USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1221 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 125 HIS HD1 : A 125 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 146 HIS HD1 : A 146 HIS ND1 : A 202 ZNZN :(H bumps) USER MOD Set 1.1: A 148 MET CE :methyl -162:sc= -0.0305 (180deg=-0.359) USER MOD Set 1.2: A 149 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.038) USER MOD Set 2.1: A 2 TYR OH : rot 30:sc= 0.987 USER MOD Set 2.2: A 143 LYS NZ :NH3+ 170:sc= 0.54 (180deg=-0.592) USER MOD Set 3.1: A 140 LYS NZ :NH3+ 172:sc= 0.367 (180deg=0.202) USER MOD Set 3.2: A 157 ASN : amide:sc= 0 X(o=0.37,f=0.13) USER MOD Set 4.1: A 93 SER OG : rot 103:sc= 0.943 USER MOD Set 4.2: A 97 ASN : amide:sc= 0.322 K(o=1.3,f=-1.9!) USER MOD Set 5.1: A 12 GLN : amide:sc= 2.03 K(o=-0.37,f=-4.3!) USER MOD Set 5.2: A 55 CYS SG : rot -167:sc= -1.22 USER MOD Set 5.3: A 75 CYS SG : rot -120:sc= -1.18 USER MOD Set 6.1: A 49 GLN : amide:sc= 0.0536 K(o=1.1,f=-11!) USER MOD Set 6.2: A 56 LYS NZ :NH3+ -161:sc= 1.08 (180deg=-0.746) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= -0.011 (180deg=-0.118) USER MOD Single : A 3 SER OG : rot -62:sc= 0.148 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.148 USER MOD Single : A 15 LYS NZ :NH3+ -153:sc= 1.29 (180deg=0.783) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -35:sc= 1.23 USER MOD Single : A 33 GLN : amide:sc= 0.673 K(o=0.67,f=-0.0024) USER MOD Single : A 35 SER OG : rot 170:sc=-0.00173 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0335) USER MOD Single : A 40 ASN : amide:sc= -0.0286 X(o=-0.029,f=0) USER MOD Single : A 43 THR OG1 : rot -24:sc= 1.01 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN :FLIP amide:sc= -2.62! C(o=-5.3!,f=-2.6!) USER MOD Single : A 52 ASN : amide:sc= -1.88 K(o=-1.9,f=-3.2) USER MOD Single : A 57 THR OG1 : rot 58:sc= 1.12 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 93:sc= 1.25 USER MOD Single : A 71 MET CE :methyl 178:sc= -0.999 (180deg=-1.04) USER MOD Single : A 72 MET CE :methyl 148:sc= -0.0709 (180deg=-0.638) USER MOD Single : A 73 THR OG1 : rot 79:sc= 1.29 USER MOD Single : A 76 GLN : amide:sc= -2.76! C(o=-2.8!,f=-3.1!) USER MOD Single : A 83 HIS : no HD1:sc= -1.67 X(o=-1.7,f=-1.3) USER MOD Single : A 84 LYS NZ :NH3+ -167:sc= 0.362 (180deg=0.17) USER MOD Single : A 92 MET CE :methyl 142:sc= -1.85! (180deg=-4!) USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 96 THR OG1 : rot 77:sc= 1.22 USER MOD Single : A 100 THR OG1 : rot -85:sc= 0.665 USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN :FLIP amide:sc= -0.457 F(o=-1.8!,f=-0.46) USER MOD Single : A 105 LYS NZ :NH3+ 164:sc= -0.0196 (180deg=-0.257) USER MOD Single : A 107 ASN : amide:sc= -0.603 X(o=-0.6,f=-0.67) USER MOD Single : A 110 ASN : amide:sc=-0.00163 K(o=-0.0016,f=-0.87) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.00673 USER MOD Single : A 116 LYS NZ :NH3+ 165:sc= 0.433 (180deg=0.246) USER MOD Single : A 119 ASN : amide:sc= -0.861 K(o=-0.86,f=-3.8!) USER MOD Single : A 122 LYS NZ :NH3+ -128:sc= -0.109 (180deg=-1.08) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= -1.62! C(o=-1.6!,f=-6.3!) USER MOD Single : A 135 LYS NZ :NH3+ 178:sc= 0.755 (180deg=0.73) USER MOD Single : A 136 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0011) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= -0.175 K(o=-0.17,f=-0.68) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 24.277 3.629 -22.934 1.00 20.39 N ATOM 2 CA MET A 1 24.367 4.877 -22.140 1.00 19.96 C ATOM 3 C MET A 1 24.036 4.618 -20.672 1.00 19.35 C ATOM 4 O MET A 1 24.666 5.179 -19.777 1.00 19.23 O ATOM 5 CB MET A 1 23.408 5.932 -22.697 1.00 20.24 C ATOM 6 CG MET A 1 23.521 7.284 -22.012 1.00 20.56 C ATOM 7 SD MET A 1 22.347 8.491 -22.658 1.00 20.81 S ATOM 8 CE MET A 1 22.774 9.931 -21.682 1.00 20.97 C ATOM 0 H1 MET A 1 24.682 3.788 -23.878 1.00 20.39 H new ATOM 0 H2 MET A 1 24.805 2.873 -22.453 1.00 20.39 H new ATOM 0 H3 MET A 1 23.280 3.349 -23.028 1.00 20.39 H new ATOM 0 HA MET A 1 25.392 5.243 -22.210 1.00 19.96 H new ATOM 0 HB2 MET A 1 23.600 6.058 -23.763 1.00 20.24 H new ATOM 0 HB3 MET A 1 22.385 5.569 -22.598 1.00 20.24 H new ATOM 0 HG2 MET A 1 23.356 7.159 -20.942 1.00 20.56 H new ATOM 0 HG3 MET A 1 24.534 7.666 -22.136 1.00 20.56 H new ATOM 0 HE1 MET A 1 22.133 10.766 -21.965 1.00 20.97 H new ATOM 0 HE2 MET A 1 22.633 9.708 -20.624 1.00 20.97 H new ATOM 0 HE3 MET A 1 23.816 10.196 -21.862 1.00 20.97 H new ATOM 20 N TYR A 2 23.063 3.748 -20.428 1.00 19.08 N ATOM 21 CA TYR A 2 22.565 3.510 -19.076 1.00 18.61 C ATOM 22 C TYR A 2 23.331 2.383 -18.394 1.00 17.62 C ATOM 23 O TYR A 2 22.806 1.691 -17.521 1.00 17.34 O ATOM 24 CB TYR A 2 21.066 3.202 -19.117 1.00 19.12 C ATOM 25 CG TYR A 2 20.248 4.333 -19.700 1.00 19.80 C ATOM 26 CD1 TYR A 2 19.680 5.302 -18.884 1.00 19.93 C ATOM 27 CD2 TYR A 2 20.063 4.442 -21.074 1.00 20.43 C ATOM 28 CE1 TYR A 2 18.948 6.346 -19.419 1.00 20.67 C ATOM 29 CE2 TYR A 2 19.331 5.478 -21.615 1.00 21.16 C ATOM 30 CZ TYR A 2 18.777 6.427 -20.785 1.00 21.27 C ATOM 31 OH TYR A 2 18.058 7.470 -21.326 1.00 22.10 O ATOM 0 H TYR A 2 22.602 3.194 -21.150 1.00 19.08 H new ATOM 0 HA TYR A 2 22.723 4.415 -18.489 1.00 18.61 H new ATOM 0 HB2 TYR A 2 20.902 2.300 -19.707 1.00 19.12 H new ATOM 0 HB3 TYR A 2 20.716 2.991 -18.107 1.00 19.12 H new ATOM 0 HD1 TYR A 2 19.812 5.239 -17.814 1.00 19.93 H new ATOM 0 HD2 TYR A 2 20.500 3.703 -21.729 1.00 20.43 H new ATOM 0 HE1 TYR A 2 18.513 7.093 -18.771 1.00 20.67 H new ATOM 0 HE2 TYR A 2 19.193 5.545 -22.684 1.00 21.16 H new ATOM 0 HH TYR A 2 18.148 8.261 -20.754 1.00 22.10 H new ATOM 41 N SER A 3 24.578 2.206 -18.795 1.00 17.23 N ATOM 42 CA SER A 3 25.467 1.256 -18.152 1.00 16.40 C ATOM 43 C SER A 3 26.876 1.849 -18.053 1.00 15.74 C ATOM 44 O SER A 3 27.833 1.288 -18.583 1.00 15.62 O ATOM 45 CB SER A 3 25.484 -0.061 -18.940 1.00 16.48 C ATOM 46 OG SER A 3 26.260 -1.049 -18.282 1.00 16.86 O ATOM 0 H SER A 3 25.001 2.714 -19.572 1.00 17.23 H new ATOM 0 HA SER A 3 25.107 1.049 -17.144 1.00 16.40 H new ATOM 0 HB2 SER A 3 24.464 -0.423 -19.068 1.00 16.48 H new ATOM 0 HB3 SER A 3 25.887 0.115 -19.937 1.00 16.48 H new ATOM 0 HG SER A 3 27.190 -0.746 -18.219 1.00 16.86 H new ATOM 52 N PRO A 4 27.020 3.008 -17.381 1.00 15.46 N ATOM 53 CA PRO A 4 28.287 3.706 -17.274 1.00 15.00 C ATOM 54 C PRO A 4 29.036 3.365 -15.987 1.00 14.24 C ATOM 55 O PRO A 4 28.730 2.366 -15.330 1.00 13.43 O ATOM 56 CB PRO A 4 27.845 5.169 -17.268 1.00 15.20 C ATOM 57 CG PRO A 4 26.467 5.172 -16.673 1.00 15.47 C ATOM 58 CD PRO A 4 25.971 3.742 -16.662 1.00 15.76 C ATOM 0 HA PRO A 4 28.982 3.445 -18.072 1.00 15.00 H new ATOM 0 HB2 PRO A 4 28.527 5.782 -16.679 1.00 15.20 H new ATOM 0 HB3 PRO A 4 27.837 5.580 -18.277 1.00 15.20 H new ATOM 0 HG2 PRO A 4 26.487 5.578 -15.662 1.00 15.47 H new ATOM 0 HG3 PRO A 4 25.799 5.805 -17.257 1.00 15.47 H new ATOM 0 HD2 PRO A 4 25.845 3.369 -15.646 1.00 15.76 H new ATOM 0 HD3 PRO A 4 25.005 3.649 -17.158 1.00 15.76 H new ATOM 66 N THR A 5 29.995 4.203 -15.612 1.00 14.65 N ATOM 67 CA THR A 5 30.751 3.986 -14.388 1.00 14.22 C ATOM 68 C THR A 5 29.850 4.146 -13.161 1.00 13.17 C ATOM 69 O THR A 5 30.160 3.650 -12.077 1.00 12.56 O ATOM 70 CB THR A 5 31.940 4.959 -14.291 1.00 15.22 C ATOM 71 OG1 THR A 5 32.673 4.954 -15.524 1.00 15.79 O ATOM 72 CG2 THR A 5 32.865 4.563 -13.153 1.00 15.33 C ATOM 0 H THR A 5 30.266 5.035 -16.136 1.00 14.65 H new ATOM 0 HA THR A 5 31.137 2.967 -14.415 1.00 14.22 H new ATOM 0 HB THR A 5 31.552 5.959 -14.097 1.00 15.22 H new ATOM 0 HG1 THR A 5 33.428 5.576 -15.458 1.00 15.79 H new ATOM 0 HG21 THR A 5 33.699 5.263 -13.101 1.00 15.33 H new ATOM 0 HG22 THR A 5 32.315 4.584 -12.212 1.00 15.33 H new ATOM 0 HG23 THR A 5 33.246 3.557 -13.327 1.00 15.33 H new ATOM 80 N SER A 6 28.714 4.807 -13.358 1.00 13.06 N ATOM 81 CA SER A 6 27.739 5.029 -12.293 1.00 12.17 C ATOM 82 C SER A 6 27.287 3.709 -11.657 1.00 11.07 C ATOM 83 O SER A 6 26.813 3.691 -10.526 1.00 10.23 O ATOM 84 CB SER A 6 26.533 5.775 -12.860 1.00 12.55 C ATOM 85 OG SER A 6 26.951 6.872 -13.659 1.00 13.32 O ATOM 0 H SER A 6 28.443 5.204 -14.258 1.00 13.06 H new ATOM 0 HA SER A 6 28.213 5.625 -11.513 1.00 12.17 H new ATOM 0 HB2 SER A 6 25.926 5.094 -13.457 1.00 12.55 H new ATOM 0 HB3 SER A 6 25.904 6.132 -12.045 1.00 12.55 H new ATOM 0 HG SER A 6 26.165 7.336 -14.015 1.00 13.32 H new ATOM 91 N ILE A 7 27.459 2.605 -12.379 1.00 11.18 N ATOM 92 CA ILE A 7 27.043 1.296 -11.881 1.00 10.37 C ATOM 93 C ILE A 7 28.027 0.791 -10.824 1.00 9.98 C ATOM 94 O ILE A 7 27.674 0.013 -9.943 1.00 9.20 O ATOM 95 CB ILE A 7 26.933 0.263 -13.030 1.00 10.88 C ATOM 96 CG1 ILE A 7 26.025 0.794 -14.146 1.00 11.65 C ATOM 97 CG2 ILE A 7 26.408 -1.071 -12.512 1.00 10.56 C ATOM 98 CD1 ILE A 7 24.603 1.080 -13.703 1.00 12.15 C ATOM 0 H ILE A 7 27.882 2.590 -13.307 1.00 11.18 H new ATOM 0 HA ILE A 7 26.057 1.412 -11.430 1.00 10.37 H new ATOM 0 HB ILE A 7 27.931 0.104 -13.438 1.00 10.88 H new ATOM 0 HG12 ILE A 7 26.460 1.709 -14.549 1.00 11.65 H new ATOM 0 HG13 ILE A 7 26.002 0.067 -14.958 1.00 11.65 H new ATOM 0 HG21 ILE A 7 26.339 -1.780 -13.337 1.00 10.56 H new ATOM 0 HG22 ILE A 7 27.088 -1.460 -11.754 1.00 10.56 H new ATOM 0 HG23 ILE A 7 25.420 -0.928 -12.074 1.00 10.56 H new ATOM 0 HD11 ILE A 7 24.026 1.452 -14.550 1.00 12.15 H new ATOM 0 HD12 ILE A 7 24.148 0.164 -13.328 1.00 12.15 H new ATOM 0 HD13 ILE A 7 24.612 1.831 -12.913 1.00 12.15 H new ATOM 110 N LEU A 8 29.266 1.249 -10.922 1.00 10.74 N ATOM 111 CA LEU A 8 30.297 0.920 -9.950 1.00 10.77 C ATOM 112 C LEU A 8 30.206 1.861 -8.752 1.00 10.46 C ATOM 113 O LEU A 8 30.735 1.580 -7.676 1.00 10.30 O ATOM 114 CB LEU A 8 31.686 1.029 -10.594 1.00 11.94 C ATOM 115 CG LEU A 8 32.068 -0.073 -11.599 1.00 12.47 C ATOM 116 CD1 LEU A 8 31.064 -0.185 -12.740 1.00 12.44 C ATOM 117 CD2 LEU A 8 33.444 0.213 -12.161 1.00 13.09 C ATOM 0 H LEU A 8 29.584 1.858 -11.676 1.00 10.74 H new ATOM 0 HA LEU A 8 30.144 -0.104 -9.611 1.00 10.77 H new ATOM 0 HB2 LEU A 8 31.751 1.991 -11.102 1.00 11.94 H new ATOM 0 HB3 LEU A 8 32.431 1.038 -9.798 1.00 11.94 H new ATOM 0 HG LEU A 8 32.066 -1.023 -11.065 1.00 12.47 H new ATOM 0 HD11 LEU A 8 31.376 -0.975 -13.423 1.00 12.44 H new ATOM 0 HD12 LEU A 8 30.080 -0.422 -12.336 1.00 12.44 H new ATOM 0 HD13 LEU A 8 31.017 0.762 -13.278 1.00 12.44 H new ATOM 0 HD21 LEU A 8 33.716 -0.567 -12.873 1.00 13.09 H new ATOM 0 HD22 LEU A 8 33.437 1.179 -12.666 1.00 13.09 H new ATOM 0 HD23 LEU A 8 34.172 0.233 -11.350 1.00 13.09 H new ATOM 129 N ASP A 9 29.535 2.983 -8.963 1.00 10.57 N ATOM 130 CA ASP A 9 29.414 4.032 -7.955 1.00 10.51 C ATOM 131 C ASP A 9 28.166 3.852 -7.090 1.00 9.48 C ATOM 132 O ASP A 9 28.225 3.954 -5.863 1.00 9.50 O ATOM 133 CB ASP A 9 29.376 5.395 -8.650 1.00 11.48 C ATOM 134 CG ASP A 9 28.838 6.501 -7.767 1.00 12.16 C ATOM 135 OD1 ASP A 9 27.611 6.735 -7.779 1.00 12.46 O ATOM 136 OD2 ASP A 9 29.639 7.122 -7.035 1.00 12.54 O ATOM 0 H ASP A 9 29.057 3.195 -9.839 1.00 10.57 H new ATOM 0 HA ASP A 9 30.279 3.970 -7.295 1.00 10.51 H new ATOM 0 HB2 ASP A 9 30.382 5.657 -8.977 1.00 11.48 H new ATOM 0 HB3 ASP A 9 28.759 5.322 -9.546 1.00 11.48 H new ATOM 141 N ILE A 10 27.060 3.534 -7.779 1.00 8.74 N ATOM 142 CA ILE A 10 25.719 3.306 -7.212 1.00 7.86 C ATOM 143 C ILE A 10 25.359 4.142 -5.983 1.00 7.43 C ATOM 144 O ILE A 10 24.553 3.687 -5.174 1.00 6.73 O ATOM 145 CB ILE A 10 25.454 1.818 -6.857 1.00 7.25 C ATOM 146 CG1 ILE A 10 26.576 1.234 -5.985 1.00 7.42 C ATOM 147 CG2 ILE A 10 25.241 0.984 -8.114 1.00 7.55 C ATOM 148 CD1 ILE A 10 27.735 0.640 -6.762 1.00 7.84 C ATOM 0 H ILE A 10 27.075 3.423 -8.793 1.00 8.74 H new ATOM 0 HA ILE A 10 25.080 3.632 -8.033 1.00 7.86 H new ATOM 0 HB ILE A 10 24.536 1.781 -6.271 1.00 7.25 H new ATOM 0 HG12 ILE A 10 26.958 2.020 -5.333 1.00 7.42 H new ATOM 0 HG13 ILE A 10 26.154 0.462 -5.341 1.00 7.42 H new ATOM 0 HG21 ILE A 10 25.058 -0.054 -7.835 1.00 7.55 H new ATOM 0 HG22 ILE A 10 24.383 1.369 -8.665 1.00 7.55 H new ATOM 0 HG23 ILE A 10 26.130 1.039 -8.742 1.00 7.55 H new ATOM 0 HD11 ILE A 10 28.479 0.252 -6.066 1.00 7.84 H new ATOM 0 HD12 ILE A 10 27.372 -0.171 -7.394 1.00 7.84 H new ATOM 0 HD13 ILE A 10 28.188 1.411 -7.385 1.00 7.84 H new ATOM 160 N ARG A 11 25.905 5.345 -5.831 1.00 8.07 N ATOM 161 CA ARG A 11 25.585 6.149 -4.657 1.00 7.96 C ATOM 162 C ARG A 11 24.158 6.682 -4.751 1.00 7.79 C ATOM 163 O ARG A 11 23.727 7.188 -5.794 1.00 8.29 O ATOM 164 CB ARG A 11 26.620 7.274 -4.431 1.00 9.08 C ATOM 165 CG ARG A 11 26.623 8.395 -5.464 1.00 9.98 C ATOM 166 CD ARG A 11 25.588 9.462 -5.148 1.00 10.66 C ATOM 167 NE ARG A 11 25.549 10.507 -6.166 1.00 11.50 N ATOM 168 CZ ARG A 11 24.480 10.783 -6.914 1.00 12.34 C ATOM 169 NH1 ARG A 11 23.373 10.054 -6.802 1.00 12.46 N ATOM 170 NH2 ARG A 11 24.522 11.781 -7.786 1.00 13.19 N ATOM 0 H ARG A 11 26.555 5.776 -6.488 1.00 8.07 H new ATOM 0 HA ARG A 11 25.641 5.507 -3.778 1.00 7.96 H new ATOM 0 HB2 ARG A 11 26.443 7.712 -3.449 1.00 9.08 H new ATOM 0 HB3 ARG A 11 27.614 6.827 -4.406 1.00 9.08 H new ATOM 0 HG2 ARG A 11 27.613 8.850 -5.503 1.00 9.98 H new ATOM 0 HG3 ARG A 11 26.425 7.979 -6.452 1.00 9.98 H new ATOM 0 HD2 ARG A 11 24.604 8.999 -5.066 1.00 10.66 H new ATOM 0 HD3 ARG A 11 25.812 9.908 -4.179 1.00 10.66 H new ATOM 0 HE ARG A 11 26.392 11.061 -6.315 1.00 11.50 H new ATOM 0 HH11 ARG A 11 23.338 9.278 -6.141 1.00 12.46 H new ATOM 0 HH12 ARG A 11 22.559 10.271 -7.377 1.00 12.46 H new ATOM 0 HH21 ARG A 11 25.372 12.337 -7.884 1.00 13.19 H new ATOM 0 HH22 ARG A 11 23.705 11.993 -8.359 1.00 13.19 H new ATOM 184 N GLN A 12 23.432 6.533 -3.654 1.00 7.29 N ATOM 185 CA GLN A 12 22.026 6.901 -3.577 1.00 7.16 C ATOM 186 C GLN A 12 21.824 8.398 -3.768 1.00 7.82 C ATOM 187 O GLN A 12 22.483 9.214 -3.123 1.00 8.10 O ATOM 188 CB GLN A 12 21.462 6.471 -2.222 1.00 6.33 C ATOM 189 CG GLN A 12 20.070 7.013 -1.925 1.00 6.44 C ATOM 190 CD GLN A 12 19.631 6.735 -0.501 1.00 6.33 C ATOM 191 OE1 GLN A 12 20.455 6.612 0.403 1.00 6.37 O ATOM 192 NE2 GLN A 12 18.330 6.663 -0.282 1.00 6.60 N ATOM 0 H GLN A 12 23.805 6.150 -2.785 1.00 7.29 H new ATOM 0 HA GLN A 12 21.498 6.390 -4.382 1.00 7.16 H new ATOM 0 HB2 GLN A 12 21.432 5.382 -2.183 1.00 6.33 H new ATOM 0 HB3 GLN A 12 22.143 6.800 -1.437 1.00 6.33 H new ATOM 0 HG2 GLN A 12 20.057 8.088 -2.103 1.00 6.44 H new ATOM 0 HG3 GLN A 12 19.355 6.567 -2.616 1.00 6.44 H new ATOM 0 HE21 GLN A 12 17.676 6.770 -1.057 1.00 6.60 H new ATOM 0 HE22 GLN A 12 17.980 6.501 0.662 1.00 6.60 H new ATOM 201 N GLY A 13 20.920 8.751 -4.672 1.00 8.30 N ATOM 202 CA GLY A 13 20.524 10.133 -4.819 1.00 9.01 C ATOM 203 C GLY A 13 19.450 10.490 -3.814 