 3.681 -5.517 -15.091 1.00 6.59 H new ATOM 0 HH21 ARG A 151 4.211 -8.972 -14.581 1.00 4.49 H new ATOM 0 HH22 ARG A 151 3.669 -7.727 -15.710 1.00 4.49 H new ATOM 2487 N PRO A 152 1.930 -10.690 -10.996 1.00 0.49 N ATOM 2488 CA PRO A 152 1.394 -11.420 -12.131 1.00 0.59 C ATOM 2489 C PRO A 152 2.127 -10.989 -13.390 1.00 0.70 C ATOM 2490 O PRO A 152 2.492 -9.824 -13.508 1.00 0.83 O ATOM 2491 CB PRO A 152 -0.080 -11.033 -12.223 1.00 0.59 C ATOM 2492 CG PRO A 152 -0.172 -9.693 -11.488 1.00 0.54 C ATOM 2493 CD PRO A 152 1.010 -9.673 -10.521 1.00 0.44 C ATOM 0 HA PRO A 152 1.512 -12.498 -12.020 1.00 0.59 H new ATOM 0 HB2 PRO A 152 -0.402 -10.939 -13.260 1.00 0.59 H new ATOM 0 HB3 PRO A 152 -0.717 -11.785 -11.758 1.00 0.59 H new ATOM 0 HG2 PRO A 152 -0.121 -8.858 -12.187 1.00 0.54 H new ATOM 0 HG3 PRO A 152 -1.118 -9.603 -10.953 1.00 0.54 H new ATOM 0 HD2 PRO A 152 1.486 -8.692 -10.506 1.00 0.44 H new ATOM 0 HD3 PRO A 152 0.685 -9.885 -9.502 1.00 0.44 H new ATOM 2501 N VAL A 153 2.343 -11.899 -14.337 1.00 0.89 N ATOM 2502 CA VAL A 153 3.038 -11.555 -15.569 1.00 1.04 C ATOM 2503 C VAL A 153 2.252 -10.501 -16.354 1.00 1.10 C ATOM 2504 O VAL A 153 2.850 -9.548 -16.860 1.00 1.44 O ATOM 2505 CB VAL A 153 3.370 -12.817 -16.385 1.00 1.39 C ATOM 2506 CG1 VAL A 153 4.297 -13.721 -15.560 1.00 1.77 C ATOM 2507 CG2 VAL A 153 2.148 -13.637 -16.808 1.00 1.61 C ATOM 0 H VAL A 153 2.048 -12.873 -14.273 1.00 0.89 H new ATOM 0 HA VAL A 153 3.998 -11.099 -15.326 1.00 1.04 H new ATOM 0 HB VAL A 153 3.845 -12.465 -17.301 1.00 1.39 H new ATOM 0 HG11 VAL A 153 4.536 -14.617 -16.133 1.00 1.77 H new ATOM 0 HG12 VAL A 153 5.216 -13.184 -15.327 1.00 1.77 H new ATOM 0 HG13 VAL A 153 3.798 -14.005 -14.634 1.00 1.77 H new ATOM 0 HG21 VAL A 153 2.473 -14.507 -17.378 1.00 1.61 H new ATOM 0 HG22 VAL A 153 1.606 -13.966 -15.921 1.00 1.61 H new ATOM 0 HG23 VAL A 153 1.494 -13.022 -17.426 1.00 1.61 H new ATOM 2517 N ASP A 154 0.925 -10.629 -16.397 1.00 1.19 N ATOM 2518 CA ASP A 154 0.009 -9.760 -17.126 1.00 1.67 C ATOM 2519 C ASP A 154 -1.228 -9.602 -16.259 1.00 2.38 C ATOM 2520 O ASP A 154 -1.446 -10.483 -15.400 1.00 3.30 O ATOM 2521 CB ASP A 154 -0.341 -10.360 -18.497 1.00 2.66 C ATOM 2522 CG ASP A 154 -1.262 -11.588 -18.428 1.00 3.74 C ATOM 2523 OD1 ASP A 154 -0.864 -12.581 -17.777 1.00 4.78 O ATOM 2524 OD2 ASP A 154 -2.325 -11.543 -19.088 1.00 4.56 O ATOM 2525 OXT ASP A 154 -1.878 -8.533 -16.299 1.00 3.42 O ATOM 0 H ASP A 154 0.440 -11.377 -15.901 1.00 1.19 H new ATOM 0 HA ASP A 154 0.464 -8.789 -17.323 1.00 1.67 H new ATOM 0 HB2 ASP A 154 -0.821 -9.593 -19.105 1.00 2.66 H new ATOM 0 HB3 ASP A 154 0.582 -10.639 -19.006 1.00 2.66 H new TER 2530 ASP A 154