1.00 8.63 C ATOM 204 O GLY A 13 18.711 9.611 -3.379 1.00 7.84 O ATOM 0 H GLY A 13 20.454 8.102 -5.306 1.00 8.30 H new ATOM 0 HA2 GLY A 13 21.389 10.781 -4.680 1.00 9.01 H new ATOM 0 HA3 GLY A 13 20.155 10.306 -5.830 1.00 9.01 H new ATOM 208 N PRO A 14 19.327 11.770 -3.432 1.00 9.33 N ATOM 209 CA PRO A 14 18.388 12.202 -2.382 1.00 9.17 C ATOM 210 C PRO A 14 16.933 11.819 -2.665 1.00 8.90 C ATOM 211 O PRO A 14 16.122 11.720 -1.747 1.00 8.50 O ATOM 212 CB PRO A 14 18.536 13.725 -2.368 1.00 10.25 C ATOM 213 CG PRO A 14 19.879 13.985 -2.957 1.00 10.91 C ATOM 214 CD PRO A 14 20.099 12.900 -3.975 1.00 10.46 C ATOM 0 HA PRO A 14 18.619 11.719 -1.433 1.00 9.17 H new ATOM 0 HB2 PRO A 14 17.749 14.204 -2.951 1.00 10.25 H new ATOM 0 HB3 PRO A 14 18.466 14.119 -1.354 1.00 10.25 H new ATOM 0 HG2 PRO A 14 19.918 14.970 -3.422 1.00 10.91 H new ATOM 0 HG3 PRO A 14 20.653 13.964 -2.190 1.00 10.91 H new ATOM 0 HD2 PRO A 14 19.742 13.195 -4.962 1.00 10.46 H new ATOM 0 HD3 PRO A 14 21.156 12.653 -4.079 1.00 10.46 H new ATOM 222 N LYS A 15 16.602 11.603 -3.932 1.00 9.36 N ATOM 223 CA LYS A 15 15.235 11.266 -4.313 1.00 9.53 C ATOM 224 C LYS A 15 15.034 9.752 -4.338 1.00 9.20 C ATOM 225 O LYS A 15 13.904 9.266 -4.399 1.00 9.66 O ATOM 226 CB LYS A 15 14.921 11.833 -5.698 1.00 10.67 C ATOM 227 CG LYS A 15 15.510 11.005 -6.830 1.00 11.41 C ATOM 228 CD LYS A 15 15.194 11.600 -8.186 1.00 12.05 C ATOM 229 CE LYS A 15 15.314 10.561 -9.293 1.00 12.96 C ATOM 230 NZ LYS A 15 16.669 9.955 -9.361 1.00 13.55 N ATOM 0 H LYS A 15 17.258 11.655 -4.711 1.00 9.36 H new ATOM 0 HA LYS A 15 14.563 11.702 -3.573 1.00 9.53 H new ATOM 0 HB2 LYS A 15 13.840 11.892 -5.823 1.00 10.67 H new ATOM 0 HB3 LYS A 15 15.305 12.851 -5.763 1.00 10.67 H new ATOM 0 HG2 LYS A 15 16.591 10.937 -6.706 1.00 11.41 H new ATOM 0 HG3 LYS A 15 15.119 9.989 -6.779 1.00 11.41 H new ATOM 0 HD2 LYS A 15 14.184 12.010 -8.178 1.00 12.05 H new ATOM 0 HD3 LYS A 15 15.873 12.429 -8.388 1.00 12.05 H new ATOM 0 HE2 LYS A 15 14.576 9.775 -9.131 1.00 12.96 H new ATOM 0 HE3 LYS A 15 15.079 11.026 -10.250 1.00 12.96 H new ATOM 0 HZ1 LYS A 15 16.857 9.634 -10.332 1.00 13.55 H new ATOM 0 HZ2 LYS A 15 17.380 10.663 -9.086 1.00 13.55 H new ATOM 0 HZ3 LYS A 15 16.719 9.144 -8.712 1.00 13.55 H new ATOM 244 N GLU A 16 16.134 9.018 -4.278 1.00 8.57 N ATOM 245 CA GLU A 16 16.106 7.585 -4.521 1.00 8.39 C ATOM 246 C GLU A 16 15.838 6.817 -3.237 1.00 7.72 C ATOM 247 O GLU A 16 16.460 7.079 -2.208 1.00 6.94 O ATOM 248 CB GLU A 16 17.440 7.124 -5.109 1.00 8.10 C ATOM 249 CG GLU A 16 17.296 6.059 -6.179 1.00 8.26 C ATOM 250 CD GLU A 16 16.753 6.627 -7.474 1.00 9.36 C ATOM 251 OE1 GLU A 16 17.204 7.711 -7.891 1.00 9.85 O ATOM 252 OE2 GLU A 16 15.873 5.985 -8.089 1.00 9.91 O ATOM 0 H GLU A 16 17.058 9.392 -4.063 1.00 8.57 H new ATOM 0 HA GLU A 16 15.301 7.384 -5.227 1.00 8.39 H new ATOM 0 HB2 GLU A 16 17.958 7.985 -5.532 1.00 8.10 H new ATOM 0 HB3 GLU A 16 18.068 6.738 -4.306 1.00 8.10 H new ATOM 0 HG2 GLU A 16 18.266 5.597 -6.364 1.00 8.26 H new ATOM 0 HG3 GLU A 16 16.632 5.273 -5.821 1.00 8.26 H new ATOM 259 N PRO A 17 14.890 5.871 -3.269 1.00 8.28 N ATOM 260 CA PRO A 17 14.677 4.955 -2.157 1.00 8.07 C ATOM 261 C PRO A 17 15.898 4.066 -1.933 1.00 7.31 C ATOM 262 O PRO A 17 16.401 3.449 -2.874 1.00 7.39 O ATOM 263 CB PRO A 17 13.458 4.125 -2.574 1.00 9.21 C ATOM 264 CG PRO A 17 13.321 4.317 -4.048 1.00 9.95 C ATOM 265 CD PRO A 17 13.949 5.642 -4.378 1.00 9.45 C ATOM 0 HA PRO A 17 14.517 5.479 -1.215 1.00 8.07 H new ATOM 0 HB2 PRO A 17 13.599 3.072 -2.328 1.00 9.21 H new ATOM 0 HB3 PRO A 17 12.561 4.457 -2.051 1.00 9.21 H new ATOM 0 HG2 PRO A 17 13.815 3.510 -4.590 1.00 9.95 H new ATOM 0 HG3 PRO A 17 12.272 4.303 -4.343 1.00 9.95 H new ATOM 0 HD2 PRO A 17 14.463 5.613 -5.339 1.00 9.45 H new ATOM 0 HD3 PRO A 17 13.203 6.434 -4.439 1.00 9.45 H new ATOM 273 N PHE A 18 16.366 4.029 -0.689 1.00 6.75 N ATOM 274 CA PHE A 18 17.620 3.361 -0.324 1.00 6.11 C ATOM 275 C PHE A 18 17.778 1.998 -0.992 1.00 6.56 C ATOM 276 O PHE A 18 18.694 1.795 -1.788 1.00 6.14 O ATOM 277 CB PHE A 18 17.690 3.205 1.197 1.00 6.14 C ATOM 278 CG PHE A 18 18.990 2.648 1.708 1.00 5.98 C ATOM 279 CD1 PHE A 18 19.058 1.358 2.209 1.00 6.36 C ATOM 280 CD2 PHE A 18 20.149 3.409 1.672 1.00 5.83 C ATOM 281 CE1 PHE A 18 20.253 0.838 2.667 1.00 6.55 C ATOM 282 CE2 PHE A 18 21.347 2.895 2.130 1.00 6.04 C ATOM 283 CZ PHE A 18 21.390 1.629 2.674 1.00 6.38 C ATOM 0 H PHE A 18 15.887 4.462 0.101 1.00 6.75 H new ATOM 0 HA PHE A 18 18.438 3.987 -0.680 1.00 6.11 H new ATOM 0 HB2 PHE A 18 17.520 4.178 1.657 1.00 6.14 H new ATOM 0 HB3 PHE A 18 16.878 2.554 1.520 1.00 6.14 H new ATOM 0 HD1 PHE A 18 18.165 0.751 2.242 1.00 6.36 H new ATOM 0 HD2 PHE A 18 20.115 4.415 1.281 1.00 5.83 H new ATOM 0 HE1 PHE A 18 20.301 -0.182 3.019 1.00 6.55 H new ATOM 0 HE2 PHE A 18 22.249 3.485 2.062 1.00 6.04 H new ATOM 0 HZ PHE A 18 22.307 1.255 3.104 1.00 6.38 H new ATOM 293 N ARG A 19 16.860 1.084 -0.700 1.00 7.57 N ATOM 294 CA ARG A 19 16.973 -0.295 -1.154 1.00 8.30 C ATOM 295 C ARG A 19 16.905 -0.404 -2.679 1.00 8.53 C ATOM 296 O ARG A 19 17.321 -1.409 -3.250 1.00 8.98 O ATOM 297 CB ARG A 19 15.865 -1.131 -0.515 1.00 9.53 C ATOM 298 CG ARG A 19 15.984 -2.623 -0.761 1.00 10.28 C ATOM 299 CD ARG A 19 17.228 -3.201 -0.108 1.00 11.35 C ATOM 300 NE ARG A 19 17.349 -4.640 -0.335 1.00 12.03 N ATOM 301 CZ ARG A 19 17.736 -5.514 0.592 1.00 13.02 C ATOM 302 NH1 ARG A 19 18.009 -5.107 1.827 1.00 13.43 N ATOM 303 NH2 ARG A 19 17.845 -6.800 0.282 1.00 13.72 N ATOM 0 H ARG A 19 16.024 1.276 -0.147 1.00 7.57 H new ATOM 0 HA ARG A 19 17.948 -0.673 -0.847 1.00 8.30 H new ATOM 0 HB2 ARG A 19 15.865 -0.951 0.560 1.00 9.53 H new ATOM 0 HB3 ARG A 19 14.903 -0.788 -0.895 1.00 9.53 H new ATOM 0 HG2 ARG A 19 15.100 -3.128 -0.371 1.00 10.28 H new ATOM 0 HG3 ARG A 19 16.013 -2.814 -1.834 1.00 10.28 H new ATOM 0 HD2 ARG A 19 18.111 -2.697 -0.501 1.00 11.35 H new ATOM 0 HD3 ARG A 19 17.199 -3.004 0.964 1.00 11.35 H new ATOM 0 HE ARG A 19 17.122 -4.998 -1.263 1.00 12.03 H new ATOM 0 HH11 ARG A 19 17.923 -4.120 2.070 1.00 13.43 H new ATOM 0 HH12 ARG A 19 18.305 -5.782 2.533 1.00 13.43 H new ATOM 0 HH21 ARG A 19 17.633 -7.116 -0.664 1.00 13.72 H new ATOM 0 HH22 ARG A 19 18.141 -7.472 0.990 1.00 13.72 H new ATOM 317 N ASP A 20 16.406 0.634 -3.338 1.00 8.44 N ATOM 318 CA ASP A 20 16.261 0.608 -4.787 1.00 9.01 C ATOM 319 C ASP A 20 17.604 0.854 -5.456 1.00 8.27 C ATOM 320 O ASP A 20 17.929 0.231 -6.464 1.00 8.68 O ATOM 321 CB ASP A 20 15.249 1.654 -5.253 1.00 9.59 C ATOM 322 CG ASP A 20 14.843 1.467 -6.703 1.00 10.55 C ATOM 323 OD1 ASP A 20 13.962 0.631 -6.985 1.00 11.24 O ATOM 324 OD2 ASP A 20 15.418 2.155 -7.573 1.00 10.78 O ATOM 0 H ASP A 20 16.097 1.499 -2.895 1.00 8.44 H new ATOM 0 HA ASP A 20 15.895 -0.378 -5.072 1.00 9.01 H new ATOM 0 HB2 ASP A 20 14.362 1.603 -4.622 1.00 9.59 H new ATOM 0 HB3 ASP A 20 15.675 2.649 -5.124 1.00 9.59 H new ATOM 329 N TYR A 21 18.396 1.757 -4.892 1.00 7.30 N ATOM 330 CA TYR A 21 19.726 2.003 -5.425 1.00 6.73 C ATOM 331 C TYR A 21 20.678 0.918 -4.938 1.00 6.19 C ATOM 332 O TYR A 21 21.600 0.515 -5.648 1.00 6.24 O ATOM 333 CB TYR A 21 20.249 3.394 -5.048 1.00 6.06 C ATOM 334 CG TYR A 21 20.960 4.077 -6.199 1.00 5.92 C ATOM 335 CD1 TYR A 21 20.758 5.422 -6.475 1.00 6.01 C ATOM 336 CD2 TYR A 21 21.813 3.362 -7.031 1.00 6.13 C ATOM 337 CE1 TYR A 21 21.382 6.033 -7.548 1.00 6.36 C ATOM 338 CE2 TYR A 21 22.444 3.967 -8.099 1.00 6.47 C ATOM 339 CZ TYR A 21 22.225 5.300 -8.355 1.00 6.60 C ATOM 340 OH TYR A 21 22.841 5.898 -9.430 1.00 7.29 O ATOM 0 H TYR A 21 18.145 2.321 -4.080 1.00 7.30 H new ATOM 0 HA TYR A 21 19.666 1.973 -6.513 1.00 6.73 H new ATOM 0 HB2 TYR A 21 19.416 4.015 -4.719 1.00 6.06 H new ATOM 0 HB3 TYR A 21 20.933 3.305 -4.204 1.00 6.06 H new ATOM 0 HD1 TYR A 21 20.103 6.001 -5.842 1.00 6.01 H new ATOM 0 HD2 TYR A 21 21.985 2.313 -6.838 1.00 6.13 H new ATOM 0 HE1 TYR A 21 21.209 7.079 -7.752 1.00 6.36 H new ATOM 0 HE2 TYR A 21 23.107 3.395 -8.731 1.00 6.47 H new ATOM 0 HH TYR A 21 23.402 5.241 -9.893 1.00 7.29 H new ATOM 350 N VAL A 22 20.426 0.424 -3.735 1.00 5.96 N ATOM 351 CA VAL A 22 21.189 -0.698 -3.193 1.00 5.81 C ATOM 352 C VAL A 22 20.933 -1.957 -4.022 1.00 6.77 C ATOM 353 O VAL A 22 21.782 -2.843 -4.108 1.00 6.77 O ATOM 354 CB VAL A 22 20.831 -0.962 -1.710 1.00 5.93 C ATOM 355 CG1 VAL A 22 21.569 -2.180 -1.168 1.00 6.61 C ATOM 356 CG2 VAL A 22 21.143 0.262 -0.864 1.00 5.41 C ATOM 0 H VAL A 22 19.700 0.780 -3.113 1.00 5.96 H new ATOM 0 HA VAL A 22 22.246 -0.438 -3.244 1.00 5.81 H new ATOM 0 HB VAL A 22 19.762 -1.167 -1.657 1.00 5.93 H new ATOM 0 HG11 VAL A 22 21.295 -2.337 -0.125 1.00 6.61 H new ATOM 0 HG12 VAL A 22 21.297 -3.060 -1.751 1.00 6.61 H new ATOM 0 HG13 VAL A 22 22.644 -2.016 -1.240 1.00 6.61 H new ATOM 0 HG21 VAL A 22 20.886 0.061 0.176 1.00 5.41 H new ATOM 0 HG22 VAL A 22 22.206 0.493 -0.937 1.00 5.41 H new ATOM 0 HG23 VAL A 22 20.561 1.111 -1.224 1.00 5.41 H new ATOM 366 N ASP A 23 19.769 -2.011 -4.660 1.00 7.71 N ATOM 367 CA ASP A 23 19.391 -3.149 -5.492 1.00 8.82 C ATOM 368 C ASP A 23 20.388 -3.375 -6.625 1.00 8.87 C ATOM 369 O ASP A 23 20.752 -4.512 -6.920 1.00 9.30 O ATOM 370 CB ASP A 23 17.987 -2.957 -6.070 1.00 9.88 C ATOM 371 CG ASP A 23 17.607 -4.059 -7.041 1.00 11.09 C ATOM 372 OD1 ASP A 23 17.592 -3.805 -8.264 1.00 11.57 O ATOM 373 OD2 ASP A 23 17.321 -5.183 -6.585 1.00 11.68 O ATOM 0 H ASP A 23 19.065 -1.274 -4.616 1.00 7.71 H new ATOM 0 HA ASP A 23 19.397 -4.031 -4.851 1.00 8.82 H new ATOM 0 HB2 ASP A 23 17.263 -2.928 -5.256 1.00 9.88 H new ATOM 0 HB3 ASP A 23 17.935 -1.994 -6.578 1.00 9.88 H new ATOM 378 N ARG A 24 20.866 -2.296 -7.237 1.00 8.57 N ATOM 379 CA ARG A 24 21.786 -2.438 -8.355 1.00 8.91 C ATOM 380 C ARG A 24 23.207 -2.600 -7.846 1.00 8.10 C ATOM 381 O ARG A 24 24.077 -3.085 -8.560 1.00 8.53 O ATOM 382 CB ARG A 24 21.684 -1.293 -9.373 1.00 9.20 C ATOM 383 CG ARG A 24 21.781 0.102 -8.787 1.00 9.35 C ATOM 384 CD ARG A 24 20.405 0.709 -8.582 1.00 9.42 C ATOM 385 NE ARG A 24 19.662 0.838 -9.833 1.00 10.13 N ATOM 386 CZ ARG A 24 18.465 1.412 -9.930 1.00 10.62 C ATOM 387 NH1 ARG A 24 17.845 1.854 -8.844 1.00 10.53 N ATOM 388 NH2 ARG A 24 17.874 1.519 -11.113 1.00 11.36 N ATOM 0 H ARG A 24 20.637 -1.335 -6.984 1.00 8.57 H new ATOM 0 HA ARG A 24 21.496 -3.340 -8.895 1.00 8.91 H new ATOM 0 HB2 ARG A 24 22.475 -1.415 -10.113 1.00 9.20 H new ATOM 0 HB3 ARG A 24 20.735 -1.382 -9.902 1.00 9.20 H new ATOM 0 HG2 ARG A 24 22.310 0.063 -7.835 1.00 9.35 H new ATOM 0 HG3 ARG A 24 22.367 0.738 -9.451 1.00 9.35 H new ATOM 0 HD2 ARG A 24 19.837 0.090 -7.888 1.00 9.42 H new ATOM 0 HD3 ARG A 24 20.509 1.691 -8.121 1.00 9.42 H new ATOM 0 HE ARG A 24 20.086 0.466 -10.683 1.00 10.13 H new ATOM 0 HH11 ARG A 24 18.285 1.755 -7.929 1.00 10.53 H new ATOM 0 HH12 ARG A 24 16.928 2.293 -8.924 1.00 10.53 H new ATOM 0 HH21 ARG A 24 18.337 1.161 -11.949 1.00 11.36 H new ATOM 0 HH22 ARG A 24 16.957 1.959 -11.187 1.00 11.36 H new ATOM 402 N PHE A 25 23.449 -2.206 -6.604 1.00 7.02 N ATOM 403 CA PHE A 25 24.701 -2.543 -5.962 1.00 6.32 C ATOM 404 C PHE A 25 24.729 -4.037 -5.702 1.00 6.59 C ATOM 405 O PHE A 25 25.766 -4.691 -5.804 1.00 6.62 O ATOM 406 CB PHE A 25 24.865 -1.793 -4.644 1.00 5.33 C ATOM 407 CG PHE A 25 26.150 -2.149 -3.949 1.00 4.98 C ATOM 408 CD1 PHE A 25 27.364 -1.673 -4.414 1.00 4.85 C ATOM 409 CD2 PHE A 25 26.141 -2.994 -2.852 1.00 5.26 C ATOM 410 CE1 PHE A 25 28.546 -2.035 -3.797 1.00 4.99 C ATOM 411 CE2 PHE A 25 27.318 -3.354 -2.231 1.00 5.43 C ATOM 412 CZ PHE A 25 28.523 -2.877 -2.702 1.00 5.29 C ATOM 0 H PHE A 25 22.803 -1.661 -6.032 1.00 7.02 H new ATOM 0 HA PHE A 25 25.522 -2.254 -6.619 1.00 6.32 H new ATOM 0 HB2 PHE A 25 24.840 -0.720 -4.832 1.00 5.33 H new ATOM 0 HB3 PHE A 25 24.024 -2.022 -3.990 1.00 5.33 H new ATOM 0 HD1 PHE A 25 27.387 -1.012 -5.268 1.00 4.85 H new ATOM 0 HD2 PHE A 25 25.202 -3.375 -2.479 1.00 5.26 H new ATOM 0 HE1 PHE A 25 29.487 -1.660 -4.171 1.00 4.99 H new ATOM 0 HE2 PHE A 25 27.296 -4.011 -1.374 1.00 5.43 H new ATOM 0 HZ PHE A 25 29.445 -3.161 -2.217 1.00 5.29 H new ATOM 422 N TYR A 26 23.561 -4.578 -5.416 1.00 7.06 N ATOM 423 CA TYR A 26 23.430 -5.976 -5.057 1.00 7.60 C ATOM 424 C TYR A 26 23.619 -6.834 -6.296 1.00 8.54 C ATOM 425 O TYR A 26 24.078 -7.972 -6.221 1.00 8.87 O ATOM 426 CB TYR A 26 22.059 -6.229 -4.425 1.00 8.10 C ATOM 427 CG TYR A 26 21.866 -7.636 -3.904 1.00 8.84 C ATOM 428 CD1 TYR A 26 21.160 -8.579 -4.638 1.00 9.57 C ATOM 429 CD2 TYR A 26 22.401 -8.022 -2.680 1.00 9.04 C ATOM 430 CE1 TYR A 26 20.989 -9.866 -4.168 1.00 10.37 C ATOM 431 CE2 TYR A 26 22.234 -9.306 -2.203 1.00 9.88 C ATOM 432 CZ TYR A 26 21.500 -10.217 -2.941 1.00 10.50 C ATOM 433 OH TYR A 26 21.362 -11.507 -2.479 1.00 11.44 O ATOM 0 H TYR A 26 22.680 -4.064 -5.426 1.00 7.06 H new ATOM 0 HA TYR A 26 24.195 -6.239 -4.326 1.00 7.60 H new ATOM 0 HB2 TYR A 26 21.915 -5.527 -3.604 1.00 8.10 H new ATOM 0 HB3 TYR A 26 21.286 -6.018 -5.164 1.00 8.10 H new ATOM 0 HD1 TYR A 26 20.737 -8.302 -5.592 1.00 9.57 H new ATOM 0 HD2 TYR A 26 22.956 -7.305 -2.093 1.00 9.04 H new ATOM 0 HE1 TYR A 26 20.456 -10.594 -4.762 1.00 10.37 H new ATOM 0 HE2 TYR A 26 22.673 -9.598 -1.260 1.00 9.88 H new ATOM 0 HH TYR A 26 21.781 -11.585 -1.596 1.00 11.44 H new ATOM 443 N LYS A 27 23.285 -6.263 -7.444 1.00 9.08 N ATOM 444 CA LYS A 27 23.412 -6.971 -8.699 1.00 10.12 C ATOM 445 C LYS A 27 24.875 -7.048 -9.114 1.00 10.01 C ATOM 446 O LYS A 27 25.273 -7.944 -9.858 1.00 10.69 O ATOM 447 CB LYS A 27 22.565 -6.287 -9.773 1.00 10.87 C ATOM 448 CG LYS A 27 23.274 -5.159 -10.501 1.00 11.19 C ATOM 449 CD LYS A 27 22.345 -4.427 -11.453 1.00 12.15 C ATOM 450 CE LYS A 27 21.850 -5.331 -12.568 1.00 12.87 C ATOM 451 NZ LYS A 27 21.046 -4.581 -13.566 1.00 13.47 N ATOM 0 H LYS A 27 22.925 -5.312 -7.527 1.00 9.08 H new ATOM 0 HA LYS A 27 23.045 -7.990 -8.576 1.00 10.12 H new ATOM 0 HB2 LYS A 27 22.251 -7.034 -10.502 1.00 10.87 H new ATOM 0 HB3 LYS A 27 21.660 -5.893 -9.310 1.00 10.87 H new ATOM 0 HG2 LYS A 27 23.677 -4.454 -9.774 1.00 11.19 H new ATOM 0 HG3 LYS A 27 24.120 -5.562 -11.058 1.00 11.19 H new ATOM 0 HD2 LYS A 27 21.493 -4.035 -10.898 1.00 12.15 H new ATOM 0 HD3 LYS A 27 22.866 -3.572 -11.883 1.00 12.15 H new ATOM 0 HE2 LYS A 27 22.701 -5.798 -13.063 1.00 12.87 H new ATOM 0 HE3 LYS A 27 21.247 -6.135 -12.145 1.00 12.87 H new ATOM 0 HZ1 LYS A 27 20.725 -5.231 -14.312 1.00 13.47 H new ATOM 0 HZ2 LYS A 27 20.220 -4.156 -13.098 1.00 13.47 H new ATOM 0 HZ3 LYS A 27 21.629 -3.830 -13.988 1.00 13.47 H new ATOM 465 N THR A 28 25.678 -6.117 -8.622 1.00 9.28 N ATOM 466 CA THR A 28 27.105 -6.168 -8.856 1.00 9.35 C ATOM 467 C THR A 28 27.750 -7.075 -7.819 1.00 8.90 C ATOM 468 O THR A 28 28.666 -7.834 -8.122 1.00 9.29 O ATOM 469 CB THR A 28 27.749 -4.764 -8.803 1.00 9.07 C ATOM 470 OG1 THR A 28 27.755 -4.244 -7.465 1.00 9.27 O ATOM 471 CG2 THR A 28 26.998 -3.803 -9.707 1.00 8.30 C ATOM 0 H THR A 28 25.365 -5.324 -8.062 1.00 9.28 H new ATOM 0 HA THR A 28 27.271 -6.564 -9.858 1.00 9.35 H new ATOM 0 HB THR A 28 28.779 -4.863 -9.146 1.00 9.07 H new ATOM 0 HG1 THR A 28 26.940 -4.528 -7.000 1.00 9.27 H new ATOM 0 HG21 THR A 28 27.464 -2.819 -9.659 1.00 8.30 H new ATOM 0 HG22 THR A 28 27.029 -4.169 -10.733 1.00 8.30 H new ATOM 0 HG23 THR A 28 25.961 -3.730 -9.379 1.00 8.30 H new ATOM 479 N LEU A 29 27.205 -7.032 -6.608 1.00 8.24 N ATOM 480 CA LEU A 29 27.740 -7.789 -5.487 1.00 8.03 C ATOM 481 C LEU A 29 27.544 -9.280 -5.718 1.00 8.87 C ATOM 482 O LEU A 29 28.376 -10.097 -5.334 1.00 9.09 O ATOM 483 CB LEU A 29 27.050 -7.361 -4.189 1.00 7.48 C ATOM 484 CG LEU A 29 27.568 -8.031 -2.914 1.00 7.10 C ATOM 485 CD1 LEU A 29 29.014 -7.637 -2.650 1.00 6.93 C ATOM 486 CD2 LEU A 29 26.690 -7.664 -1.729 1.00 6.99 C ATOM 0 H LEU A 29 26.383 -6.473 -6.378 1.00 8.24 H new ATOM 0 HA LEU A 29 28.808 -7.586 -5.403 1.00 8.03 H new ATOM 0 HB2 LEU A 29 27.157 -6.282 -4.080 1.00 7.48 H new ATOM 0 HB3 LEU A 29 25.984 -7.568 -4.280 1.00 7.48 H new ATOM 0 HG LEU A 29 27.529 -9.111 -3.052 1.00 7.10 H new ATOM 0 HD11 LEU A 29 29.363 -8.124 -1.739 1.00 6.93 H new ATOM 0 HD12 LEU A 29 29.635 -7.949 -3.489 1.00 6.93 H new ATOM 0 HD13 LEU A 29 29.081 -6.555 -2.532 1.00 6.93 H new ATOM 0 HD21 LEU A 29 27.071 -8.148 -0.830 1.00 6.99 H new ATOM 0 HD22 LEU A 29 26.699 -6.583 -1.591 1.00 6.99 H new ATOM 0 HD23 LEU A 29 25.669 -7.997 -1.915 1.00 6.99 H new ATOM 498 N ARG A 30 26.440 -9.618 -6.369 1.00 9.50 N ATOM 499 CA ARG A 30 26.112 -11.012 -6.640 1.00 10.45 C ATOM 500 C ARG A 30 27.018 -11.576 -7.722 1.00 10.98 C ATOM 501 O ARG A 30 27.258 -12.780 -7.784 1.00 11.61 O ATOM 502 CB ARG A 30 24.646 -11.138 -7.060 1.00 11.14 C ATOM 503 CG ARG A 30 24.342 -10.602 -8.450 1.00 11.16 C ATOM 504 CD ARG A 30 22.854 -10.653 -8.756 1.00 11.94 C ATOM 505 NE ARG A 30 22.557 -10.174 -10.106 1.00 12.66 N ATOM 506 CZ ARG A 30 21.429 -9.551 -10.453 1.00 13.44 C ATOM 507 NH1 ARG A 30 20.467 -9.349 -9.558 1.00 13.60 N ATOM 508 NH2 ARG A 30 21.259 -9.145 -11.707 1.00 14.19 N ATOM 0 H ARG A 30 25.756 -8.947 -6.719 1.00 9.50 H new ATOM 0 HA ARG A 30 26.268 -11.586 -5.727 1.00 10.45 H new ATOM 0 HB2 ARG A 30 24.358 -12.188 -7.018 1.00 11.14 H new ATOM 0 HB3 ARG A 30 24.027 -10.608 -6.336 1.00 11.14 H new ATOM 0 HG2 ARG A 30 24.695 -9.574 -8.530 1.00 11.16 H new ATOM 0 HG3 ARG A 30 24.887 -11.185 -9.193 1.00 11.16 H new ATOM 0 HD2 ARG A 30 22.496 -11.677 -8.647 1.00 11.94 H new ATOM 0 HD3 ARG A 30 22.313 -10.047 -8.029 1.00 11.94 H new ATOM 0 HE ARG A 30 23.259 -10.326 -10.830 1.00 12.66 H new ATOM 0 HH11 ARG A 30 20.588 -9.671 -8.598 1.00 13.60 H new ATOM 0 HH12 ARG A 30 19.608 -8.872 -9.832 1.00 13.60 H new ATOM 0 HH21 ARG A 30 21.989 -9.310 -12.400 1.00 14.19 H new ATOM 0 HH22 ARG A 30 20.398 -8.668 -11.977 1.00 14.19 H new ATOM 522 N ALA A 31 27.520 -10.697 -8.568 1.00 10.87 N ATOM 523 CA ALA A 31 28.397 -11.102 -9.654 1.00 11.56 C ATOM 524 C ALA A 31 29.849 -11.181 -9.197 1.00 11.34 C ATOM 525 O ALA A 31 30.477 -12.236 -9.283 1.00 11.93 O ATOM 526 CB ALA A 31 28.263 -10.142 -10.828 1.00 11.84 C ATOM 0 H ALA A 31 27.336 -9.695 -8.525 1.00 10.87 H new ATOM 0 HA ALA A 31 28.093 -12.099 -9.975 1.00 11.56 H new ATOM 0 HB1 ALA A 31 28.926 -10.458 -11.634 1.00 11.84 H new ATOM 0 HB2 ALA A 31 27.233 -10.144 -11.184 1.00 11.84 H new ATOM 0 HB3 ALA A 31 28.535 -9.136 -10.508 1.00 11.84 H new ATOM 532 N GLU A 32 30.374 -10.073 -8.687 1.00 10.61 N ATOM 533 CA GLU A 32 31.782 -9.996 -8.301 1.00 10.60 C ATOM 534 C GLU A 32 32.002 -10.451 -6.856 1.00 10.54 C ATOM 535 O GLU A 32 32.830 -9.890 -6.134 1.00 10.89 O ATOM 536 CB GLU A 32 32.311 -8.571 -8.503 1.00 10.22 C ATOM 537 CG GLU A 32 31.597 -7.524 -7.662 1.00 9.56 C ATOM 538 CD GLU A 32 32.029 -6.110 -7.991 1.00 9.48 C ATOM 539 OE1 GLU A 32 33.159 -5.725 -7.627 1.00 9.47 O ATOM 540 OE2 GLU A 32 31.235 -5.373 -8.610 1.00 9.62 O ATOM 0 H GLU A 32 29.847 -9.214 -8.530 1.00 10.61 H new ATOM 0 HA GLU A 32 32.339 -10.677 -8.945 1.00 10.60 H new ATOM 0 HB2 GLU A 32 33.374 -8.551 -8.264 1.00 10.22 H new ATOM 0 HB3 GLU A 32 32.216 -8.304 -9.556 1.00 10.22 H new ATOM 0 HG2 GLU A 32 30.521 -7.615 -7.814 1.00 9.56 H new ATOM 0 HG3 GLU A 32 31.788 -7.721 -6.607 1.00 9.56 H new ATOM 547 N GLN A 33 31.282 -11.481 -6.438 1.00 10.31 N ATOM 548 CA GLN A 33 31.375 -11.967 -5.069 1.00 10.45 C ATOM 549 C GLN A 33 32.546 -12.930 -4.887 1.00 10.39 C ATOM 550 O GLN A 33 32.434 -13.949 -4.206 1.00 10.09 O ATOM 551 CB GLN A 33 30.081 -12.652 -4.649 1.00 10.44 C ATOM 552 CG GLN A 33 29.665 -13.809 -5.546 1.00 10.76 C ATOM 553 CD GLN A 33 28.477 -14.567 -4.985 1.00 11.12 C ATOM 554 OE1 GLN A 33 28.637 -15.509 -4.212 1.00 11.23 O ATOM 555 NE2 GLN A 33 27.282 -14.170 -5.377 1.00 11.52 N ATOM 0 H GLN A 33 30.627 -11.996 -7.026 1.00 10.31 H new ATOM 0 HA GLN A 33 31.546 -11.098 -4.434 1.00 10.45 H new ATOM 0 HB2 GLN A 33 30.193 -13.020 -3.629 1.00 10.44 H new ATOM 0 HB3 GLN A 33 29.280 -11.913 -4.635 1.00 10.44 H new ATOM 0 HG2 GLN A 33 29.416 -13.428 -6.537 1.00 10.76 H new ATOM 0 HG3 GLN A 33 30.505 -14.492 -5.669 1.00 10.76 H new ATOM 0 HE21 GLN A 33 27.191 -13.383 -6.020 1.00 11.52 H new ATOM 0 HE22 GLN A 33 26.448 -14.650 -5.037 1.00 11.52 H new ATOM 564 N ALA A 34 33.667 -12.596 -5.491 1.00 10.90 N ATOM 565 CA ALA A 34 34.862 -13.418 -5.386 1.00 11.19 C ATOM 566 C ALA A 34 35.525 -13.207 -4.033 1.00 11.09 C ATOM 567 O ALA A 34 35.621 -14.129 -3.222 1.00 11.27 O ATOM 568 CB ALA A 34 35.830 -13.101 -6.516 1.00 11.97 C ATOM 0 H ALA A 34 33.779 -11.759 -6.063 1.00 10.90 H new ATOM 0 HA ALA A 34 34.574 -14.466 -5.471 1.00 11.19 H new ATOM 0 HB1 ALA A 34 36.718 -13.726 -6.420 1.00 11.97 H new ATOM 0 HB2 ALA A 34 35.349 -13.299 -7.474 1.00 11.97 H new ATOM 0 HB3 ALA A 34 36.118 -12.051 -6.465 1.00 11.97 H new ATOM 574 N SER A 35 35.974 -11.986 -3.785 1.00 11.05 N ATOM 575 CA SER A 35 36.539 -11.632 -2.498 1.00 11.21 C ATOM 576 C SER A 35 35.429 -11.272 -1.518 1.00 10.64 C ATOM 577 O SER A 35 35.230 -10.101 -1.190 1.00 10.19 O ATOM 578 CB SER A 35 37.518 -10.467 -2.638 1.00 11.48 C ATOM 579 OG SER A 35 38.159 -10.189 -1.406 1.00 12.02 O ATOM 0 H SER A 35 35.957 -11.224 -4.462 1.00 11.05 H new ATOM 0 HA SER A 35 37.085 -12.494 -2.114 1.00 11.21 H new ATOM 0 HB2 SER A 35 38.265 -10.705 -3.395 1.00 11.48 H new ATOM 0 HB3 SER A 35 36.986 -9.580 -2.983 1.00 11.48 H new ATOM 0 HG SER A 35 38.891 -9.554 -1.554 1.00 12.02 H new ATOM 585 N GLN A 36 34.709 -12.282 -1.054 1.00 10.85 N ATOM 586 CA GLN A 36 33.612 -12.085 -0.111 1.00 10.51 C ATOM 587 C GLN A 36 34.121 -11.410 1.156 1.00 10.66 C ATOM 588 O GLN A 36 33.406 -10.640 1.798 1.00 10.26 O ATOM 589 CB GLN A 36 32.974 -13.429 0.236 1.00 11.11 C ATOM 590 CG GLN A 36 32.467 -14.189 -0.978 1.00 11.25 C ATOM 591 CD GLN A 36 32.063 -15.610 -0.644 1.00 11.80 C ATOM 592 OE1 GLN A 36 32.887 -16.523 -0.688 1.00 12.14 O ATOM 593 NE2 GLN A 36 30.796 -15.810 -0.324 1.00 12.09 N ATOM 0 H GLN A 36 34.865 -13.255 -1.316 1.00 10.85 H new ATOM 0 HA GLN A 36 32.862 -11.444 -0.575 1.00 10.51 H new ATOM 0 HB2 GLN A 36 33.704 -14.044 0.761 1.00 11.11 H new ATOM 0 HB3 GLN A 36 32.145 -13.262 0.923 1.00 11.11 H new ATOM 0 HG2 GLN A 36 31.613 -13.662 -1.402 1.00 11.25 H new ATOM 0 HG3 GLN A 36 33.243 -14.205 -1.743 1.00 11.25 H new ATOM 0 HE21 GLN A 36 30.146 -15.024 -0.300 1.00 12.09 H new ATOM 0 HE22 GLN A 36 30.468 -16.750 -0.101 1.00 12.09 H new ATOM 602 N GLU A 37 35.375 -11.694 1.489 1.00 11.37 N ATOM 603 CA GLU A 37 36.008 -11.154 2.683 1.00 11.85 C ATOM 604 C GLU A 37 36.115 -9.633 2.629 1.00 11.40 C ATOM 605 O GLU A 37 35.847 -8.948 3.618 1.00 11.56 O ATOM 606 CB GLU A 37 37.391 -11.784 2.873 1.00 12.76 C ATOM 607 CG GLU A 37 38.268 -11.712 1.632 1.00 12.82 C ATOM 608 CD GLU A 37 39.626 -12.343 1.835 1.00 13.79 C ATOM 609 OE1 GLU A 37 39.743 -13.574 1.667 1.00 14.44 O ATOM 610 OE2 GLU A 37 40.580 -11.609 2.167 1.00 13.98 O ATOM 0 H GLU A 37 35.979 -12.304 0.939 1.00 11.37 H new ATOM 0 HA GLU A 37 35.380 -11.405 3.538 1.00 11.85 H new ATOM 0 HB2 GLU A 37 37.899 -11.283 3.697 1.00 12.76 H new ATOM 0 HB3 GLU A 37 37.269 -12.828 3.162 1.00 12.76 H new ATOM 0 HG2 GLU A 37 37.761 -12.210 0.806 1.00 12.82 H new ATOM 0 HG3 GLU A 37 38.397 -10.669 1.344 1.00 12.82 H new ATOM 617 N VAL A 38 36.485 -9.103 1.474 1.00 11.01 N ATOM 618 CA VAL A 38 36.621 -7.664 1.318 1.00 10.78 C ATOM 619 C VAL A 38 35.267 -7.049 1.005 1.00 9.91 C ATOM 620 O VAL A 38 34.951 -5.951 1.456 1.00 9.82 O ATOM 621 CB VAL A 38 37.635 -7.299 0.208 1.00 10.99 C ATOM 622 CG1 VAL A 38 37.691 -5.793 -0.011 1.00 11.05 C ATOM 623 CG2 VAL A 38 39.016 -7.832 0.555 1.00 11.61 C ATOM 0 H VAL A 38 36.695 -9.644 0.635 1.00 11.01 H new ATOM 0 HA VAL A 38 37.000 -7.262 2.258 1.00 10.78 H new ATOM 0 HB VAL A 38 37.300 -7.764 -0.719 1.00 10.99 H new ATOM 0 HG11 VAL A 38 38.412 -5.566 -0.797 1.00 11.05 H new ATOM 0 HG12 VAL A 38 36.706 -5.431 -0.307 1.00 11.05 H new ATOM 0 HG13 VAL A 38 37.995 -5.302 0.913 1.00 11.05 H new ATOM 0 HG21 VAL A 38 39.718 -7.567 -0.236 1.00 11.61 H new ATOM 0 HG22 VAL A 38 39.349 -7.395 1.497 1.00 11.61 H new ATOM 0 HG23 VAL A 38 38.973 -8.917 0.653 1.00 11.61 H new ATOM 633 N LYS A 39 34.455 -7.786 0.260 1.00 9.40 N ATOM 634 CA LYS A 39 33.140 -7.311 -0.142 1.00 8.62 C ATOM 635 C LYS A 39 32.255 -7.053 1.069 1.00 8.49 C ATOM 636 O LYS A 39 31.700 -5.966 1.215 1.00 8.00 O ATOM 637 CB LYS A 39 32.473 -8.316 -1.078 1.00 8.48 C ATOM 638 CG LYS A 39 33.119 -8.389 -2.453 1.00 8.87 C ATOM 639 CD LYS A 39 32.853 -7.128 -3.263 1.00 8.96 C ATOM 640 CE LYS A 39 33.466 -7.210 -4.654 1.00 9.53 C ATOM 641 NZ LYS A 39 34.951 -7.208 -4.620 1.00 9.78 N ATOM 0 H LYS A 39 34.686 -8.720 -0.079 1.00 9.40 H new ATOM 0 HA LYS A 39 33.272 -6.368 -0.673 1.00 8.62 H new ATOM 0 HB2 LYS A 39 32.504 -9.304 -0.618 1.00 8.48 H new ATOM 0 HB3 LYS A 39 31.422 -8.051 -1.193 1.00 8.48 H new ATOM 0 HG2 LYS A 39 34.194 -8.532 -2.344 1.00 8.87 H new ATOM 0 HG3 LYS A 39 32.735 -9.256 -2.991 1.00 8.87 H new ATOM 0 HD2 LYS A 39 31.778 -6.971 -3.348 1.00 8.96 H new ATOM 0 HD3 LYS A 39 33.261 -6.265 -2.736 1.00 8.96 H new ATOM 0 HE2 LYS A 39 33.118 -8.117 -5.148 1.00 9.53 H new ATOM 0 HE3 LYS A 39 33.118 -6.367 -5.252 1.00 9.53 H new ATOM 0 HZ1 LYS A 39 35.320 -7.180 -5.592 1.00 9.78 H new ATOM 0 HZ2 LYS A 39 35.285 -6.373 -4.098 1.00 9.78 H new ATOM 0 HZ3 LYS A 39 35.289 -8.070 -4.146 1.00 9.78 H new ATOM 655 N ASN A 40 32.137 -8.046 1.943 1.00 9.12 N ATOM 656 CA ASN A 40 31.308 -7.907 3.138 1.00 9.38 C ATOM 657 C ASN A 40 31.817 -6.769 4.022 1.00 9.55 C ATOM 658 O ASN A 40 31.033 -5.949 4.497 1.00 9.39 O ATOM 659 CB ASN A 40 31.270 -9.214 3.933 1.00 10.35 C ATOM 660 CG ASN A 40 30.326 -9.140 5.123 1.00 10.85 C ATOM 661 OD1 ASN A 40 29.129 -9.406 5.000 1.00 10.92 O ATOM 662 ND2 ASN A 40 30.855 -8.787 6.285 1.00 11.43 N ATOM 0 H ASN A 40 32.600 -8.950 1.850 1.00 9.12 H new ATOM 0 HA ASN A 40 30.295 -7.670 2.814 1.00 9.38 H new ATOM 0 HB2 ASN A 40 30.960 -10.027 3.276 1.00 10.35 H new ATOM 0 HB3 ASN A 40 32.274 -9.453 4.283 1.00 10.35 H new ATOM 0 HD21 ASN A 40 30.267 -8.728 7.116 1.00 11.43 H new ATOM 0 HD22 ASN A 40 31.851 -8.574 6.348 1.00 11.43 H new ATOM 669 N ALA A 41 33.131 -6.708 4.210 1.00 10.04 N ATOM 670 CA ALA A 41 33.739 -5.661 5.027 1.00 10.52 C ATOM 671 C ALA A 41 33.508 -4.289 4.405 1.00 9.85 C ATOM 672 O ALA A 41 33.355 -3.290 5.112 1.00 10.08 O ATOM 673 CB ALA A 41 35.228 -5.921 5.204 1.00 11.43 C ATOM 0 H ALA A 41 33.796 -7.370 3.809 1.00 10.04 H new ATOM 0 HA ALA A 41 33.265 -5.676 6.009 1.00 10.52 H new ATOM 0 HB1 ALA A 41 35.665 -5.131 5.815 1.00 11.43 H new ATOM 0 HB2 ALA A 41 35.373 -6.883 5.696 1.00 11.43 H new ATOM 0 HB3 ALA A 41 35.713 -5.935 4.228 1.00 11.43 H new ATOM 679 N ALA A 42 33.486 -4.245 3.081 1.00 9.19 N ATOM 680 CA ALA A 42 33.210 -3.012 2.366 1.00 8.71 C ATOM 681 C ALA A 42 31.760 -2.602 2.550 1.00 7.86 C ATOM 682 O ALA A 42 31.488 -1.507 3.020 1.00 7.82 O ATOM 683 CB ALA A 42 33.543 -3.157 0.887 1.00 8.58 C ATOM 0 H ALA A 42 33.657 -5.052 2.481 1.00 9.19 H new ATOM 0 HA ALA A 42 33.844 -2.229 2.781 1.00 8.71 H new ATOM 0 HB1 ALA A 42 33.328 -2.221 0.372 1.00 8.58 H new ATOM 0 HB2 ALA A 42 34.600 -3.399 0.774 1.00 8.58 H new ATOM 0 HB3 ALA A 42 32.940 -3.955 0.455 1.00 8.58 H new ATOM 689 N THR A 43 30.840 -3.509 2.215 1.00 7.35 N ATOM 690 CA THR A 43 29.403 -3.230 2.243 1.00 6.63 C ATOM 691 C THR A 43 28.950 -2.573 3.549 1.00 6.87 C ATOM 692 O THR A 43 28.041 -1.742 3.542 1.00 6.42 O ATOM 693 CB THR A 43 28.572 -4.512 2.004 1.00 6.60 C ATOM 694 OG1 THR A 43 28.896 -5.513 2.976 1.00 6.93 O ATOM 695 CG2 THR A 43 28.815 -5.062 0.608 1.00 6.92 C ATOM 0 H THR A 43 31.070 -4.457 1.917 1.00 7.35 H new ATOM 0 HA THR A 43 29.226 -2.525 1.431 1.00 6.63 H new ATOM 0 HB THR A 43 27.519 -4.248 2.101 1.00 6.60 H new ATOM 0 HG1 THR A 43 29.799 -5.353 3.322 1.00 6.93 H new ATOM 0 HG21 THR A 43 28.220 -5.964 0.463 1.00 6.92 H new ATOM 0 HG22 THR A 43 28.528 -4.315 -0.132 1.00 6.92 H new ATOM 0 HG23 THR A 43 29.872 -5.302 0.490 1.00 6.92 H new ATOM 703 N GLU A 44 29.599 -2.933 4.654 1.00 7.76 N ATOM 704 CA GLU A 44 29.275 -2.370 5.961 1.00 8.32 C ATOM 705 C GLU A 44 29.345 -0.845 5.939 1.00 8.48 C ATOM 706 O GLU A 44 28.367 -0.159 6.236 1.00 8.35 O ATOM 707 CB GLU A 44 30.247 -2.896 7.011 1.00 9.53 C ATOM 708 CG GLU A 44 30.212 -4.401 7.188 1.00 10.03 C ATOM 709 CD GLU A 44 31.150 -4.869 8.280 1.00 11.07 C ATOM 710 OE1 GLU A 44 32.336 -5.112 7.989 1.00 11.69 O ATOM 711 OE2 GLU A 44 30.701 -4.990 9.441 1.00 11.42 O ATOM 0 H GLU A 44 30.356 -3.616 4.669 1.00 7.76 H new ATOM 0 HA GLU A 44 28.257 -2.671 6.210 1.00 8.32 H new ATOM 0 HB2 GLU A 44 31.259 -2.597 6.737 1.00 9.53 H new ATOM 0 HB3 GLU A 44 30.023 -2.423 7.967 1.00 9.53 H new ATOM 0 HG2 GLU A 44 29.195 -4.714 7.426 1.00 10.03 H new ATOM 0 HG3 GLU A 44 30.482 -4.882 6.248 1.00 10.03 H new ATOM 718 N THR A 45 30.510 -0.327 5.589 1.00 8.95 N ATOM 719 CA THR A 45 30.720 1.112 5.531 1.00 9.49 C ATOM 720 C THR A 45 30.271 1.678 4.181 1.00 8.79 C ATOM 721 O THR A 45 29.873 2.836 4.080 1.00 9.04 O ATOM 722 CB THR A 45 32.204 1.468 5.797 1.00 10.61 C ATOM 723 OG1 THR A 45 32.417 2.879 5.675 1.00 11.34 O ATOM 724 CG2 THR A 45 33.130 0.729 4.843 1.00 11.01 C ATOM 0 H THR A 45 31.328 -0.883 5.340 1.00 8.95 H new ATOM 0 HA THR A 45 30.112 1.567 6.313 1.00 9.49 H new ATOM 0 HB THR A 45 32.435 1.157 6.816 1.00 10.61 H new ATOM 0 HG1 THR A 45 33.360 3.084 5.848 1.00 11.34 H new ATOM 0 HG21 THR A 45 34.164 1.001 5.056 1.00 11.01 H new ATOM 0 HG22 THR A 45 33.003 -0.346 4.972 1.00 11.01 H new ATOM 0 HG23 THR A 45 32.887 1.002 3.816 1.00 11.01 H new ATOM 732 N LEU A 46 30.308 0.839 3.156 1.00 8.07 N ATOM 733 CA LEU A 46 30.004 1.257 1.798 1.00 7.71 C ATOM 734 C LEU A 46 28.551 1.701 1.664 1.00 6.77 C ATOM 735 O LEU A 46 28.299 2.832 1.287 1.00 6.93 O ATOM 736 CB LEU A 46 30.341 0.121 0.813 1.00 7.55 C ATOM 737 CG LEU A 46 30.217 0.427 -0.690 1.00 7.70 C ATOM 738 CD1 LEU A 46 28.785 0.259 -1.161 1.00 7.76 C ATOM 739 CD2 LEU A 46 30.721 1.827 -1.007 1.00 8.22 C ATOM 0 H LEU A 46 30.549 -0.148 3.243 1.00 8.07 H new ATOM 0 HA LEU A 46 30.622 2.121 1.554 1.00 7.71 H new ATOM 0 HB2 LEU A 46 31.364 -0.201 1.008 1.00 7.55 H new ATOM 0 HB3 LEU A 46 29.692 -0.725 1.039 1.00 7.55 H new ATOM 0 HG LEU A 46 30.840 -0.288 -1.226 1.00 7.70 H new ATOM 0 HD11 LEU A 46 28.724 0.481 -2.226 1.00 7.76 H new ATOM 0 HD12 LEU A 46 28.462 -0.767 -0.985 1.00 7.76 H new ATOM 0 HD13 LEU A 46 28.138 0.942 -0.610 1.00 7.76 H new ATOM 0 HD21 LEU A 46 30.622 2.016 -2.076 1.00 8.22 H new ATOM 0 HD22 LEU A 46 30.134 2.559 -0.453 1.00 8.22 H new ATOM 0 HD23 LEU A 46 31.769 1.910 -0.720 1.00 8.22 H new ATOM 751 N LEU A 47 27.598 0.829 1.993 1.00 5.99 N ATOM 752 CA LEU A 47 26.183 1.148 1.766 1.00 5.15 C ATOM 753 C LEU A 47 25.711 2.332 2.611 1.00 5.48 C ATOM 754 O LEU A 47 24.835 3.082 2.189 1.00 5.21 O ATOM 755 CB LEU A 47 25.273 -0.064 2.013 1.00 4.73 C ATOM 756 CG LEU A 47 25.176 -1.081 0.863 1.00 4.22 C ATOM 757 CD1 LEU A 47 24.867 -0.394 -0.465 1.00 4.20 C ATOM 758 CD2 LEU A 47 26.449 -1.898 0.757 1.00 4.34 C ATOM 0 H LEU A 47 27.771 -0.086 2.409 1.00 5.99 H new ATOM 0 HA LEU A 47 26.107 1.429 0.716 1.00 5.15 H new ATOM 0 HB2 LEU A 47 25.628 -0.584 2.903 1.00 4.73 H new ATOM 0 HB3 LEU A 47 24.270 0.300 2.235 1.00 4.73 H new ATOM 0 HG LEU A 47 24.350 -1.756 1.089 1.00 4.22 H new ATOM 0 HD11 LEU A 47 24.805 -1.142 -1.256 1.00 4.20 H new ATOM 0 HD12 LEU A 47 23.916 0.133 -0.389 1.00 4.20 H new ATOM 0 HD13 LEU A 47 25.659 0.318 -0.699 1.00 4.20 H new ATOM 0 HD21 LEU A 47 26.357 -2.610 -0.063 1.00 4.34 H new ATOM 0 HD22 LEU A 47 27.293 -1.234 0.568 1.00 4.34 H new ATOM 0 HD23 LEU A 47 26.614 -2.438 1.690 1.00 4.34 H new ATOM 770 N VAL A 48 26.289 2.513 3.793 1.00 6.32 N ATOM 771 CA VAL A 48 25.895 3.634 4.642 1.00 6.92 C ATOM 772 C VAL A 48 26.520 4.939 4.147 1.00 7.62 C ATOM 773 O VAL A 48 25.914 6.002 4.249 1.00 7.93 O ATOM 774 CB VAL A 48 26.249 3.405 6.133 1.00 7.91 C ATOM 775 CG1 VAL A 48 25.503 2.197 6.680 1.00 7.84 C ATOM 776 CG2 VAL A 48 27.747 3.238 6.332 1.00 8.67 C ATOM 0 H VAL A 48 27.017 1.913 4.180 1.00 6.32 H new ATOM 0 HA VAL A 48 24.810 3.708 4.574 1.00 6.92 H new ATOM 0 HB VAL A 48 25.937 4.291 6.686 1.00 7.91 H new ATOM 0 HG11 VAL A 48 25.764 2.052 7.728 1.00 7.84 H new ATOM 0 HG12 VAL A 48 24.429 2.363 6.593 1.00 7.84 H new ATOM 0 HG13 VAL A 48 25.780 1.310 6.111 1.00 7.84 H new ATOM 0 HG21 VAL A 48 27.958 3.079 7.390 1.00 8.67 H new ATOM 0 HG22 VAL A 48 28.097 2.379 5.759 1.00 8.67 H new ATOM 0 HG23 VAL A 48 28.262 4.136 5.990 1.00 8.67 H new ATOM 786 N GLN A 49 27.725 4.844 3.593 1.00 8.03 N ATOM 787 CA GLN A 49 28.405 5.997 3.015 1.00 8.97 C ATOM 788 C GLN A 49 27.864 6.278 1.613 1.00 8.65 C ATOM 789 O GLN A 49 27.943 7.395 1.102 1.00 9.36 O ATOM 790 CB GLN A 49 29.917 5.737 2.971 1.00 9.65 C ATOM 791 CG GLN A 49 30.725 6.838 2.299 1.00 10.72 C ATOM 792 CD GLN A 49 30.725 8.145 3.073 1.00 11.48 C ATOM 793 OE1 GLN A 49 29.772 8.468 3.783 1.00 11.55 O ATOM 794 NE2 GLN A 49 31.795 8.910 2.935 1.00 12.22 N ATOM 0 H GLN A 49 28.253 3.974 3.532 1.00 8.03 H new ATOM 0 HA GLN A 49 28.219 6.874 3.635 1.00 8.97 H new ATOM 0 HB2 GLN A 49 30.281 5.607 3.990 1.00 9.65 H new ATOM 0 HB3 GLN A 49 30.097 4.799 2.446 1.00 9.65 H new ATOM 0 HG2 GLN A 49 31.753 6.499 2.174 1.00 10.72 H new ATOM 0 HG3 GLN A 49 30.324 7.015 1.301 1.00 10.72 H new ATOM 0 HE21 GLN A 49 32.564 8.608 2.338 1.00 12.22 H new ATOM 0 HE22 GLN A 49 31.851 9.802 3.426 1.00 12.22 H new ATOM 803 N ASN A 50 27.296 5.242 1.018 1.00 7.73 N ATOM 804 CA ASN A 50 26.709 5.301 -0.315 1.00 7.72 C ATOM 805 C ASN A 50 25.441 6.151 -0.318 1.00 7.17 C ATOM 806 O ASN A 50 24.998 6.624 -1.364 1.00 7.27 O ATOM 807 CB ASN A 50 26.395 3.871 -0.772 1.00 7.34 C ATOM 808 CG ASN A 50 25.698 3.788 -2.107 1.00 7.66 C ATOM 809 OD1 ASN A 50 26.473 3.605 -3.158 1.00 8.30 O flip ATOM 810 ND2 ASN A 50 24.474 3.860 -2.190 1.00 7.49 N flip ATOM 0 H ASN A 50 27.228 4.322 1.452 1.00 7.73 H new ATOM 0 HA ASN A 50 27.416 5.766 -1.002 1.00 7.72 H new ATOM 0 HB2 ASN A 50 27.325 3.306 -0.825 1.00 7.34 H new ATOM 0 HB3 ASN A 50 25.772 3.389 -0.019 1.00 7.34 H new ATOM 0 HD21 ASN A 50 23.913 4.002 -1.350 1.00 7.49 H new ATOM 0 HD22 ASN A 50 24.019 3.777 -3.099 1.00 7.49 H new ATOM 817 N ALA A 51 24.888 6.376 0.864 1.00 6.83 N ATOM 818 CA ALA A 51 23.630 7.078 0.992 1.00 6.42 C ATOM 819 C ALA A 51 23.834 8.575 0.813 1.00 7.39 C ATOM 820 O ALA A 51 24.946 9.082 0.980 1.00 8.36 O ATOM 821 CB ALA A 51 23.017 6.778 2.351 1.00 5.86 C ATOM 0 H ALA A 51 25.297 6.079 1.750 1.00 6.83 H new ATOM 0 HA ALA A 51 22.949 6.736 0.213 1.00 6.42 H new ATOM 0 HB1 ALA A 51 22.069 7.307 2.447 1.00 5.86 H new ATOM 0 HB2 ALA A 51 22.845 5.706 2.444 1.00 5.86 H new ATOM 0 HB3 ALA A 51 23.697 7.106 3.137 1.00 5.86 H new ATOM 827 N ASN A 52 22.771 9.279 0.449 1.00 7.23 N ATOM 828 CA ASN A 52 22.817 10.731 0.390 1.00 8.14 C ATOM 829 C ASN A 52 22.912 11.265 1.808 1.00 8.57 C ATOM 830 O ASN A 52 22.368 10.653 2.725 1.00 8.09 O ATOM 831 CB ASN A 52 21.589 11.300 -0.347 1.00 7.94 C ATOM 832 CG ASN A 52 20.273 11.029 0.359 1.00 8.81 C ATOM 833 OD1 ASN A 52 19.682 9.966 0.201 1.00 9.40 O ATOM 834 ND2 ASN A 52 19.784 12.005 1.107 1.00 9.07 N ATOM 0 H ASN A 52 21.872 8.870 0.192 1.00 7.23 H new ATOM 0 HA ASN A 52 23.692 11.048 -0.177 1.00 8.14 H new ATOM 0 HB2 ASN A 52 21.713 12.377 -0.464 1.00 7.94 H new ATOM 0 HB3 ASN A 52 21.548 10.873 -1.349 1.00 7.94 H new ATOM 0 HD21 ASN A 52 18.886 11.887 1.576 1.00 9.07 H new ATOM 0 HD22 ASN A 52 20.305 12.875 1.215 1.00 9.07 H new ATOM 841 N PRO A 53 23.638 12.382 2.007 1.00 9.68 N ATOM 842 CA PRO A 53 23.904 12.953 3.334 1.00 10.41 C ATOM 843 C PRO A 53 22.722 12.849 4.293 1.00 10.13 C ATOM 844 O PRO A 53 22.863 12.367 5.413 1.00 10.29 O ATOM 845 CB PRO A 53 24.213 14.409 3.007 1.00 11.56 C ATOM 846 CG PRO A 53 24.889 14.348 1.681 1.00 11.66 C ATOM 847 CD PRO A 53 24.278 13.181 0.943 1.00 10.51 C ATOM 0 HA PRO A 53 24.703 12.424 3.853 1.00 10.41 H new ATOM 0 HB2 PRO A 53 23.304 15.009 2.964 1.00 11.56 H new ATOM 0 HB3 PRO A 53 24.857 14.859 3.762 1.00 11.56 H new ATOM 0 HG2 PRO A 53 24.744 15.276 1.128 1.00 11.66 H new ATOM 0 HG3 PRO A 53 25.964 14.213 1.799 1.00 11.66 H new ATOM 0 HD2 PRO A 53 23.551 13.514 0.202 1.00 10.51 H new ATOM 0 HD3 PRO A 53 25.035 12.604 0.411 1.00 10.51 H new ATOM 855 N ASP A 54 21.554 13.259 3.825 1.00 9.86 N ATOM 856 CA ASP A 54 20.346 13.284 4.654 1.00 9.76 C ATOM 857 C ASP A 54 19.948 11.874 5.094 1.00 8.93 C ATOM 858 O ASP A 54 19.525 11.653 6.228 1.00 9.26 O ATOM 859 CB ASP A 54 19.199 13.909 3.863 1.00 9.71 C ATOM 860 CG ASP A 54 18.083 14.428 4.749 1.00 9.98 C ATOM 861 OD1 ASP A 54 18.136 15.611 5.145 1.00 10.64 O ATOM 862 OD2 ASP A 54 17.138 13.668 5.035 1.00 9.67 O ATOM 0 H ASP A 54 21.410 13.583 2.868 1.00 9.86 H new ATOM 0 HA ASP A 54 20.555 13.876 5.545 1.00 9.76 H new ATOM 0 HB2 ASP A 54 19.586 14.729 3.258 1.00 9.71 H new ATOM 0 HB3 ASP A 54 18.794 13.168 3.174 1.00 9.71 H new ATOM 867 N CYS A 55 20.121 10.934 4.183 1.00 8.04 N ATOM 868 CA CYS A 55 19.714 9.543 4.385 1.00 7.30 C ATOM 869 C CYS A 55 20.539 8.849 5.470 1.00 7.57 C ATOM 870 O CYS A 55 19.989 8.211 6.365 1.00 7.74 O ATOM 871 CB CYS A 55 19.836 8.780 3.065 1.00 6.46 C ATOM 872 SG CYS A 55 19.533 7.006 3.187 1.00 6.30 S ATOM 0 H CYS A 55 20.550 11.109 3.274 1.00 8.04 H new ATOM 0 HA CYS A 55 18.677 9.545 4.722 1.00 7.30 H new ATOM 0 HB2 CYS A 55 19.133 9.206 2.349 1.00 6.46 H new ATOM 0 HB3 CYS A 55 20.837 8.937 2.662 1.00 6.46 H new ATOM 0 HG CYS A 55 19.922 6.423 2.092 1.00 6.30 H new ATOM 878 N LYS A 56 21.858 8.957 5.400 1.00 7.87 N ATOM 879 CA LYS A 56 22.706 8.353 6.426 1.00 8.36 C ATOM 880 C LYS A 56 22.540 9.096 7.743 1.00 9.50 C ATOM 881 O LYS A 56 22.682 8.521 8.821 1.00 10.04 O ATOM 882 CB LYS A 56 24.170 8.342 5.994 1.00 8.58 C ATOM 883 CG LYS A 56 24.657 9.677 5.471 1.00 8.84 C ATOM 884 CD LYS A 56 25.104 9.570 4.028 1.00 8.68 C ATOM 885 CE LYS A 56 26.488 8.954 3.903 1.00 9.50 C ATOM 886 NZ LYS A 56 27.515 9.713 4.661 1.00 9.81 N ATOM 0 H LYS A 56 22.360 9.447 4.660 1.00 7.87 H new ATOM 0 HA LYS A 56 22.394 7.318 6.564 1.00 8.36 H new ATOM 0 HB2 LYS A 56 24.788 8.046 6.841 1.00 8.58 H new ATOM 0 HB3 LYS A 56 24.306 7.586 5.220 1.00 8.58 H new ATOM 0 HG2 LYS A 56 23.860 10.416 5.554 1.00 8.84 H new ATOM 0 HG3 LYS A 56 25.485 10.031 6.086 1.00 8.84 H new ATOM 0 HD2 LYS A 56 24.387 8.967 3.471 1.00 8.68 H new ATOM 0 HD3 LYS A 56 25.107 10.561 3.575 1.00 8.68 H new ATOM 0 HE2 LYS A 56 26.459 7.926 4.264 1.00 9.50 H new ATOM 0 HE3 LYS A 56 26.772 8.914 2.851 1.00 9.50 H new ATOM 0 HZ1 LYS A 56 28.461 9.469 4.304 1.00 9.81 H new ATOM 0 HZ2 LYS A 56 27.352 10.733 4.541 1.00 9.81 H new ATOM 0 HZ3 LYS A 56 27.453 9.469 5.670 1.00 9.81 H new ATOM 900 N THR A 57 22.224 10.377 7.633 1.00 9.98 N ATOM 901 CA THR A 57 21.933 11.205 8.796 1.00 11.08 C ATOM 902 C THR A 57 20.722 10.674 9.572 1.00 11.16 C ATOM 903 O THR A 57 20.760 10.582 10.802 1.00 12.08 O ATOM 904 CB THR A 57 21.692 12.670 8.378 1.00 11.53 C ATOM 905 OG1 THR A 57 22.892 13.216 7.818 1.00 12.00 O ATOM 906 CG2 THR A 57 21.251 13.521 9.555 1.00 12.46 C ATOM 0 H THR A 57 22.162 10.870 6.742 1.00 9.98 H new ATOM 0 HA THR A 57 22.803 11.164 9.452 1.00 11.08 H new ATOM 0 HB THR A 57 20.895 12.679 7.635 1.00 11.53 H new ATOM 0 HG1 THR A 57 23.169 12.677 7.048 1.00 12.00 H new ATOM 0 HG21 THR A 57 21.091 14.547 9.223 1.00 12.46 H new ATOM 0 HG22 THR A 57 20.322 13.123 9.964 1.00 12.46 H new ATOM 0 HG23 THR A 57 22.023 13.505 10.325 1.00 12.46 H new ATOM 914 N ILE A 58 19.653 10.313 8.867 1.00 10.34 N ATOM 915 CA ILE A 58 18.465 9.791 9.534 1.00 10.60 C ATOM 916 C ILE A 58 18.696 8.370 10.040 1.00 10.65 C ATOM 917 O ILE A 58 18.230 8.023 11.118 1.00 11.46 O ATOM 918 CB ILE A 58 17.207 9.817 8.639 1.00 9.96 C ATOM 919 CG1 ILE A 58 17.436 9.016 7.361 1.00 8.86 C ATOM 920 CG2 ILE A 58 16.817 11.249 8.313 1.00 10.22 C ATOM 921 CD1 ILE A 58 16.216 8.894 6.482 1.00 8.44 C ATOM 0 H ILE A 58 19.585 10.371 7.851 1.00 10.34 H new ATOM 0 HA ILE A 58 18.284 10.457 10.378 1.00 10.60 H new ATOM 0 HB ILE A 58 16.387 9.353 9.187 1.00 9.96 H new ATOM 0 HG12 ILE A 58 18.237 9.486 6.789 1.00 8.86 H new ATOM 0 HG13 ILE A 58 17.779 8.017 7.628 1.00 8.86 H new ATOM 0 HG21 ILE A 58 15.929 11.249 7.682 1.00 10.22 H new ATOM 0 HG22 ILE A 58 16.606 11.788 9.237 1.00 10.22 H new ATOM 0 HG23 ILE A 58 17.636 11.738 7.787 1.00 10.22 H new ATOM 0 HD11 ILE A 58 16.463 8.311 5.595 1.00 8.44 H new ATOM 0 HD12 ILE A 58 15.419 8.396 7.033 1.00 8.44 H new ATOM 0 HD13 ILE A 58 15.883 9.888 6.182 1.00 8.44 H new ATOM 933 N LEU A 59 19.426 7.560 9.265 1.00 9.90 N ATOM 934 CA LEU A 59 19.760 6.188 9.667 1.00 9.98 C ATOM 935 C LEU A 59 20.262 6.128 11.104 1.00 11.20 C ATOM 936 O LEU A 59 19.798 5.317 11.903 1.00 11.84 O ATOM 937 CB LEU A 59 20.827 5.594 8.741 1.00 9.07 C ATOM 938 CG LEU A 59 20.320 5.063 7.400 1.00 7.91 C ATOM 939 CD1 LEU A 59 21.480 4.583 6.540 1.00 7.28 C ATOM 940 CD2 LEU A 59 19.332 3.930 7.624 1.00 7.92 C ATOM 0 H LEU A 59 19.797 7.831 8.355 1.00 9.90 H new ATOM 0 HA LEU A 59 18.842 5.605 9.592 1.00 9.98 H new ATOM 0 HB2 LEU A 59 21.580 6.358 8.547 1.00 9.07 H new ATOM 0 HB3 LEU A 59 21.327 4.781 9.267 1.00 9.07 H new ATOM 0 HG LEU A 59 19.815 5.875 6.877 1.00 7.91 H new ATOM 0 HD11 LEU A 59 21.098 4.209 5.590 1.00 7.28 H new ATOM 0 HD12 LEU A 59 22.163 5.412 6.355 1.00 7.28 H new ATOM 0 HD13 LEU A 59 22.010 3.784 7.058 1.00 7.28 H new ATOM 0 HD21 LEU A 59 18.978 3.560 6.662 1.00 7.92 H new ATOM 0 HD22 LEU A 59 19.823 3.121 8.165 1.00 7.92 H new ATOM 0 HD23 LEU A 59 18.486 4.295 8.206 1.00 7.92 H new ATOM 952 N LYS A 60 21.197 7.003 11.429 1.00 11.67 N ATOM 953 CA LYS A 60 21.807 7.011 12.751 1.00 12.90 C ATOM 954 C LYS A 60 20.911 7.700 13.777 1.00 13.86 C ATOM 955 O LYS A 60 21.080 7.519 14.982 1.00 14.91 O ATOM 956 CB LYS A 60 23.178 7.686 12.682 1.00 13.23 C ATOM 957 CG LYS A 60 23.121 9.123 12.193 1.00 13.20 C ATOM 958 CD LYS A 60 24.418 9.545 11.527 1.00 13.44 C ATOM 959 CE LYS A 60 25.597 9.495 12.487 1.00 14.35 C ATOM 960 NZ LYS A 60 26.874 9.858 11.817 1.00 14.91 N ATOM 0 H LYS A 60 21.552 7.719 10.796 1.00 11.67 H new ATOM 0 HA LYS A 60 21.935 5.979 13.078 1.00 12.90 H new ATOM 0 HB2 LYS A 60 23.635 7.665 13.671 1.00 13.23 H new ATOM 0 HB3 LYS A 60 23.825 7.110 12.020 1.00 13.23 H new ATOM 0 HG2 LYS A 60 22.298 9.234 11.488 1.00 13.20 H new ATOM 0 HG3 LYS A 60 22.912 9.785 13.034 1.00 13.20 H new ATOM 0 HD2 LYS A 60 24.616 8.894 10.676 1.00 13.44 H new ATOM 0 HD3 LYS A 60 24.312 10.557 11.136 1.00 13.44 H new ATOM 0 HE2 LYS A 60 25.417 10.176 13.319 1.00 14.35 H new ATOM 0 HE3 LYS A 60 25.680 8.493 12.908 1.00 14.35 H new ATOM 0 HZ1 LYS A 60 27.652 9.812 12.505 1.00 14.91 H new ATOM 0 HZ2 LYS A 60 27.059 9.193 11.039 1.00 14.91 H new ATOM 0 HZ3 LYS A 60 26.805 10.824 11.437 1.00 14.91 H new ATOM 974 N ALA A 61 19.963 8.490 13.297 1.00 13.54 N ATOM 975 CA ALA A 61 19.044 9.198 14.176 1.00 14.41 C ATOM 976 C ALA A 61 17.908 8.289 14.628 1.00 14.65 C ATOM 977 O ALA A 61 17.532 8.285 15.801 1.00 15.64 O ATOM 978 CB ALA A 61 18.486 10.432 13.483 1.00 14.06 C ATOM 0 H ALA A 61 19.809 8.657 12.303 1.00 13.54 H new ATOM 0 HA ALA A 61 19.601 9.513 15.059 1.00 14.41 H new ATOM 0 HB1 ALA A 61 17.801 10.948 14.155 1.00 14.06 H new ATOM 0 HB2 ALA A 61 19.304 11.100 13.215 1.00 14.06 H new ATOM 0 HB3 ALA A 61 17.952 10.133 12.581 1.00 14.06 H new ATOM 984 N LEU A 62 17.368 7.507 13.701 1.00 13.84 N ATOM 985 CA LEU A 62 16.222 6.653 14.003 1.00 14.21 C ATOM 986 C LEU A 62 16.632 5.207 14.206 1.00 14.97 C ATOM 987 O LEU A 62 15.788 4.354 14.450 1.00 15.72 O ATOM 988 CB LEU A 62 15.150 6.746 12.911 1.00 13.37 C ATOM 989 CG LEU A 62 15.648 6.752 11.459 1.00 12.15 C ATOM 990 CD1 LEU A 62 16.022 5.352 10.993 1.00 11.39 C ATOM 991 CD2 LEU A 62 14.594 7.353 10.542 1.00 12.25 C ATOM 0 H LEU A 62 17.701 7.445 12.739 1.00 13.84 H new ATOM 0 HA LEU A 62 15.799 7.020 14.938 1.00 14.21 H new ATOM 0 HB2 LEU A 62 14.465 5.907 13.033 1.00 13.37 H new ATOM 0 HB3 LEU A 62 14.572 7.655 13.077 1.00 13.37 H new ATOM 0 HG LEU A 62 16.547 7.367 11.416 1.00 12.15 H new ATOM 0 HD11 LEU A 62 16.370 5.393 9.961 1.00 11.39 H new ATOM 0 HD12 LEU A 62 16.815 4.957 11.628 1.00 11.39 H new ATOM 0 HD13 LEU A 62 15.149 4.702 11.056 1.00 11.39 H new ATOM 0 HD21 LEU A 62 14.961 7.351 9.516 1.00 12.25 H new ATOM 0 HD22 LEU A 62 13.680 6.762 10.602 1.00 12.25 H new ATOM 0 HD23 LEU A 62 14.385 8.377 10.850 1.00 12.25 H new ATOM 1003 N GLY A 63 17.927 4.955 14.104 1.00 14.89 N ATOM 1004 CA GLY A 63 18.477 3.620 14.314 1.00 15.66 C ATOM 1005 C GLY A 63 17.887 2.886 15.515 1.00 16.04 C ATOM 1006 O GLY A 63 17.434 1.754 15.372 1.00 16.17 O ATOM 0 H GLY A 63 18.625 5.663 13.875 1.00 14.89 H new ATOM 0 HA2 GLY A 63 18.307 3.023 13.418 1.00 15.66 H new ATOM 0 HA3 GLY A 63 19.556 3.699 14.444 1.00 15.66 H new ATOM 1010 N PRO A 64 17.889 3.491 16.717 1.00 16.36 N ATOM 1011 CA PRO A 64 17.297 2.883 17.922 1.00 16.89 C ATOM 1012 C PRO A 64 15.834 2.467 17.745 1.00 16.41 C ATOM 1013 O PRO A 64 15.403 1.444 18.277 1.00 16.65 O ATOM 1014 CB PRO A 64 17.386 3.995 18.973 1.00 17.44 C ATOM 1015 CG PRO A 64 17.718 5.237 18.216 1.00 16.99 C ATOM 1016 CD PRO A 64 18.503 4.787 17.026 1.00 16.40 C ATOM 0 HA PRO A 64 17.822 1.965 18.184 1.00 16.89 H new ATOM 0 HB2 PRO A 64 16.444 4.103 19.510 1.00 17.44 H new ATOM 0 HB3 PRO A 64 18.152 3.772 19.716 1.00 17.44 H new ATOM 0 HG2 PRO A 64 16.814 5.764 17.912 1.00 16.99 H new ATOM 0 HG3 PRO A 64 18.298 5.927 18.830 1.00 16.99 H new ATOM 0 HD2 PRO A 64 18.417 5.486 16.194 1.00 16.40 H new ATOM 0 HD3 PRO A 64 19.565 4.690 17.252 1.00 16.40 H new ATOM 1024 N GLY A 65 15.072 3.260 17.001 1.00 15.83 N ATOM 1025 CA GLY A 65 13.655 2.984 16.829 1.00 15.53 C ATOM 1026 C GLY A 65 13.368 2.232 15.548 1.00 14.59 C ATOM 1027 O GLY A 65 12.226 1.857 15.274 1.00 14.42 O ATOM 0 H GLY A 65 15.409 4.090 16.513 1.00 15.83 H new ATOM 0 HA2 GLY A 65 13.295 2.402 17.678 1.00 15.53 H new ATOM 0 HA3 GLY A 65 13.102 3.923 16.828 1.00 15.53 H new ATOM 1031 N ALA A 66 14.404 2.029 14.758 1.00 14.15 N ATOM 1032 CA ALA A 66 14.288 1.301 13.506 1.00 13.39 C ATOM 1033 C ALA A 66 15.220 0.095 13.503 1.00 13.11 C ATOM 1034 O ALA A 66 16.435 0.236 13.394 1.00 12.58 O ATOM 1035 CB ALA A 66 14.605 2.225 12.343 1.00 12.24 C ATOM 0 H ALA A 66 15.346 2.361 14.963 1.00 14.15 H new ATOM 0 HA ALA A 66 13.265 0.939 13.399 1.00 13.39 H new ATOM 0 HB1 ALA A 66 14.517 1.674 11.406 1.00 12.24 H new ATOM 0 HB2 ALA A 66 13.905 3.060 12.340 1.00 12.24 H new ATOM 0 HB3 ALA A 66 15.622 2.604 12.446 1.00 12.24 H new ATOM 1041 N THR A 67 14.625 -1.091 13.610 1.00 13.60 N ATOM 1042 CA THR A 67 15.377 -2.337 13.725 1.00 13.52 C ATOM 1043 C THR A 67 16.286 -2.588 12.518 1.00 12.33 C ATOM 1044 O THR A 67 17.508 -2.472 12.618 1.00 11.64 O ATOM 1045 CB THR A 67 14.423 -3.535 13.904 1.00 14.67 C ATOM 1046 OG1 THR A 67 13.489 -3.258 14.955 1.00 15.33 O ATOM 1047 CG2 THR A 67 15.193 -4.806 14.230 1.00 15.45 C ATOM 0 H THR A 67 13.613 -1.215 13.619 1.00 13.60 H new ATOM 0 HA THR A 67 16.011 -2.235 14.606 1.00 13.52 H new ATOM 0 HB THR A 67 13.889 -3.687 12.966 1.00 14.67 H new ATOM 0 HG1 THR A 67 12.673 -2.872 14.574 1.00 15.33 H new ATOM 0 HG21 THR A 67 14.494 -5.634 14.351 1.00 15.45 H new ATOM 0 HG22 THR A 67 15.885 -5.031 13.418 1.00 15.45 H new ATOM 0 HG23 THR A 67 15.752 -4.665 15.155 1.00 15.45 H new ATOM 1055 N LEU A 68 15.698 -2.949 11.386 1.00 12.22 N ATOM 1056 CA LEU A 68 16.483 -3.225 10.190 1.00 11.25 C ATOM 1057 C LEU A 68 15.682 -2.852 8.954 1.00 11.10 C ATOM 1058 O LEU A 68 16.119 -2.046 8.131 1.00 10.12 O ATOM 1059 CB LEU A 68 16.889 -4.711 10.161 1.00 11.69 C ATOM 1060 CG LEU A 68 17.964 -5.116 9.134 1.00 10.84 C ATOM 1061 CD1 LEU A 68 17.391 -5.200 7.726 1.00 10.70 C ATOM 1062 CD2 LEU A 68 19.135 -4.143 9.171 1.00 9.79 C ATOM 0 H LEU A 68 14.690 -3.057 11.270 1.00 12.22 H new ATOM 0 HA LEU A 68 17.393 -2.625 10.203 1.00 11.25 H new ATOM 0 HB2 LEU A 68 17.247 -4.985 11.154 1.00 11.69 H new ATOM 0 HB3 LEU A 68 15.995 -5.304 9.969 1.00 11.69 H new ATOM 0 HG LEU A 68 18.322 -6.108 9.408 1.00 10.84 H new ATOM 0 HD11 LEU A 68 18.178 -5.488 7.029 1.00 10.70 H new ATOM 0 HD12 LEU A 68 16.594 -5.944 7.701 1.00 10.70 H new ATOM 0 HD13 LEU A 68 16.989 -4.228 7.438 1.00 10.70 H new ATOM 0 HD21 LEU A 68 19.883 -4.446 8.439 1.00 9.79 H new ATOM 0 HD22 LEU A 68 18.782 -3.139 8.935 1.00 9.79 H new ATOM 0 HD23 LEU A 68 19.579 -4.146 10.166 1.00 9.79 H new ATOM 1074 N GLU A 69 14.490 -3.407 8.850 1.00 12.16 N ATOM 1075 CA GLU A 69 13.626 -3.140 7.719 1.00 12.26 C ATOM 1076 C GLU A 69 13.011 -1.764 7.880 1.00 11.96 C ATOM 1077 O GLU A 69 12.705 -1.080 6.905 1.00 11.57 O ATOM 1078 CB GLU A 69 12.528 -4.208 7.599 1.00 13.61 C ATOM 1079 CG GLU A 69 11.595 -4.298 8.805 1.00 14.60 C ATOM 1080 CD GLU A 69 12.273 -4.844 10.048 1.00 15.86 C ATOM 1081 OE1 GLU A 69 12.259 -6.081 10.247 1.00 16.53 O ATOM 1082 OE2 GLU A 69 12.812 -4.041 10.834 1.00 16.24 O ATOM 0 H GLU A 69 14.097 -4.048 9.539 1.00 12.16 H new ATOM 0 HA GLU A 69 14.218 -3.172 6.804 1.00 12.26 H new ATOM 0 HB2 GLU A 69 11.933 -4.000 6.710 1.00 13.61 H new ATOM 0 HB3 GLU A 69 12.999 -5.179 7.447 1.00 13.61 H new ATOM 0 HG2 GLU A 69 11.197 -3.307 9.022 1.00 14.60 H new ATOM 0 HG3 GLU A 69 10.747 -4.934 8.553 1.00 14.60 H new ATOM 1089 N GLU A 70 12.862 -1.364 9.131 1.00 12.26 N ATOM 1090 CA GLU A 70 12.304 -0.072 9.466 1.00 12.19 C ATOM 1091 C GLU A 70 13.220 1.048 8.989 1.00 10.92 C ATOM 1092 O GLU A 70 12.769 1.991 8.348 1.00 10.57 O ATOM 1093 CB GLU A 70 12.089 0.014 10.972 1.00 13.06 C ATOM 1094 CG GLU A 70 11.429 -1.226 11.546 1.00 14.21 C ATOM 1095 CD GLU A 70 11.073 -1.078 13.004 1.00 15.02 C ATOM 1096 OE1 GLU A 70 9.987 -0.536 13.301 1.00 15.56 O ATOM 1097 OE2 GLU A 70 11.875 -1.509 13.859 1.00 15.23 O ATOM 0 H GLU A 70 13.125 -1.927 9.940 1.00 12.26 H new ATOM 0 HA GLU A 70 11.344 0.043 8.962 1.00 12.19 H new ATOM 0 HB2 GLU A 70 13.050 0.168 11.463 1.00 13.06 H new ATOM 0 HB3 GLU A 70 11.473 0.885 11.197 1.00 13.06 H new ATOM 0 HG2 GLU A 70 10.526 -1.448 10.977 1.00 14.21 H new ATOM 0 HG3 GLU A 70 12.099 -2.077 11.425 1.00 14.21 H new ATOM 1104 N MET A 71 14.515 0.928 9.276 1.00 10.30 N ATOM 1105 CA MET A 71 15.475 1.942 8.845 1.00 9.14 C ATOM 1106 C MET A 71 15.643 1.901 7.331 1.00 8.31 C ATOM 1107 O MET A 71 15.944 2.910 6.702 1.00 7.58 O ATOM 1108 CB MET A 71 16.837 1.767 9.536 1.00 8.85 C ATOM 1109 CG MET A 71 17.539 0.457 9.216 1.00 8.69 C ATOM 1110 SD MET A 71 19.235 0.405 9.833 1.00 8.41 S ATOM 1111 CE MET A 71 18.982 0.737 11.575 1.00 8.50 C ATOM 0 H MET A 71 14.919 0.150 9.798 1.00 10.30 H new ATOM 0 HA MET A 71 15.079 2.915 9.135 1.00 9.14 H new ATOM 0 HB2 MET A 71 17.486 2.593 9.247 1.00 8.85 H new ATOM 0 HB3 MET A 71 16.695 1.835 10.615 1.00 8.85 H new ATOM 0 HG2 MET A 71 16.974 -0.368 9.649 1.00 8.69 H new ATOM 0 HG3 MET A 71 17.545 0.307 8.136 1.00 8.69 H new ATOM 0 HE1 MET A 71 19.939 0.701 12.095 1.00 8.50 H new ATOM 0 HE2 MET A 71 18.540 1.726 11.696 1.00 8.50 H new ATOM 0 HE3 MET A 71 18.313 -0.014 11.995 1.00 8.50 H new ATOM 1121 N MET A 72 15.429 0.726 6.751 1.00 8.67 N ATOM 1122 CA MET A 72 15.494 0.574 5.307 1.00 8.32 C ATOM 1123 C MET A 72 14.315 1.283 4.658 1.00 8.63 C ATOM 1124 O MET A 72 14.469 1.984 3.659 1.00 8.10 O ATOM 1125 CB MET A 72 15.502 -0.908 4.928 1.00 9.08 C ATOM 1126 CG MET A 72 15.657 -1.159 3.435 1.00 9.10 C ATOM 1127 SD MET A 72 15.719 -2.915 3.028 1.00 10.28 S ATOM 1128 CE MET A 72 14.087 -3.450 3.542 1.00 11.15 C ATOM 0 H MET A 72 15.210 -0.131 7.258 1.00 8.67 H new ATOM 0 HA MET A 72 16.418 1.025 4.945 1.00 8.32 H new ATOM 0 HB2 MET A 72 16.316 -1.404 5.457 1.00 9.08 H new ATOM 0 HB3 MET A 72 14.574 -1.366 5.270 1.00 9.08 H new ATOM 0 HG2 MET A 72 14.825 -0.696 2.904 1.00 9.10 H new ATOM 0 HG3 MET A 72 16.568 -0.676 3.082 1.00 9.10 H new ATOM 0 HE1 MET A 72 13.751 -4.263 2.899 1.00 11.15 H new ATOM 0 HE2 MET A 72 14.126 -3.797 4.575 1.00 11.15 H new ATOM 0 HE3 MET A 72 13.390 -2.616 3.466 1.00 11.15 H new ATOM 1138 N THR A 73 13.146 1.109 5.254 1.00 9.62 N ATOM 1139 CA THR A 73 11.930 1.755 4.781 1.00 10.09 C ATOM 1140 C THR A 73 11.992 3.261 5.035 1.00 9.53 C ATOM 1141 O THR A 73 11.478 4.060 4.251 1.00 9.49 O ATOM 1142 CB THR A 73 10.685 1.162 5.478 1.00 11.37 C ATOM 1143 OG1 THR A 73 10.675 -0.266 5.327 1.00 12.02 O ATOM 1144 CG2 THR A 73 9.403 1.740 4.899 1.00 11.93 C ATOM 0 H THR A 73 13.013 0.519 6.075 1.00 9.62 H new ATOM 0 HA THR A 73 11.850 1.575 3.709 1.00 10.09 H new ATOM 0 HB THR A 73 10.735 1.422 6.535 1.00 11.37 H new ATOM 0 HG1 THR A 73 11.291 -0.668 5.975 1.00 12.02 H new ATOM 0 HG21 THR A 73 8.544 1.304 5.409 1.00 11.93 H new ATOM 0 HG22 THR A 73 9.396 2.821 5.037 1.00 11.93 H new ATOM 0 HG23 THR A 73 9.348 1.510 3.835 1.00 11.93 H new ATOM 1152 N ALA A 74 12.650 3.639 6.129 1.00 9.27 N ATOM 1153 CA ALA A 74 12.834 5.040 6.481 1.00 9.02 C ATOM 1154 C ALA A 74 13.589 5.785 5.387 1.00 8.01 C ATOM 1155 O ALA A 74 13.323 6.958 5.115 1.00 8.00 O ATOM 1156 CB ALA A 74 13.579 5.150 7.801 1.00 9.32 C ATOM 0 H ALA A 74 13.067 2.985 6.791 1.00 9.27 H new ATOM 0 HA ALA A 74 11.851 5.499 6.585 1.00 9.02 H new ATOM 0 HB1 ALA A 74 13.712 6.201 8.057 1.00 9.32 H new ATOM 0 HB2 ALA A 74 13.005 4.656 8.585 1.00 9.32 H new ATOM 0 HB3 ALA A 74 14.554 4.672 7.709 1.00 9.32 H new ATOM 1162 N CYS A 75 14.525 5.093 4.757 1.00 7.31 N ATOM 1163 CA CYS A 75 15.325 5.681 3.696 1.00 6.51 C ATOM 1164 C CYS A 75 14.736 5.372 2.321 1.00 6.63 C ATOM 1165 O CYS A 75 15.240 5.838 1.298 1.00 6.46 O ATOM 1166 CB CYS A 75 16.760 5.179 3.794 1.00 5.86 C ATOM 1167 SG CYS A 75 17.546 5.552 5.376 1.00 6.16 S ATOM 0 H CYS A 75 14.749 4.120 4.964 1.00 7.31 H new ATOM 0 HA CYS A 75 15.318 6.764 3.818 1.00 6.51 H new ATOM 0 HB2 CYS A 75 16.771 4.100 3.637 1.00 5.86 H new ATOM 0 HB3 CYS A 75 17.348 5.624 2.991 1.00 5.86 H new ATOM 0 HG CYS A 75 18.597 6.291 5.175 1.00 6.16 H new ATOM 1173 N GLN A 76 13.682 4.571 2.288 1.00 7.27 N ATOM 1174 CA GLN A 76 12.936 4.371 1.062 1.00 7.76 C ATOM 1175 C GLN A 76 11.990 5.540 0.859 1.00 8.19 C ATOM 1176 O GLN A 76 11.062 5.741 1.642 1.00 8.73 O ATOM 1177 CB GLN A 76 12.157 3.057 1.102 1.00 8.60 C ATOM 1178 CG GLN A 76 13.025 1.828 0.902 1.00 9.19 C ATOM 1179 CD GLN A 76 12.241 0.535 1.011 1.00 10.10 C ATOM 1180 OE1 GLN A 76 11.282 0.441 1.772 1.00 10.49 O ATOM 1181 NE2 GLN A 76 12.624 -0.458 0.226 1.00 10.66 N ATOM 0 H GLN A 76 13.328 4.053 3.092 1.00 7.27 H new ATOM 0 HA GLN A 76 13.635 4.316 0.227 1.00 7.76 H new ATOM 0 HB2 GLN A 76 11.645 2.977 2.061 1.00 8.60 H new ATOM 0 HB3 GLN A 76 11.387 3.077 0.330 1.00 8.60 H new ATOM 0 HG2 GLN A 76 13.500 1.879 -0.078 1.00 9.19 H new ATOM 0 HG3 GLN A 76 13.824 1.828 1.644 1.00 9.19 H new ATOM 0 HE21 GLN A 76 13.427 -0.339 -0.392 1.00 10.66 H new ATOM 0 HE22 GLN A 76 12.117 -1.343 0.239 1.00 10.66 H new ATOM 1190 N GLY A 77 12.231 6.309 -0.194 1.00 8.13 N ATOM 1191 CA GLY A 77 11.462 7.508 -0.422 1.00 8.58 C ATOM 1192 C GLY A 77 11.661 8.513 0.692 1.00 8.30 C ATOM 1193 O GLY A 77 10.748 8.764 1.474 1.00 8.85 O ATOM 0 H GLY A 77 12.948 6.120 -0.894 1.00 8.13 H new ATOM 0 HA2 GLY A 77 11.754 7.954 -1.373 1.00 8.58 H new ATOM 0 HA3 GLY A 77 10.405 7.254 -0.500 1.00 8.58 H new ATOM 1197 N VAL A 78 12.870 9.067 0.774 1.00 7.65 N ATOM 1198 CA VAL A 78 13.211 10.036 1.815 1.00 7.69 C ATOM 1199 C VAL A 78 12.264 11.231 1.770 1.00 8.18 C ATOM 1200 O VAL A 78 12.380 12.095 0.901 1.00 8.24 O ATOM 1201 CB VAL A 78 14.667 10.531 1.667 1.00 7.30 C ATOM 1202 CG1 VAL A 78 15.042 11.468 2.808 1.00 7.56 C ATOM 1203 CG2 VAL A 78 15.634 9.356 1.603 1.00 7.23 C ATOM 0 H VAL A 78 13.633 8.860 0.129 1.00 7.65 H new ATOM 0 HA VAL A 78 13.110 9.530 2.775 1.00 7.69 H new ATOM 0 HB VAL A 78 14.738 11.086 0.732 1.00 7.30 H new ATOM 0 HG11 VAL A 78 16.072 11.802 2.681 1.00 7.56 H new ATOM 0 HG12 VAL A 78 14.377 12.331 2.803 1.00 7.56 H new ATOM 0 HG13 VAL A 78 14.946 10.941 3.758 1.00 7.56 H new ATOM 0 HG21 VAL A 78 16.653 9.729 1.499 1.00 7.23 H new ATOM 0 HG22 VAL A 78 15.554 8.769 2.518 1.00 7.23 H new ATOM 0 HG23 VAL A 78 15.388 8.728 0.746 1.00 7.23 H new ATOM 1213 N GLY A 79 11.308 11.256 2.690 1.00 8.79 N ATOM 1214 CA GLY A 79 10.315 12.314 2.709 1.00 9.46 C ATOM 1215 C GLY A 79 9.383 12.245 1.513 1.00 9.86 C ATOM 1216 O GLY A 79 8.680 13.210 1.207 1.00 10.49 O ATOM 0 H GLY A 79 11.202 10.559 3.427 1.00 8.79 H new ATOM 0 HA2 GLY A 79 9.731 12.246 3.627 1.00 9.46 H new ATOM 0 HA3 GLY A 79 10.817 13.281 2.721 1.00 9.46 H new ATOM 1220 N GLY A 80 9.381 11.095 0.844 1.00 9.69 N ATOM 1221 CA GLY A 80 8.590 10.918 -0.357 1.00 10.31 C ATOM 1222 C GLY A 80 9.200 11.616 -1.561 1.00 10.42 C ATOM 1223 O GLY A 80 9.310 12.841 -1.571 1.00 10.24 O ATOM 0 H GLY A 80 9.921 10.274 1.119 1.00 9.69 H new ATOM 0 HA2 GLY A 80 8.490 9.854 -0.570 1.00 10.31 H new ATOM 0 HA3 GLY A 80 7.585 11.304 -0.187 1.00 10.31 H new ATOM 1227 N PRO A 81 9.599 10.861 -2.600 1.00 10.92 N ATOM 1228 CA PRO A 81 10.233 11.428 -3.803 1.00 11.29 C ATOM 1229 C PRO A 81 9.363 12.490 -4.474 1.00 11.16 C ATOM 1230 O PRO A 81 9.851 13.553 -4.867 1.00 11.39 O ATOM 1231 CB PRO A 81 10.399 10.219 -4.731 1.00 12.10 C ATOM 1232 CG PRO A 81 10.376 9.035 -3.829 1.00 12.10 C ATOM 1233 CD PRO A 81 9.462 9.398 -2.693 1.00 11.39 C ATOM 0 HA PRO A 81 11.170 11.931 -3.563 1.00 11.29 H new ATOM 0 HB2 PRO A 81 9.595 10.172 -5.465 1.00 12.10 H new ATOM 0 HB3 PRO A 81 11.335 10.274 -5.287 1.00 12.10 H new ATOM 0 HG2 PRO A 81 10.014 8.151 -4.354 1.00 12.10 H new ATOM 0 HG3 PRO A 81 11.377 8.802 -3.465 1.00 12.10 H new ATOM 0 HD2 PRO A 81 8.432 9.103 -2.895 1.00 11.39 H new ATOM 0 HD3 PRO A 81 9.758 8.907 -1.766 1.00 11.39 H new ATOM 1241 N GLY A 82 8.076 12.195 -4.597 1.00 10.99 N ATOM 1242 CA GLY A 82 7.152 13.137 -5.201 1.00 11.07 C ATOM 1243 C GLY A 82 6.251 13.783 -4.170 1.00 10.54 C ATOM 1244 O GLY A 82 5.213 14.361 -4.506 1.00 10.90 O ATOM 0 H GLY A 82 7.654 11.319 -4.289 1.00 10.99 H new ATOM 0 HA2 GLY A 82 7.713 13.909 -5.728 1.00 11.07 H new ATOM 0 HA3 GLY A 82 6.543 12.622 -5.944 1.00 11.07 H new ATOM 1248 N HIS A 83 6.643 13.684 -2.910 1.00 9.87 N ATOM 1249 CA HIS A 83 5.863 14.253 -1.820 1.00 9.50 C ATOM 1250 C HIS A 83 6.307 15.679 -1.552 1.00 9.01 C ATOM 1251 O HIS A 83 7.473 16.023 -1.728 1.00 8.60 O ATOM 1252 CB HIS A 83 6.011 13.420 -0.542 1.00 9.28 C ATOM 1253 CG HIS A 83 5.269 12.119 -0.558 1.00 9.71 C ATOM 1254 ND1 HIS A 83 4.365 11.759 0.418 1.00 9.88 N ATOM 1255 CD2 HIS A 83 5.323 11.075 -1.418 1.00 10.26 C ATOM 1256 CE1 HIS A 83 3.901 10.551 0.161 1.00 10.48 C ATOM 1257 NE2 HIS A 83 4.466 10.111 -0.948 1.00 10.71 N ATOM 0 H HIS A 83 7.499 13.214 -2.615 1.00 9.87 H new ATOM 0 HA HIS A 83 4.814 14.247 -2.117 1.00 9.50 H new ATOM 0 HB2 HIS A 83 7.069 13.218 -0.376 1.00 9.28 H new ATOM 0 HB3 HIS A 83 5.663 14.012 0.304 1.00 9.28 H new ATOM 0 HD2 HIS A 83 5.929 11.012 -2.310 1.00 10.26 H new ATOM 0 HE1 HIS A 83 3.180 10.012 0.758 1.00 10.48 H new ATOM 0 HE2 HIS A 83 4.294 9.205 -1.384 1.00 10.71 H new ATOM 1266 N LYS A 84 5.370 16.503 -1.116 1.00 9.30 N ATOM 1267 CA LYS A 84 5.650 17.907 -0.844 1.00 9.11 C ATOM 1268 C LYS A 84 6.262 18.042 0.540 1.00 8.52 C ATOM 1269 O LYS A 84 6.807 19.085 0.900 1.00 8.22 O ATOM 1270 CB LYS A 84 4.362 18.723 -0.935 1.00 9.97 C ATOM 1271 CG LYS A 84 3.506 18.348 -2.131 1.00 10.46 C ATOM 1272 CD LYS A 84 4.218 18.629 -3.447 1.00 11.30 C ATOM 1273 CE LYS A 84 3.436 18.089 -4.635 1.00 11.85 C ATOM 1274 NZ LYS A 84 3.363 16.603 -4.630 1.00 12.21 N ATOM 0 H LYS A 84 4.404 16.225 -0.941 1.00 9.30 H new ATOM 0 HA LYS A 84 6.354 18.286 -1.584 1.00 9.11 H new ATOM 0 HB2 LYS A 84 3.783 18.581 -0.022 1.00 9.97 H new ATOM 0 HB3 LYS A 84 4.613 19.782 -0.992 1.00 9.97 H new ATOM 0 HG2 LYS A 84 3.248 17.290 -2.076 1.00 10.46 H new ATOM 0 HG3 LYS A 84 2.570 18.906 -2.098 1.00 10.46 H new ATOM 0 HD2 LYS A 84 4.359 19.704 -3.562 1.00 11.30 H new ATOM 0 HD3 LYS A 84 5.210 18.177 -3.428 1.00 11.30 H new ATOM 0 HE2 LYS A 84 2.427 18.501 -4.621 1.00 11.85 H new ATOM 0 HE3 LYS A 84 3.905 18.425 -5.560 1.00 11.85 H new ATOM 0 HZ1 LYS A 84 3.021 16.269 -5.554 1.00 12.21 H new ATOM 0 HZ2 LYS A 84 4.308 16.210 -4.448 1.00 12.21 H new ATOM 0 HZ3 LYS A 84 2.709 16.290 -3.885 1.00 12.21 H new ATOM 1288 N ALA A 85 6.176 16.952 1.293 1.00 8.58 N ATOM 1289 CA ALA A 85 6.715 16.888 2.642 1.00 8.36 C ATOM 1290 C ALA A 85 8.204 17.184 2.642 1.00 7.63 C ATOM 1291 O ALA A 85 8.702 17.925 3.488 1.00 7.43 O ATOM 1292 CB ALA A 85 6.455 15.518 3.245 1.00 8.99 C ATOM 0 H ALA A 85 5.730 16.088 0.984 1.00 8.58 H new ATOM 0 HA ALA A 85 6.214 17.644 3.247 1.00 8.36 H new ATOM 0 HB1 ALA A 85 6.863 15.482 4.255 1.00 8.99 H new ATOM 0 HB2 ALA A 85 5.381 15.334 3.280 1.00 8.99 H new ATOM 0 HB3 ALA A 85 6.934 14.754 2.633 1.00 8.99 H new ATOM 1298 N ARG A 86 8.912 16.620 1.674 1.00 7.48 N ATOM 1299 CA ARG A 86 10.350 16.827 1.581 1.00 7.14 C ATOM 1300 C ARG A 86 10.669 18.272 1.224 1.00 6.68 C ATOM 1301 O ARG A 86 11.641 18.833 1.717 1.00 6.49 O ATOM 1302 CB ARG A 86 10.994 15.888 0.555 1.00 7.54 C ATOM 1303 CG ARG A 86 10.415 15.998 -0.847 1.00 7.94 C ATOM 1304 CD ARG A 86 11.376 15.450 -1.890 1.00 8.47 C ATOM 1305 NE ARG A 86 11.974 14.184 -1.469 1.00 9.09 N ATOM 1306 CZ ARG A 86 13.152 13.739 -1.896 1.00 9.85 C ATOM 1307 NH1 ARG A 86 13.813 14.393 -2.845 1.00 10.10 N ATOM 1308 NH2 ARG A 86 13.656 12.630 -1.380 1.00 10.56 N ATOM 0 H ARG A 86 8.519 16.021 0.948 1.00 7.48 H new ATOM 0 HA ARG A 86 10.768 16.600 2.562 1.00 7.14 H new ATOM 0 HB2 ARG A 86 12.063 16.096 0.511 1.00 7.54 H new ATOM 0 HB3 ARG A 86 10.883 14.860 0.901 1.00 7.54 H new ATOM 0 HG2 ARG A 86 9.473 15.453 -0.897 1.00 7.94 H new ATOM 0 HG3 ARG A 86 10.192 17.042 -1.069 1.00 7.94 H new ATOM 0 HD2 ARG A 86 10.846 15.306 -2.832 1.00 8.47 H new ATOM 0 HD3 ARG A 86 12.164 16.180 -2.076 1.00 8.47 H new ATOM 0 HE ARG A 86 11.456 13.607 -0.807 1.00 9.09 H new ATOM 0 HH11 ARG A 86 13.417 15.241 -3.250 1.00 10.10 H new ATOM 0 HH12 ARG A 86 14.716 14.047 -3.168 1.00 10.10 H new ATOM 0 HH21 ARG A 86 13.141 12.123 -0.660 1.00 10.56 H new ATOM 0 HH22 ARG A 86 14.559 12.282 -1.702 1.00 10.56 H new ATOM 1322 N VAL A 87 9.817 18.883 0.408 1.00 6.80 N ATOM 1323 CA VAL A 87 10.080 20.214 -0.116 1.00 6.75 C ATOM 1324 C VAL A 87 9.928 21.248 0.988 1.00 6.55 C ATOM 1325 O VAL A 87 10.647 22.247 1.036 1.00 6.49 O ATOM 1326 CB VAL A 87 9.130 20.550 -1.286 1.00 7.42 C ATOM 1327 CG1 VAL A 87 9.449 21.919 -1.872 1.00 7.80 C ATOM 1328 CG2 VAL A 87 9.209 19.475 -2.360 1.00 7.90 C ATOM 0 H VAL A 87 8.936 18.474 0.096 1.00 6.80 H new ATOM 0 HA VAL A 87 11.103 20.234 -0.491 1.00 6.75 H new ATOM 0 HB VAL A 87 8.111 20.579 -0.899 1.00 7.42 H new ATOM 0 HG11 VAL A 87 8.766 22.131 -2.694 1.00 7.80 H new ATOM 0 HG12 VAL A 87 9.336 22.680 -1.100 1.00 7.80 H new ATOM 0 HG13 VAL A 87 10.474 21.927 -2.241 1.00 7.80 H new ATOM 0 HG21 VAL A 87 8.533 19.727 -3.177 1.00 7.90 H new ATOM 0 HG22 VAL A 87 10.229 19.413 -2.738 1.00 7.90 H new ATOM 0 HG23 VAL A 87 8.921 18.514 -1.934 1.00 7.90 H new ATOM 1338 N LEU A 88 9.003 20.979 1.893 1.00 6.74 N ATOM 1339 CA LEU A 88 8.755 21.871 3.007 1.00 6.96 C ATOM 1340 C LEU A 88 9.766 21.602 4.108 1.00 6.75 C ATOM 1341 O LEU A 88 10.217 22.516 4.794 1.00 6.87 O ATOM 1342 CB LEU A 88 7.308 21.717 3.497 1.00 7.72 C ATOM 1343 CG LEU A 88 6.934 20.393 4.180 1.00 8.06 C ATOM 1344 CD1 LEU A 88 7.221 20.438 5.675 1.00 8.65 C ATOM 1345 CD2 LEU A 88 5.467 20.073 3.931 1.00 8.66 C ATOM 0 H LEU A 88 8.412 20.148 1.876 1.00 6.74 H new ATOM 0 HA LEU A 88 8.877 22.906 2.688 1.00 6.96 H new ATOM 0 HB2 LEU A 88 7.100 22.528 4.195 1.00 7.72 H new ATOM 0 HB3 LEU A 88 6.646 21.855 2.642 1.00 7.72 H new ATOM 0 HG LEU A 88 7.550 19.604 3.748 1.00 8.06 H new ATOM 0 HD11 LEU A 88 6.945 19.486 6.127 1.00 8.65 H new ATOM 0 HD12 LEU A 88 8.283 20.622 5.836 1.00 8.65 H new ATOM 0 HD13 LEU A 88 6.641 21.239 6.133 1.00 8.65 H new ATOM 0 HD21 LEU A 88 5.212 19.132 4.419 1.00 8.66 H new ATOM 0 HD22 LEU A 88 4.846 20.872 4.336 1.00 8.66 H new ATOM 0 HD23 LEU A 88 5.291 19.985 2.859 1.00 8.66 H new ATOM 1357 N ALA A 89 10.141 20.337 4.247 1.00 6.75 N ATOM 1358 CA ALA A 89 11.180 19.942 5.190 1.00 6.99 C ATOM 1359 C ALA A 89 12.509 20.597 4.834 1.00 6.71 C ATOM 1360 O ALA A 89 13.284 20.965 5.720 1.00 7.11 O ATOM 1361 CB ALA A 89 11.328 18.427 5.220 1.00 7.41 C ATOM 0 H ALA A 89 9.739 19.564 3.716 1.00 6.75 H new ATOM 0 HA ALA A 89 10.884 20.281 6.183 1.00 6.99 H new ATOM 0 HB1 ALA A 89 12.108 18.152 5.930 1.00 7.41 H new ATOM 0 HB2 ALA A 89 10.384 17.975 5.525 1.00 7.41 H new ATOM 0 HB3 ALA A 89 11.598 18.068 4.227 1.00 7.41 H new ATOM 1367 N GLU A 90 12.761 20.759 3.535 1.00 6.35 N ATOM 1368 CA GLU A 90 13.982 21.417 3.075 1.00 6.46 C ATOM 1369 C GLU A 90 13.985 22.883 3.491 1.00 6.45 C ATOM 1370 O GLU A 90 15.034 23.457 3.779 1.00 6.84 O ATOM 1371 CB GLU A 90 14.132 21.305 1.553 1.00 6.55 C ATOM 1372 CG GLU A 90 14.347 19.882 1.060 1.00 7.09 C ATOM 1373 CD GLU A 90 14.540 19.798 -0.442 1.00 7.80 C ATOM 1374 OE1 GLU A 90 15.675 19.528 -0.888 1.00 8.05 O ATOM 1375 OE2 GLU A 90 13.559 20.015 -1.184 1.00 8.34 O ATOM 0 H GLU A 90 12.141 20.446 2.788 1.00 6.35 H new ATOM 0 HA GLU A 90 14.828 20.912 3.541 1.00 6.46 H new ATOM 0 HB2 GLU A 90 13.240 21.713 1.078 1.00 6.55 H new ATOM 0 HB3 GLU A 90 14.973 21.921 1.234 1.00 6.55 H new ATOM 0 HG2 GLU A 90 15.220 19.459 1.557 1.00 7.09 H new ATOM 0 HG3 GLU A 90 13.491 19.271 1.345 1.00 7.09 H new ATOM 1382 N ALA A 91 12.799 23.475 3.557 1.00 6.32 N ATOM 1383 CA ALA A 91 12.660 24.873 3.928 1.00 6.63 C ATOM 1384 C ALA A 91 12.707 25.022 5.440 1.00 6.98 C ATOM 1385 O ALA A 91 13.246 25.997 5.971 1.00 7.39 O ATOM 1386 CB ALA A 91 11.366 25.443 3.374 1.00 6.88 C ATOM 0 H ALA A 91 11.917 23.004 3.357 1.00 6.32 H new ATOM 0 HA ALA A 91 13.491 25.433 3.499 1.00 6.63 H new ATOM 0 HB1 ALA A 91 11.278 26.491 3.661 1.00 6.88 H new ATOM 0 HB2 ALA A 91 11.369 25.364 2.287 1.00 6.88 H new ATOM 0 HB3 ALA A 91 10.521 24.884 3.776 1.00 6.88 H new ATOM 1392 N MET A 92 12.147 24.039 6.123 1.00 7.07 N ATOM 1393 CA MET A 92 12.157 24.012 7.580 1.00 7.77 C ATOM 1394 C MET A 92 13.578 23.840 8.096 1.00 8.07 C ATOM 1395 O MET A 92 13.985 24.485 9.061 1.00 8.75 O ATOM 1396 CB MET A 92 11.263 22.889 8.117 1.00 8.13 C ATOM 1397 CG MET A 92 9.773 23.080 7.853 1.00 8.95 C ATOM 1398 SD MET A 92 8.940 24.132 9.070 1.00 9.67 S ATOM 1399 CE MET A 92 9.587 25.759 8.680 1.00 10.32 C ATOM 0 H MET A 92 11.676 23.244 5.691 1.00 7.07 H new ATOM 0 HA MET A 92 11.762 24.963 7.937 1.00 7.77 H new ATOM 0 HB2 MET A 92 11.579 21.946 7.671 1.00 8.13 H new ATOM 0 HB3 MET A 92 11.419 22.801 9.192 1.00 8.13 H new ATOM 0 HG2 MET A 92 9.643 23.515 6.862 1.00 8.95 H new ATOM 0 HG3 MET A 92 9.289 22.104 7.839 1.00 8.95 H new ATOM 0 HE1 MET A 92 8.796 26.501 8.791 1.00 10.32 H new ATOM 0 HE2 MET A 92 10.406 25.997 9.359 1.00 10.32 H new ATOM 0 HE3 MET A 92 9.952 25.769 7.653 1.00 10.32 H new ATOM 1409 N SER A 93 14.330 22.968 7.441 1.00 7.80 N ATOM 1410 CA SER A 93 15.732 22.770 7.767 1.00 8.38 C ATOM 1411 C SER A 93 16.523 24.046 7.482 1.00 8.44 C ATOM 1412 O SER A 93 17.391 24.444 8.261 1.00 9.14 O ATOM 1413 CB SER A 93 16.288 21.599 6.950 1.00 8.44 C ATOM 1414 OG SER A 93 17.643 21.326 7.265 1.00 8.68 O ATOM 0 H SER A 93 13.989 22.384 6.677 1.00 7.80 H new ATOM 0 HA SER A 93 15.827 22.537 8.828 1.00 8.38 H new ATOM 0 HB2 SER A 93 15.686 20.709 7.136 1.00 8.44 H new ATOM 0 HB3 SER A 93 16.202 21.825 5.887 1.00 8.44 H new ATOM 0 HG SER A 93 17.692 20.535 7.842 1.00 8.68 H new ATOM 1420 N GLN A 94 16.170 24.710 6.388 1.00 7.90 N ATOM 1421 CA GLN A 94 16.912 25.869 5.908 1.00 8.16 C ATOM 1422 C GLN A 94 16.905 27.007 6.923 1.00 8.55 C ATOM 1423 O GLN A 94 17.937 27.627 7.173 1.00 9.08 O ATOM 1424 CB GLN A 94 16.329 26.341 4.577 1.00 7.85 C ATOM 1425 CG GLN A 94 17.148 27.421 3.894 1.00 8.03 C ATOM 1426 CD GLN A 94 16.526 27.893 2.597 1.00 8.38 C ATOM 1427 OE1 GLN A 94 15.305 27.880 2.441 1.00 8.64 O ATOM 1428 NE2 GLN A 94 17.358 28.311 1.658 1.00 8.68 N ATOM 0 H GLN A 94 15.366 24.462 5.811 1.00 7.90 H new ATOM 0 HA GLN A 94 17.950 25.568 5.765 1.00 8.16 H new ATOM 0 HB2 GLN A 94 16.242 25.486 3.906 1.00 7.85 H new ATOM 0 HB3 GLN A 94 15.320 26.717 4.747 1.00 7.85 H new ATOM 0 HG2 GLN A 94 17.258 28.269 4.569 1.00 8.03 H new ATOM 0 HG3 GLN A 94 18.150 27.040 3.694 1.00 8.03 H new ATOM 0 HE21 GLN A 94 18.364 28.305 1.828 1.00 8.68 H new ATOM 0 HE22 GLN A 94 16.994 28.639 0.763 1.00 8.68 H new ATOM 1437 N VAL A 95 15.751 27.268 7.515 1.00 8.52 N ATOM 1438 CA VAL A 95 15.626 28.354 8.477 1.00 9.16 C ATOM 1439 C VAL A 95 16.227 27.966 9.831 1.00 9.86 C ATOM 1440 O VAL A 95 16.673 28.824 10.595 1.00 10.49 O ATOM 1441 CB VAL A 95 14.147 28.785 8.654 1.00 9.36 C ATOM 1442 CG1 VAL A 95 13.301 27.647 9.203 1.00 9.64 C ATOM 1443 CG2 VAL A 95 14.038 30.014 9.547 1.00 9.49 C ATOM 0 H VAL A 95 14.890 26.746 7.348 1.00 8.52 H new ATOM 0 HA VAL A 95 16.185 29.202 8.080 1.00 9.16 H new ATOM 0 HB VAL A 95 13.761 29.045 7.668 1.00 9.36 H new ATOM 0 HG11 VAL A 95 12.270 27.982 9.315 1.00 9.64 H new ATOM 0 HG12 VAL A 95 13.336 26.803 8.514 1.00 9.64 H new ATOM 0 HG13 VAL A 95 13.690 27.340 10.174 1.00 9.64 H new ATOM 0 HG21 VAL A 95 12.990 30.294 9.654 1.00 9.49 H new ATOM 0 HG22 VAL A 95 14.455 29.789 10.528 1.00 9.49 H new ATOM 0 HG23 VAL A 95 14.590 30.840 9.099 1.00 9.49 H new ATOM 1453 N THR A 96 16.274 26.672 10.110 1.00 9.91 N ATOM 1454 CA THR A 96 16.705 26.199 11.414 1.00 10.78 C ATOM 1455 C THR A 96 18.227 26.107 11.520 1.00 11.00 C ATOM 1456 O THR A 96 18.822 26.641 12.458 1.00 11.80 O ATOM 1457 CB THR A 96 16.068 24.837 11.750 1.00 11.07 C ATOM 1458 OG1 THR A 96 14.642 24.926 11.612 1.00 10.84 O ATOM 1459 CG2 THR A 96 16.409 24.408 13.170 1.00 11.70 C ATOM 0 H THR A 96 16.020 25.934 9.453 1.00 9.91 H new ATOM 0 HA THR A 96 16.365 26.936 12.141 1.00 10.78 H new ATOM 0 HB THR A 96 16.466 24.094 11.058 1.00 11.07 H new ATOM 0 HG1 THR A 96 14.404 24.911 10.662 1.00 10.84 H new ATOM 0 HG21 THR A 96 15.946 23.444 13.380 1.00 11.70 H new ATOM 0 HG22 THR A 96 17.491 24.322 13.274 1.00 11.70 H new ATOM 0 HG23 THR A 96 16.035 25.151 13.874 1.00 11.70 H new ATOM 1467 N ASN A 97 18.857 25.452 10.561 1.00 10.45 N ATOM 1468 CA ASN A 97 20.299 25.247 10.626 1.00 10.82 C ATOM 1469 C ASN A 97 21.014 25.979 9.496 1.00 10.83 C ATOM 1470 O ASN A 97 20.570 25.968 8.345 1.00 10.47 O ATOM 1471 CB ASN A 97 20.658 23.753 10.604 1.00 10.70 C ATOM 1472 CG ASN A 97 20.224 23.043 9.335 1.00 11.05 C ATOM 1473 OD1 ASN A 97 20.943 23.033 8.336 1.00 11.34 O ATOM 1474 ND2 ASN A 97 19.060 22.412 9.381 1.00 11.26 N ATOM 0 H ASN A 97 18.403 25.057 9.737 1.00 10.45 H new ATOM 0 HA ASN A 97 20.638 25.664 11.574 1.00 10.82 H new ATOM 0 HB2 ASN A 97 21.736 23.645 10.720 1.00 10.70 H new ATOM 0 HB3 ASN A 97 20.195 23.264 11.461 1.00 10.70 H new ATOM 0 HD21 ASN A 97 18.729 21.892 8.568 1.00 11.26 H new ATOM 0 HD22 ASN A 97 18.495 22.446 10.229 1.00 11.26 H new ATOM 1481 N PRO A 98 22.138 26.636 9.824 1.00 11.40 N ATOM 1482 CA PRO A 98 22.947 27.374 8.851 1.00 11.59 C ATOM 1483 C PRO A 98 23.774 26.453 7.959 1.00 11.38 C ATOM 1484 O PRO A 98 24.487 26.907 7.070 1.00 11.57 O ATOM 1485 CB PRO A 98 23.864 28.223 9.730 1.00 12.45 C ATOM 1486 CG PRO A 98 24.009 27.439 10.985 1.00 12.70 C ATOM 1487 CD PRO A 98 22.699 26.727 11.186 1.00 12.08 C ATOM 0 HA PRO A 98 22.329 27.952 8.165 1.00 11.59 H new ATOM 0 HB2 PRO A 98 24.829 28.389 9.252 1.00 12.45 H new ATOM 0 HB3 PRO A 98 23.431 29.205 9.923 1.00 12.45 H new ATOM 0 HG2 PRO A 98 24.831 26.728 10.907 1.00 12.70 H new ATOM 0 HG3 PRO A 98 24.231 28.092 11.829 1.00 12.70 H new ATOM 0 HD2 PRO A 98 22.843 25.740 11.627 1.00 12.08 H new ATOM 0 HD3 PRO A 98 22.040 27.282 11.854 1.00 12.08 H new ATOM 1495 N ALA A 99 23.666 25.151 8.194 1.00 11.13 N ATOM 1496 CA ALA A 99 24.397 24.168 7.405 1.00 11.14 C ATOM 1497 C ALA A 99 23.837 24.089 5.989 1.00 10.78 C ATOM 1498 O ALA A 99 24.468 23.540 5.083 1.00 10.91 O ATOM 1499 CB ALA A 99 24.345 22.803 8.076 1.00 11.25 C ATOM 0 H ALA A 99 23.078 24.751 8.926 1.00 11.13 H new ATOM 0 HA ALA A 99 25.438 24.484 7.343 1.00 11.14 H new ATOM 0 HB1 ALA A 99 24.896 22.080 7.474 1.00 11.25 H new ATOM 0 HB2 ALA A 99 24.795 22.867 9.067 1.00 11.25 H new ATOM 0 HB3 ALA A 99 23.307 22.482 8.169 1.00 11.25 H new ATOM 1505 N THR A 100 22.663 24.675 5.800 1.00 10.51 N ATOM 1506 CA THR A 100 21.984 24.631 4.523 1.00 10.39 C ATOM 1507 C THR A 100 22.617 25.596 3.526 1.00 10.51 C ATOM 1508 O THR A 100 22.540 25.390 2.317 1.00 10.58 O ATOM 1509 CB THR A 100 20.486 24.938 4.686 1.00 10.40 C ATOM 1510 OG1 THR A 100 20.308 26.052 5.576 1.00 10.60 O ATOM 1511 CG2 THR A 100 19.747 23.719 5.220 1.00 10.63 C ATOM 0 H THR A 100 22.162 25.189 6.524 1.00 10.51 H new ATOM 0 HA THR A 100 22.089 23.620 4.131 1.00 10.39 H new ATOM 0 HB THR A 100 20.074 25.192 3.710 1.00 10.40 H new ATOM 0 HG1 THR A 100 20.312 25.734 6.503 1.00 10.60 H new ATOM 0 HG21 THR A 100 18.688 23.954 5.329 1.00 10.63 H new ATOM 0 HG22 THR A 100 19.864 22.889 4.524 1.00 10.63 H new ATOM 0 HG23 THR A 100 20.159 23.440 6.190 1.00 10.63 H new ATOM 1519 N ILE A 101 23.268 26.641 4.033 1.00 10.71 N ATOM 1520 CA ILE A 101 23.968 27.576 3.154 1.00 11.06 C ATOM 1521 C ILE A 101 25.316 26.998 2.745 1.00 11.17 C ATOM 1522 O ILE A 101 25.827 27.286 1.662 1.00 11.41 O ATOM 1523 CB ILE A 101 24.183 28.972 3.788 1.00 11.57 C ATOM 1524 CG1 ILE A 101 25.152 28.900 4.971 1.00 11.88 C ATOM 1525 CG2 ILE A 101 22.853 29.567 4.225 1.00 11.78 C ATOM 1526 CD1 ILE A 101 25.520 30.255 5.539 1.00 12.53 C ATOM 0 H ILE A 101 23.326 26.860 5.028 1.00 10.71 H new ATOM 0 HA ILE A 101 23.328 27.714 2.283 1.00 11.06 H new ATOM 0 HB ILE A 101 24.625 29.620 3.032 1.00 11.57 H new ATOM 0 HG12 ILE A 101 24.705 28.295 5.759 1.00 11.88 H new ATOM 0 HG13 ILE A 101 26.061 28.389 4.654 1.00 11.88 H new ATOM 0 HG21 ILE A 101 23.022 30.548 4.669 1.00 11.78 H new ATOM 0 HG22 ILE A 101 22.198 29.668 3.360 1.00 11.78 H new ATOM 0 HG23 ILE A 101 22.385 28.912 4.960 1.00 11.78 H new ATOM 0 HD11 ILE A 101 26.209 30.125 6.373 1.00 12.53 H new ATOM 0 HD12 ILE A 101 25.997 30.857 4.765 1.00 12.53 H new ATOM 0 HD13 ILE A 101 24.619 30.760 5.888 1.00 12.53 H new ATOM 1538 N MET A 102 25.874 26.158 3.608 1.00 11.16 N ATOM 1539 CA MET A 102 27.143 25.510 3.328 1.00 11.48 C ATOM 1540 C MET A 102 26.970 24.499 2.202 1.00 11.29 C ATOM 1541 O MET A 102 27.777 24.436 1.275 1.00 11.61 O ATOM 1542 CB MET A 102 27.684 24.828 4.587 1.00 11.78 C ATOM 1543 CG MET A 102 29.062 24.212 4.406 1.00 12.25 C ATOM 1544 SD MET A 102 30.313 25.432 3.963 1.00 12.74 S ATOM 1545 CE MET A 102 31.772 24.397 3.878 1.00 13.25 C ATOM 0 H MET A 102 25.464 25.911 4.509 1.00 11.16 H new ATOM 0 HA MET A 102 27.864 26.264 3.014 1.00 11.48 H new ATOM 0 HB2 MET A 102 27.726 25.558 5.395 1.00 11.78 H new ATOM 0 HB3 MET A 102 26.986 24.050 4.896 1.00 11.78 H new ATOM 0 HG2 MET A 102 29.357 23.713 5.329 1.00 12.25 H new ATOM 0 HG3 MET A 102 29.015 23.447 3.631 1.00 12.25 H new ATOM 0 HE1 MET A 102 32.636 25.007 3.613 1.00 13.25 H new ATOM 0 HE2 MET A 102 31.942 23.928 4.847 1.00 13.25 H new ATOM 0 HE3 MET A 102 31.627 23.625 3.122 1.00 13.25 H new ATOM 1555 N ILE A 103 25.885 23.733 2.267 1.00 10.93 N ATOM 1556 CA ILE A 103 25.584 22.754 1.232 1.00 10.95 C ATOM 1557 C ILE A 103 25.053 23.465 -0.016 1.00 10.91 C ATOM 1558 O ILE A 103 25.065 22.916 -1.118 1.00 11.12 O ATOM 1559 CB ILE A 103 24.573 21.690 1.730 1.00 10.89 C ATOM 1560 CG1 ILE A 103 24.453 20.538 0.727 1.00 11.10 C ATOM 1561 CG2 ILE A 103 23.209 22.315 1.986 1.00 11.06 C ATOM 1562 CD1 ILE A 103 23.583 19.398 1.209 1.00 11.41 C ATOM 0 H ILE A 103 25.202 23.772 3.024 1.00 10.93 H new ATOM 0 HA ILE A 103 26.506 22.230 0.979 1.00 10.95 H new ATOM 0 HB ILE A 103 24.948 21.288 2.671 1.00 10.89 H new ATOM 0 HG12 ILE A 103 24.046 20.923 -0.208 1.00 11.10 H new ATOM 0 HG13 ILE A 103 25.449 20.155 0.507 1.00 11.10 H new ATOM 0 HG21 ILE A 103 22.517 21.548 2.335 1.00 11.06 H new ATOM 0 HG22 ILE A 103 23.302 23.092 2.745 1.00 11.06 H new ATOM 0 HG23 ILE A 103 22.830 22.753 1.062 1.00 11.06 H new ATOM 0 HD11 ILE A 103 23.546 18.621 0.446 1.00 11.41 H new ATOM 0 HD12 ILE A 103 24.000 18.985 2.128 1.00 11.41 H new ATOM 0 HD13 ILE A 103 22.575 19.766 1.401 1.00 11.41 H new ATOM 1574 N GLN A 104 24.604 24.706 0.168 1.00 10.83 N ATOM 1575 CA GLN A 104 24.162 25.535 -0.944 1.00 11.03 C ATOM 1576 C GLN A 104 25.377 25.982 -1.752 1.00 11.28 C ATOM 1577 O GLN A 104 25.351 25.984 -2.981 1.00 11.50 O ATOM 1578 CB GLN A 104 23.368 26.747 -0.426 1.00 11.19 C ATOM 1579 CG GLN A 104 22.526 27.459 -1.485 1.00 11.48 C ATOM 1580 CD GLN A 104 23.330 28.355 -2.411 1.00 11.71 C ATOM 1581 OE1 GLN A 104 24.371 28.981 -1.885 1.00 11.93 O flip ATOM 1582 NE2 GLN A 104 22.993 28.512 -3.585 1.00 11.88 N flip ATOM 0 H GLN A 104 24.538 25.157 1.080 1.00 10.83 H new ATOM 0 HA GLN A 104 23.501 24.957 -1.590 1.00 11.03 H new ATOM 0 HB2 GLN A 104 22.711 26.417 0.379 1.00 11.19 H new ATOM 0 HB3 GLN A 104 24.066 27.464 0.006 1.00 11.19 H new ATOM 0 HG2 GLN A 104 22.003 26.712 -2.082 1.00 11.48 H new ATOM 0 HG3 GLN A 104 21.764 28.058 -0.987 1.00 11.48 H new ATOM 0 HE21 GLN A 104 22.185 28.012 -3.955 1.00 11.88 H new ATOM 0 HE22 GLN A 104 23.522 29.142 -4.188 1.00 11.88 H new ATOM 1591 N LYS A 105 26.446 26.350 -1.052 1.00 11.41 N ATOM 1592 CA LYS A 105 27.695 26.710 -1.713 1.00 11.86 C ATOM 1593 C LYS A 105 28.320 25.470 -2.342 1.00 11.85 C ATOM 1594 O LYS A 105 28.835 25.515 -3.458 1.00 12.20 O ATOM 1595 CB LYS A 105 28.674 27.347 -0.722 1.00 12.25 C ATOM 1596 CG LYS A 105 29.941 27.881 -1.381 1.00 12.76 C ATOM 1597 CD LYS A 105 30.879 28.527 -0.371 1.00 13.39 C ATOM 1598 CE LYS A 105 31.559 27.498 0.521 1.00 14.09 C ATOM 1599 NZ LYS A 105 32.480 26.618 -0.243 1.00 14.37 N ATOM 0 H LYS A 105 26.473 26.406 -0.034 1.00 11.41 H new ATOM 0 HA LYS A 105 27.477 27.440 -2.492 1.00 11.86 H new ATOM 0 HB2 LYS A 105 28.173 28.163 -0.201 1.00 12.25 H new ATOM 0 HB3 LYS A 105 28.949 26.609 0.031 1.00 12.25 H new ATOM 0 HG2 LYS A 105 30.458 27.066 -1.887 1.00 12.76 H new ATOM 0 HG3 LYS A 105 29.673 28.611 -2.145 1.00 12.76 H new ATOM 0 HD2 LYS A 105 31.637 29.105 -0.899 1.00 13.39 H new ATOM 0 HD3 LYS A 105 30.318 29.227 0.247 1.00 13.39 H new ATOM 0 HE2 LYS A 105 32.116 28.010 1.306 1.00 14.09 H new ATOM 0 HE3 LYS A 105 30.801 26.889 1.014 1.00 14.09 H new ATOM 0 HZ1 LYS A 105 33.115 26.124 0.416 1.00 14.37 H new ATOM 0 HZ2 LYS A 105 31.927 25.919 -0.780 1.00 14.37 H new ATOM 0 HZ3 LYS A 105 33.043 27.193 -0.901 1.00 14.37 H new ATOM 1613 N GLY A 106 28.247 24.359 -1.614 1.00 11.60 N ATOM 1614 CA GLY A 106 28.756 23.098 -2.115 1.00 11.77 C ATOM 1615 C GLY A 106 27.998 22.611 -3.334 1.00 11.76 C ATOM 1616 O GLY A 106 28.509 21.807 -4.113 1.00 12.03 O ATOM 0 H GLY A 106 27.841 24.312 -0.679 1.00 11.60 H new ATOM 0 HA2 GLY A 106 29.811 23.210 -2.367 1.00 11.77 H new ATOM 0 HA3 GLY A 106 28.694 22.346 -1.328 1.00 11.77 H new ATOM 1620 N ASN A 107 26.774 23.107 -3.499 1.00 11.60 N ATOM 1621 CA ASN A 107 25.929 22.747 -4.639 1.00 11.78 C ATOM 1622 C ASN A 107 26.587 23.161 -5.950 1.00 12.07 C ATOM 1623 O ASN A 107 26.293 22.611 -7.008 1.00 12.33 O ATOM 1624 CB ASN A 107 24.556 23.419 -4.512 1.00 11.85 C ATOM 1625 CG ASN A 107 23.567 22.954 -5.567 1.00 11.96 C ATOM 1626 OD1 ASN A 107 23.584 21.797 -5.990 1.00 11.97 O ATOM 1627 ND2 ASN A 107 22.700 23.855 -5.999 1.00 12.28 N ATOM 0 H ASN A 107 26.341 23.766 -2.852 1.00 11.60 H new ATOM 0 HA ASN A 107 25.800 21.665 -4.641 1.00 11.78 H new ATOM 0 HB2 ASN A 107 24.147 23.213 -3.523 1.00 11.85 H new ATOM 0 HB3 ASN A 107 24.678 24.499 -4.588 1.00 11.85 H new ATOM 0 HD21 ASN A 107 22.012 23.602 -6.708 1.00 12.28 H new ATOM 0 HD22 ASN A 107 22.719 24.803 -5.623 1.00 12.28 H new ATOM 1634 N PHE A 108 27.496 24.128 -5.869 1.00 12.19 N ATOM 1635 CA PHE A 108 28.216 24.608 -7.040 1.00 12.69 C ATOM 1636 C PHE A 108 29.142 23.517 -7.582 1.00 12.92 C ATOM 1637 O PHE A 108 29.471 23.497 -8.768 1.00 13.36 O ATOM 1638 CB PHE A 108 29.014 25.866 -6.688 1.00 13.02 C ATOM 1639 CG PHE A 108 29.631 26.546 -7.878 1.00 13.41 C ATOM 1640 CD1 PHE A 108 31.005 26.662 -7.992 1.00 13.60 C ATOM 1641 CD2 PHE A 108 28.832 27.061 -8.885 1.00 13.76 C ATOM 1642 CE1 PHE A 108 31.573 27.280 -9.087 1.00 14.16 C ATOM 1643 CE2 PHE A 108 29.394 27.682 -9.983 1.00 14.30 C ATOM 1644 CZ PHE A 108 30.768 27.791 -10.084 1.00 14.51 C ATOM 0 H PHE A 108 27.751 24.596 -4.999 1.00 12.19 H new ATOM 0 HA PHE A 108 27.494 24.860 -7.817 1.00 12.69 H new ATOM 0 HB2 PHE A 108 28.357 26.571 -6.179 1.00 13.02 H new ATOM 0 HB3 PHE A 108 29.803 25.600 -5.984 1.00 13.02 H new ATOM 0 HD1 PHE A 108 31.640 26.264 -7.215 1.00 13.60 H new ATOM 0 HD2 PHE A 108 27.758 26.976 -8.811 1.00 13.76 H new ATOM 0 HE1 PHE A 108 32.647 27.364 -9.164 1.00 14.16 H new ATOM 0 HE2 PHE A 108 28.761 28.082 -10.761 1.00 14.30 H new ATOM 0 HZ PHE A 108 31.211 28.275 -10.942 1.00 14.51 H new ATOM 1654 N ARG A 109 29.543 22.604 -6.706 1.00 12.75 N ATOM 1655 CA ARG A 109 30.381 21.481 -7.105 1.00 13.13 C ATOM 1656 C ARG A 109 29.528 20.400 -7.753 1.00 13.11 C ATOM 1657 O ARG A 109 30.002 19.633 -8.587 1.00 13.55 O ATOM 1658 CB ARG A 109 31.101 20.892 -5.894 1.00 13.21 C ATOM 1659 CG ARG A 109 31.970 21.886 -5.146 1.00 13.63 C ATOM 1660 CD ARG A 109 32.544 21.271 -3.881 1.00 13.95 C ATOM 1661 NE ARG A 109 31.491 20.798 -2.978 1.00 14.26 N ATOM 1662 CZ ARG A 109 31.584 20.817 -1.650 1.00 14.71 C ATOM 1663 NH1 ARG A 109 32.689 21.255 -1.059 1.00 14.89 N ATOM 1664 NH2 ARG A 109 30.571 20.388 -0.909 1.00 15.12 N ATOM 0 H ARG A 109 29.301 22.619 -5.715 1.00 12.75 H new ATOM 0 HA ARG A 109 31.121 21.843 -7.819 1.00 13.13 H new ATOM 0 HB2 ARG A 109 30.360 20.485 -5.207 1.00 13.21 H new ATOM 0 HB3 ARG A 109 31.722 20.059 -6.224 1.00 13.21 H new ATOM 0 HG2 ARG A 109 32.782 22.221 -5.791 1.00 13.63 H new ATOM 0 HG3 ARG A 109 31.382 22.767 -4.890 1.00 13.63 H new ATOM 0 HD2 ARG A 109 33.197 20.439 -4.145 1.00 13.95 H new ATOM 0 HD3 ARG A 109 33.160 22.008 -3.366 1.00 13.95 H new ATOM 0 HE ARG A 109 30.634 20.432 -3.393 1.00 14.26 H new ATOM 0 HH11 ARG A 109 33.474 21.580 -1.623 1.00 14.89 H new ATOM 0 HH12 ARG A 109 32.753 21.267 -0.041 1.00 14.89 H new ATOM 0 HH21 ARG A 109 29.722 20.044 -1.357 1.00 15.12 H new ATOM 0 HH22 ARG A 109 30.641 20.402 0.108 1.00 15.12 H new ATOM 1678 N ASN A 110 28.263 20.359 -7.364 1.00 12.73 N ATOM 1679 CA ASN A 110 27.340 19.339 -7.840 1.00 12.86 C ATOM 1680 C ASN A 110 26.762 19.729 -9.195 1.00 12.47 C ATOM 1681 O ASN A 110 26.468 20.899 -9.445 1.00 12.44 O ATOM 1682 CB ASN A 110 26.208 19.143 -6.827 1.00 13.08 C ATOM 1683 CG ASN A 110 25.239 18.049 -7.232 1.00 13.55 C ATOM 1684 OD1 ASN A 110 25.616 17.073 -7.881 1.00 13.74 O ATOM 1685 ND2 ASN A 110 23.982 18.206 -6.857 1.00 13.93 N ATOM 0 H ASN A 110 27.849 21.027 -6.714 1.00 12.73 H new ATOM 0 HA ASN A 110 27.887 18.403 -7.952 1.00 12.86 H new ATOM 0 HB2 ASN A 110 26.635 18.901 -5.854 1.00 13.08 H new ATOM 0 HB3 ASN A 110 25.663 20.080 -6.712 1.00 13.08 H new ATOM 0 HD21 ASN A 110 23.284 17.504 -7.105 1.00 13.93 H new ATOM 0 HD22 ASN A 110 23.709 19.029 -6.320 1.00 13.93 H new ATOM 1692 N GLN A 111 26.621 18.750 -10.073 1.00 12.38 N ATOM 1693 CA GLN A 111 26.023 18.976 -11.379 1.00 12.20 C ATOM 1694 C GLN A 111 24.500 18.954 -11.272 1.00 11.61 C ATOM 1695 O GLN A 111 23.861 17.921 -11.480 1.00 11.50 O ATOM 1696 CB GLN A 111 26.510 17.925 -12.380 1.00 12.57 C ATOM 1697 CG GLN A 111 28.018 17.944 -12.590 1.00 13.05 C ATOM 1698 CD GLN A 111 28.489 16.899 -13.579 1.00 13.63 C ATOM 1699 OE1 GLN A 111 28.791 15.762 -13.209 1.00 13.90 O ATOM 1700 NE2 GLN A 111 28.558 17.274 -14.846 1.00 14.01 N ATOM 0 H GLN A 111 26.914 17.788 -9.904 1.00 12.38 H new ATOM 0 HA GLN A 111 26.330 19.958 -11.739 1.00 12.20 H new ATOM 0 HB2 GLN A 111 26.211 16.936 -12.032 1.00 12.57 H new ATOM 0 HB3 GLN A 111 26.015 18.089 -13.337 1.00 12.57 H new ATOM 0 HG2 GLN A 111 28.318 18.931 -12.942 1.00 13.05 H new ATOM 0 HG3 GLN A 111 28.515 17.782 -11.634 1.00 13.05 H new ATOM 0 HE21 GLN A 111 28.299 18.224 -15.111 1.00 14.01 H new ATOM 0 HE22 GLN A 111 28.870 16.613 -15.557 1.00 14.01 H new ATOM 1709 N ARG A 112 23.929 20.109 -10.952 1.00 11.45 N ATOM 1710 CA ARG A 112 22.486 20.250 -10.776 1.00 11.12 C ATOM 1711 C ARG A 112 21.796 20.467 -12.122 1.00 10.61 C ATOM 1712 O ARG A 112 20.670 20.964 -12.190 1.00 10.60 O ATOM 1713 CB ARG A 112 22.190 21.430 -9.845 1.00 11.41 C ATOM 1714 CG ARG A 112 22.691 22.764 -10.384 1.00 11.96 C ATOM 1715 CD ARG A 112 22.433 23.910 -9.415 1.00 12.50 C ATOM 1716 NE ARG A 112 21.008 24.104 -9.144 1.00 13.09 N ATOM 1717 CZ ARG A 112 20.429 25.296 -8.994 1.00 13.79 C ATOM 1718 NH1 ARG A 112 21.134 26.413 -9.142 1.00 14.01 N ATOM 1719 NH2 ARG A 112 19.135 25.367 -8.708 1.00 14.43 N ATOM 0 H ARG A 112 24.451 20.973 -10.807 1.00 11.45 H new ATOM 0 HA ARG A 112 22.100 19.332 -10.333 1.00 11.12 H new ATOM 0 HB2 ARG A 112 21.114 21.493 -9.681 1.00 11.41 H new ATOM 0 HB3 ARG A 112 22.650 21.242 -8.875 1.00 11.41 H new ATOM 0 HG2 ARG A 112 23.760 22.694 -10.585 1.00 11.96 H new ATOM 0 HG3 ARG A 112 22.201 22.977 -11.334 1.00 11.96 H new ATOM 0 HD2 ARG A 112 22.954 23.714 -8.478 1.00 12.50 H new ATOM 0 HD3 ARG A 112 22.850 24.830 -9.825 1.00 12.50 H new ATOM 0 HE ARG A 112 20.420 23.274 -9.065 1.00 13.09 H new ATOM 0 HH11 ARG A 112 22.126 26.363 -9.372 1.00 14.01 H new ATOM 0 HH12 ARG A 112 20.683 27.320 -9.025 1.00 14.01 H new ATOM 0 HH21 ARG A 112 18.588 24.512 -8.604 1.00 14.43 H new ATOM 0 HH22 ARG A 112 18.687 26.276 -8.592 1.00 14.43 H new ATOM 1733 N LYS A 113 22.478 20.073 -13.190 1.00 10.40 N ATOM 1734 CA LYS A 113 22.004 20.304 -14.545 1.00 10.14 C ATOM 1735 C LYS A 113 20.972 19.254 -14.960 1.00 9.74 C ATOM 1736 O LYS A 113 20.619 19.148 -16.130 1.00 9.59 O ATOM 1737 CB LYS A 113 23.188 20.286 -15.513 1.00 10.36 C ATOM 1738 CG LYS A 113 23.055 21.258 -16.672 1.00 10.98 C ATOM 1739 CD LYS A 113 23.051 22.699 -16.188 1.00 11.43 C ATOM 1740 CE LYS A 113 23.001 23.674 -17.348 1.00 11.95 C ATOM 1741 NZ LYS A 113 22.976 25.087 -16.885 1.00 12.41 N ATOM 0 H LYS A 113 23.373 19.586 -13.140 1.00 10.40 H new ATOM 0 HA LYS A 113 21.520 21.280 -14.577 1.00 10.14 H new ATOM 0 HB2 LYS A 113 24.099 20.518 -14.961 1.00 10.36 H new ATOM 0 HB3 LYS A 113 23.304 19.277 -15.910 1.00 10.36 H new ATOM 0 HG2 LYS A 113 23.879 21.109 -17.370 1.00 10.98 H new ATOM 0 HG3 LYS A 113 22.134 21.053 -17.217 1.00 10.98 H new ATOM 0 HD2 LYS A 113 22.193 22.863 -15.536 1.00 11.43 H new ATOM 0 HD3 LYS A 113 23.944 22.886 -15.592 1.00 11.43 H new ATOM 0 HE2 LYS A 113 23.867 23.518 -17.991 1.00 11.95 H new ATOM 0 HE3 LYS A 113 22.116 23.474 -17.952 1.00 11.95 H new ATOM 0 HZ1 LYS A 113 22.942 25.722 -17.708 1.00 12.41 H new ATOM 0 HZ2 LYS A 113 22.136 25.243 -16.292 1.00 12.41 H new ATOM 0 HZ3 LYS A 113 23.833 25.286 -16.330 1.00 12.41 H new ATOM 1755 N THR A 114 20.491 18.484 -13.996 1.00 9.83 N ATOM 1756 CA THR A 114 19.484 17.463 -14.257 1.00 9.78 C ATOM 1757 C THR A 114 18.106 18.102 -14.419 1.00 9.62 C ATOM 1758 O THR A 114 17.165 17.478 -14.910 1.00 9.64 O ATOM 1759 CB THR A 114 19.440 16.444 -13.105 1.00 10.31 C ATOM 1760 OG1 THR A 114 20.761 16.266 -12.576 1.00 10.49 O ATOM 1761 CG2 THR A 114 18.899 15.103 -13.581 1.00 10.80 C ATOM 0 H THR A 114 20.783 18.546 -13.021 1.00 9.83 H new ATOM 0 HA THR A 114 19.753 16.950 -15.180 1.00 9.78 H new ATOM 0 HB THR A 114 18.775 16.827 -12.331 1.00 10.31 H new ATOM 0 HG1 THR A 114 20.734 15.618 -11.841 1.00 10.49 H new ATOM 0 HG21 THR A 114 18.879 14.402 -12.747 1.00 10.80 H new ATOM 0 HG22 THR A 114 17.889 15.235 -13.968 1.00 10.80 H new ATOM 0 HG23 THR A 114 19.541 14.711 -14.369 1.00 10.80 H new ATOM 1769 N VAL A 115 18.006 19.358 -14.003 1.00 9.74 N ATOM 1770 CA VAL A 115 16.745 20.087 -14.032 1.00 9.92 C ATOM 1771 C VAL A 115 16.261 20.328 -15.464 1.00 9.30 C ATOM 1772 O VAL A 115 15.057 20.373 -15.714 1.00 9.52 O ATOM 1773 CB VAL A 115 16.868 21.437 -13.284 1.00 10.85 C ATOM 1774 CG1 VAL A 115 17.914 22.331 -13.939 1.00 11.22 C ATOM 1775 CG2 VAL A 115 15.520 22.141 -13.209 1.00 11.44 C ATOM 0 H VAL A 115 18.791 19.897 -13.638 1.00 9.74 H new ATOM 0 HA VAL A 115 16.007 19.466 -13.524 1.00 9.92 H new ATOM 0 HB VAL A 115 17.196 21.228 -12.266 1.00 10.85 H new ATOM 0 HG11 VAL A 115 17.980 23.273 -13.394 1.00 11.22 H new ATOM 0 HG12 VAL A 115 18.883 21.832 -13.920 1.00 11.22 H new ATOM 0 HG13 VAL A 115 17.628 22.529 -14.972 1.00 11.22 H new ATOM 0 HG21 VAL A 115 15.632 23.087 -12.679 1.00 11.44 H new ATOM 0 HG22 VAL A 115 15.152 22.331 -14.217 1.00 11.44 H new ATOM 0 HG23 VAL A 115 14.809 21.509 -12.677 1.00 11.44 H new ATOM 1785 N LYS A 116 17.193 20.461 -16.408 1.00 8.75 N ATOM 1786 CA LYS A 116 16.824 20.735 -17.791 1.00 8.35 C ATOM 1787 C LYS A 116 15.979 19.598 -18.350 1.00 7.64 C ATOM 1788 O LYS A 116 16.373 18.431 -18.316 1.00 7.40 O ATOM 1789 CB LYS A 116 18.057 21.005 -18.664 1.00 8.50 C ATOM 1790 CG LYS A 116 19.101 19.900 -18.654 1.00 9.04 C ATOM 1791 CD LYS A 116 20.360 20.334 -19.392 1.00 9.56 C ATOM 1792 CE LYS A 116 21.451 19.276 -19.330 1.00 10.24 C ATOM 1793 NZ LYS A 116 21.056 18.021 -20.019 1.00 10.72 N ATOM 0 H LYS A 116 18.196 20.384 -16.241 1.00 8.75 H new ATOM 0 HA LYS A 116 16.223 21.644 -17.807 1.00 8.35 H new ATOM 0 HB2 LYS A 116 17.729 21.166 -19.691 1.00 8.50 H new ATOM 0 HB3 LYS A 116 18.525 21.931 -18.330 1.00 8.50 H new ATOM 0 HG2 LYS A 116 19.350 19.639 -17.625 1.00 9.04 H new ATOM 0 HG3 LYS A 116 18.692 19.004 -19.121 1.00 9.04 H new ATOM 0 HD2 LYS A 116 20.116 20.542 -20.434 1.00 9.56 H new ATOM 0 HD3 LYS A 116 20.731 21.263 -18.960 1.00 9.56 H new ATOM 0 HE2 LYS A 116 22.361 19.668 -19.785 1.00 10.24 H new ATOM 0 HE3 LYS A 116 21.685 19.058 -18.288 1.00 10.24 H new ATOM 0 HZ1 LYS A 116 21.898 17.431 -20.176 1.00 10.72 H new ATOM 0 HZ2 LYS A 116 20.374 17.501 -19.430 1.00 10.72 H new ATOM 0 HZ3 LYS A 116 20.619 18.250 -20.934 1.00 10.72 H new ATOM 1807 N CYS A 117 14.809 19.962 -18.850 1.00 7.61 N ATOM 1808 CA CYS A 117 13.805 19.004 -19.269 1.00 7.28 C ATOM 1809 C CYS A 117 14.308 18.185 -20.459 1.00 6.81 C ATOM 1810 O CYS A 117 14.434 18.702 -21.574 1.00 6.94 O ATOM 1811 CB CYS A 117 12.519 19.759 -19.620 1.00 7.77 C ATOM 1812 SG CYS A 117 11.024 18.764 -19.526 1.00 8.16 S ATOM 0 H CYS A 117 14.530 20.935 -18.976 1.00 7.61 H new ATOM 0 HA CYS A 117 13.599 18.306 -18.458 1.00 7.28 H new ATOM 0 HB2 CYS A 117 12.417 20.611 -18.947 1.00 7.77 H new ATOM 0 HB3 CYS A 117 12.611 20.160 -20.630 1.00 7.77 H new ATOM 1817 N PHE A 118 14.599 16.909 -20.203 1.00 6.60 N ATOM 1818 CA PHE A 118 15.177 16.012 -21.206 1.00 6.49 C ATOM 1819 C PHE A 118 14.157 15.608 -22.268 1.00 6.66 C ATOM 1820 O PHE A 118 13.795 14.437 -22.386 1.00 6.96 O ATOM 1821 CB PHE A 118 15.744 14.757 -20.536 1.00 6.75 C ATOM 1822 CG PHE A 118 16.844 15.030 -19.550 1.00 6.84 C ATOM 1823 CD1 PHE A 118 18.149 15.206 -19.980 1.00 7.09 C ATOM 1824 CD2 PHE A 118 16.576 15.102 -18.193 1.00 7.05 C ATOM 1825 CE1 PHE A 118 19.164 15.450 -19.076 1.00 7.55 C ATOM 1826 CE2 PHE A 118 17.587 15.347 -17.285 1.00 7.50 C ATOM 1827 CZ PHE A 118 18.883 15.522 -17.728 1.00 7.76 C ATOM 0 H PHE A 118 14.441 16.468 -19.297 1.00 6.60 H new ATOM 0 HA PHE A 118 15.980 16.559 -21.701 1.00 6.49 H new ATOM 0 HB2 PHE A 118 14.935 14.234 -20.026 1.00 6.75 H new ATOM 0 HB3 PHE A 118 16.121 14.085 -21.307 1.00 6.75 H new ATOM 0 HD1 PHE A 118 18.375 15.152 -21.035 1.00 7.09 H new ATOM 0 HD2 PHE A 118 15.564 14.965 -17.841 1.00 7.05 H new ATOM 0 HE1 PHE A 118 20.177 15.584 -19.425 1.00 7.55 H new ATOM 0 HE2 PHE A 118 17.364 15.402 -16.230 1.00 7.50 H new ATOM 0 HZ PHE A 118 19.675 15.715 -17.020 1.00 7.76 H new ATOM 1837 N ASN A 119 13.714 16.594 -23.034 1.00 6.83 N ATOM 1838 CA ASN A 119 12.814 16.397 -24.168 1.00 7.37 C ATOM 1839 C ASN A 119 12.441 17.753 -24.752 1.00 7.84 C ATOM 1840 O ASN A 119 12.253 17.893 -25.962 1.00 8.35 O ATOM 1841 CB ASN A 119 11.539 15.607 -23.791 1.00 7.76 C ATOM 1842 CG ASN A 119 10.618 16.329 -22.820 1.00 8.38 C ATOM 1843 OD1 ASN A 119 11.059 17.112 -21.983 1.00 8.64 O ATOM 1844 ND2 ASN A 119 9.324 16.064 -22.926 1.00 8.90 N ATOM 0 H ASN A 119 13.972 17.570 -22.885 1.00 6.83 H new ATOM 0 HA ASN A 119 13.342 15.798 -24.909 1.00 7.37 H new ATOM 0 HB2 ASN A 119 10.983 15.382 -24.701 1.00 7.76 H new ATOM 0 HB3 ASN A 119 11.833 14.653 -23.353 1.00 7.76 H new ATOM 0 HD21 ASN A 119 8.658 16.516 -22.300 1.00 8.90 H new ATOM 0 HD22 ASN A 119 8.994 15.408 -23.634 1.00 8.90 H new ATOM 1851 N CYS A 120 12.359 18.758 -23.885 1.00 7.96 N ATOM 1852 CA CYS A 120 12.065 20.116 -24.310 1.00 8.71 C ATOM 1853 C CYS A 120 13.348 20.946 -24.406 1.00 8.75 C ATOM 1854 O CYS A 120 13.396 21.952 -25.109 1.00 9.54 O ATOM 1855 CB CYS A 120 11.084 20.759 -23.333 1.00 9.25 C ATOM 1856 SG CYS A 120 9.670 19.709 -22.926 1.00 9.45 S ATOM 0 H CYS A 120 12.493 18.653 -22.879 1.00 7.96 H new ATOM 0 HA CYS A 120 11.612 20.083 -25.301 1.00 8.71 H new ATOM 0 HB2 CYS A 120 11.613 21.012 -22.414 1.00 9.25 H new ATOM 0 HB3 CYS A 120 10.720 21.694 -23.760 1.00 9.25 H new ATOM 1861 N GLY A 121 14.386 20.519 -23.692 1.00 8.15 N ATOM 1862 CA GLY A 121 15.691 21.148 -23.823 1.00 8.48 C ATOM 1863 C GLY A 121 16.016 22.125 -22.702 1.00 8.66 C ATOM 1864 O GLY A 121 17.178 22.266 -22.316 1.00 9.05 O ATOM 0 H GLY A 121 14.348 19.749 -23.025 1.00 8.15 H new ATOM 0 HA2 GLY A 121 16.457 20.373 -23.850 1.00 8.48 H new ATOM 0 HA3 GLY A 121 15.736 21.675 -24.776 1.00 8.48 H new ATOM 1868 N LYS A 122 14.999 22.789 -22.170 1.00 8.64 N ATOM 1869 CA LYS A 122 15.211 23.847 -21.186 1.00 9.14 C ATOM 1870 C LYS A 122 14.743 23.407 -19.804 1.00 9.38 C ATOM 1871 O LYS A 122 13.984 22.449 -19.676 1.00 9.60 O ATOM 1872 CB LYS A 122 14.466 25.117 -21.609 1.00 10.04 C ATOM 1873 CG LYS A 122 14.854 25.617 -22.991 1.00 10.62 C ATOM 1874 CD LYS A 122 14.198 26.949 -23.339 1.00 11.49 C ATOM 1875 CE LYS A 122 12.675 26.869 -23.343 1.00 12.13 C ATOM 1876 NZ LYS A 122 12.085 27.170 -22.009 1.00 12.70 N ATOM 0 H LYS A 122 14.021 22.616 -22.401 1.00 8.64 H new ATOM 0 HA LYS A 122 16.280 24.057 -21.137 1.00 9.14 H new ATOM 0 HB2 LYS A 122 13.394 24.923 -21.590 1.00 10.04 H new ATOM 0 HB3 LYS A 122 14.661 25.903 -20.879 1.00 10.04 H new ATOM 0 HG2 LYS A 122 15.937 25.725 -23.043 1.00 10.62 H new ATOM 0 HG3 LYS A 122 14.572 24.872 -23.735 1.00 10.62 H new ATOM 0 HD2 LYS A 122 14.517 27.705 -22.621 1.00 11.49 H new ATOM 0 HD3 LYS A 122 14.544 27.275 -24.320 1.00 11.49 H new ATOM 0 HE2 LYS A 122 12.279 27.570 -24.078 1.00 12.13 H new ATOM 0 HE3 LYS A 122 12.368 25.871 -23.656 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 11.433 26.407 -21.738 1.00 12.70 H new ATOM 0 HZ2 LYS A 122 12.844 27.244 -21.302 1.00 12.70 H new ATOM 0 HZ3 LYS A 122 11.565 28.070 -22.054 1.00 12.70 H new ATOM 1890 N GLU A 123 15.190 24.120 -18.775 1.00 9.61 N ATOM 1891 CA GLU A 123 14.866 23.771 -17.394 1.00 10.15 C ATOM 1892 C GLU A 123 13.564 24.426 -16.944 1.00 10.16 C ATOM 1893 O GLU A 123 13.345 24.647 -15.752 1.00 9.77 O ATOM 1894 CB GLU A 123 16.002 24.181 -16.454 1.00 10.72 C ATOM 1895 CG GLU A 123 16.221 25.684 -16.358 1.00 11.36 C ATOM 1896 CD GLU A 123 17.144 26.059 -15.219 1.00 12.15 C ATOM 1897 OE1 GLU A 123 16.688 26.065 -14.056 1.00 12.53 O ATOM 1898 OE2 GLU A 123 18.330 26.351 -15.474 1.00 12.54 O ATOM 0 H GLU A 123 15.780 24.946 -18.871 1.00 9.61 H new ATOM 0 HA GLU A 123 14.738 22.689 -17.352 1.00 10.15 H new ATOM 0 HB2 GLU A 123 15.793 23.791 -15.458 1.00 10.72 H new ATOM 0 HB3 GLU A 123 16.926 23.711 -16.792 1.00 10.72 H new ATOM 0 HG2 GLU A 123 16.639 26.049 -17.296 1.00 11.36 H new ATOM 0 HG3 GLU A 123 15.260 26.181 -16.223 1.00 11.36 H new ATOM 1905 N GLY A 124 12.706 24.732 -17.904 1.00 10.81 N ATOM 1906 CA GLY A 124 11.417 25.312 -17.589 1.00 11.18 C ATOM 1907 C GLY A 124 10.495 24.298 -16.952 1.00 11.06 C ATOM 1908 O GLY A 124 9.540 24.652 -16.256 1.00 11.83 O ATOM 0 H GLY A 124 12.879 24.589 -18.899 1.00 10.81 H new ATOM 0 HA2 GLY A 124 11.552 26.157 -16.914 1.00 11.18 H new ATOM 0 HA3 GLY A 124 10.959 25.701 -18.499 1.00 11.18 H new ATOM 1912 N HIS A 125 10.791 23.030 -17.194 1.00 10.27 N ATOM 1913 CA HIS A 125 10.029 21.936 -16.613 1.00 10.32 C ATOM 1914 C HIS A 125 10.988 20.936 -16.000 1.00 9.72 C ATOM 1915 O HIS A 125 12.190 21.180 -15.917 1.00 9.32 O ATOM 1916 CB HIS A 125 9.199 21.181 -17.665 1.00 10.21 C ATOM 1917 CG HIS A 125 8.711 21.991 -18.818 1.00 10.68 C ATOM 1918 ND1 HIS A 125 9.119 21.701 -20.097 1.00 10.37 N ATOM 1919 CD2 HIS A 125 7.827 23.015 -18.851 1.00 11.65 C ATOM 1920 CE1 HIS A 125 8.473 22.550 -20.877 1.00 11.18 C ATOM 1921 NE2 HIS A 125 7.679 23.367 -20.167 1.00 11.94 N ATOM 0 H HIS A 125 11.560 22.732 -17.794 1.00 10.27 H new ATOM 0 HA HIS A 125 9.356 22.370 -15.873 1.00 10.32 H new ATOM 0 HB2 HIS A 125 9.801 20.360 -18.053 1.00 10.21 H new ATOM 0 HB3 HIS A 125 8.337 20.737 -17.168 1.00 10.21 H new ATOM 0 HD2 HIS A 125 7.333 23.468 -18.004 1.00 11.65 H new ATOM 0 HE1 HIS A 125 8.572 22.582 -21.952 1.00 11.18 H new ATOM 0 HE2 HIS A 125 7.081 24.107 -20.536 1.00 11.94 H new ATOM 1929 N ILE A 126 10.441 19.805 -15.599 1.00 9.89 N ATOM 1930 CA ILE A 126 11.226 18.671 -15.164 1.00 9.58 C ATOM 1931 C ILE A 126 10.694 17.425 -15.854 1.00 9.30 C ATOM 1932 O ILE A 126 9.488 17.166 -15.841 1.00 9.89 O ATOM 1933 CB ILE A 126 11.216 18.463 -13.623 1.00 10.51 C ATOM 1934 CG1 ILE A 126 9.788 18.471 -13.044 1.00 11.44 C ATOM 1935 CG2 ILE A 126 12.084 19.509 -12.939 1.00 10.87 C ATOM 1936 CD1 ILE A 126 9.177 19.849 -12.868 1.00 12.22 C ATOM 0 H ILE A 126 9.434 19.648 -15.566 1.00 9.89 H new ATOM 0 HA ILE A 126 12.263 18.866 -15.437 1.00 9.58 H new ATOM 0 HB ILE A 126 11.634 17.476 -13.425 1.00 10.51 H new ATOM 0 HG12 ILE A 126 9.143 17.885 -13.698 1.00 11.44 H new ATOM 0 HG13 ILE A 126 9.801 17.969 -12.076 1.00 11.44 H new ATOM 0 HG21 ILE A 126 12.066 19.349 -11.861 1.00 10.87 H new ATOM 0 HG22 ILE A 126 13.109 19.425 -13.301 1.00 10.87 H new ATOM 0 HG23 ILE A 126 11.700 20.504 -13.164 1.00 10.87 H new ATOM 0 HD11 ILE A 126 8.173 19.752 -12.455 1.00 12.22 H new ATOM 0 HD12 ILE A 126 9.794 20.436 -12.187 1.00 12.22 H new ATOM 0 HD13 ILE A 126 9.125 20.350 -13.835 1.00 12.22 H new ATOM 1948 N ALA A 127 11.595 16.669 -16.469 1.00 8.62 N ATOM 1949 CA ALA A 127 11.227 15.522 -17.297 1.00 8.50 C ATOM 1950 C ALA A 127 10.428 14.480 -16.519 1.00 9.47 C ATOM 1951 O ALA A 127 9.750 13.644 -17.111 1.00 9.79 O ATOM 1952 CB ALA A 127 12.470 14.888 -17.905 1.00 7.91 C ATOM 0 H ALA A 127 12.600 16.831 -16.410 1.00 8.62 H new ATOM 0 HA ALA A 127 10.584 15.893 -18.095 1.00 8.50 H new ATOM 0 HB1 ALA A 127 12.180 14.035 -18.519 1.00 7.91 H new ATOM 0 HB2 ALA A 127 12.987 15.622 -18.524 1.00 7.91 H new ATOM 0 HB3 ALA A 127 13.134 14.553 -17.108 1.00 7.91 H new ATOM 1958 N LYS A 128 10.511 14.535 -15.196 1.00 10.12 N ATOM 1959 CA LYS A 128 9.794 13.596 -14.341 1.00 11.20 C ATOM 1960 C LYS A 128 8.294 13.903 -14.309 1.00 11.91 C ATOM 1961 O LYS A 128 7.480 13.021 -14.043 1.00 12.77 O ATOM 1962 CB LYS A 128 10.372 13.628 -12.921 1.00 11.83 C ATOM 1963 CG LYS A 128 10.251 14.986 -12.244 1.00 11.76 C ATOM 1964 CD LYS A 128 10.911 15.004 -10.873 1.00 12.45 C ATOM 1965 CE LYS A 128 12.417 14.843 -10.978 1.00 12.66 C ATOM 1966 NZ LYS A 128 13.077 14.875 -9.650 1.00 13.15 N ATOM 0 H LYS A 128 11.069 15.222 -14.690 1.00 10.12 H new ATOM 0 HA LYS A 128 9.922 12.597 -14.757 1.00 11.20 H new ATOM 0 HB2 LYS A 128 9.861 12.881 -12.313 1.00 11.83 H new ATOM 0 HB3 LYS A 128 11.423 13.343 -12.959 1.00 11.83 H new ATOM 0 HG2 LYS A 128 10.708 15.747 -12.876 1.00 11.76 H new ATOM 0 HG3 LYS A 128 9.198 15.247 -12.142 1.00 11.76 H new ATOM 0 HD2 LYS A 128 10.679 15.942 -10.369 1.00 12.45 H new ATOM 0 HD3 LYS A 128 10.500 14.202 -10.260 1.00 12.45 H new ATOM 0 HE2 LYS A 128 12.646 13.900 -11.473 1.00 12.66 H new ATOM 0 HE3 LYS A 128 12.823 15.638 -11.603 1.00 12.66 H new ATOM 0 HZ1 LYS A 128 14.104 14.762 -9.770 1.00 13.15 H new ATOM 0 HZ2 LYS A 128 12.881 15.785 -9.187 1.00 13.15 H new ATOM 0 HZ3 LYS A 128 12.710 14.101 -9.061 1.00 13.15 H new ATOM 1980 N ASN A 129 7.931 15.153 -14.580 1.00 11.70 N ATOM 1981 CA ASN A 129 6.529 15.577 -14.514 1.00 12.56 C ATOM 1982 C ASN A 129 6.030 16.030 -15.879 1.00 12.29 C ATOM 1983 O ASN A 129 4.825 16.099 -16.123 1.00 13.04 O ATOM 1984 CB ASN A 129 6.351 16.719 -13.506 1.00 13.04 C ATOM 1985 CG ASN A 129 6.447 16.268 -12.061 1.00 13.96 C ATOM 1986 OD1 ASN A 129 7.100 15.277 -11.743 1.00 14.48 O ATOM 1987 ND2 ASN A 129 5.804 17.006 -11.171 1.00 14.33 N ATOM 0 H ASN A 129 8.583 15.891 -14.847 1.00 11.70 H new ATOM 0 HA ASN A 129 5.944 14.717 -14.189 1.00 12.56 H new ATOM 0 HB2 ASN A 129 7.109 17.480 -13.692 1.00 13.04 H new ATOM 0 HB3 ASN A 129 5.381 17.189 -13.668 1.00 13.04 H new ATOM 0 HD21 ASN A 129 5.840 16.759 -10.182 1.00 14.33 H new ATOM 0 HD22 ASN A 129 5.272 17.822 -11.474 1.00 14.33 H new ATOM 1994 N CYS A 130 6.957 16.340 -16.765 1.00 11.34 N ATOM 1995 CA CYS A 130 6.614 16.863 -18.072 1.00 11.22 C ATOM 1996 C CYS A 130 6.400 15.735 -19.071 1.00 11.41 C ATOM 1997 O CYS A 130 7.355 15.156 -19.592 1.00 10.94 O ATOM 1998 CB CYS A 130 7.719 17.799 -18.553 1.00 10.26 C ATOM 1999 SG CYS A 130 7.389 18.647 -20.117 1.00 10.18 S ATOM 0 H CYS A 130 7.959 16.238 -16.601 1.00 11.34 H new ATOM 0 HA CYS A 130 5.680 17.419 -17.993 1.00 11.22 H new ATOM 0 HB2 CYS A 130 7.898 18.549 -17.783 1.00 10.26 H new ATOM 0 HB3 CYS A 130 8.639 17.224 -18.658 1.00 10.26 H new ATOM 2004 N ARG A 131 5.141 15.414 -19.320 1.00 12.28 N ATOM 2005 CA ARG A 131 4.788 14.448 -20.337 1.00 12.72 C ATOM 2006 C ARG A 131 4.383 15.174 -21.614 1.00 12.49 C ATOM 2007 O ARG A 131 3.273 15.696 -21.729 1.00 12.99 O ATOM 2008 CB ARG A 131 3.664 13.541 -19.837 1.00 13.93 C ATOM 2009 CG ARG A 131 2.534 14.291 -19.154 1.00 14.54 C ATOM 2010 CD ARG A 131 1.431 13.350 -18.725 1.00 15.39 C ATOM 2011 NE ARG A 131 0.342 14.053 -18.053 1.00 15.94 N ATOM 2012 CZ ARG A 131 -0.781 13.464 -17.643 1.00 16.74 C ATOM 2013 NH1 ARG A 131 -0.972 12.170 -17.863 1.00 17.08 N ATOM 2014 NH2 ARG A 131 -1.714 14.172 -17.020 1.00 17.31 N ATOM 0 H ARG A 131 4.344 15.814 -18.825 1.00 12.28 H new ATOM 0 HA ARG A 131 5.651 13.820 -20.556 1.00 12.72 H new ATOM 0 HB2 ARG A 131 3.259 12.980 -20.680 1.00 13.93 H new ATOM 0 HB3 ARG A 131 4.079 12.813 -19.140 1.00 13.93 H new ATOM 0 HG2 ARG A 131 2.921 14.822 -18.284 1.00 14.54 H new ATOM 0 HG3 ARG A 131 2.131 15.042 -19.833 1.00 14.54 H new ATOM 0 HD2 ARG A 131 1.041 12.827 -19.598 1.00 15.39 H new ATOM 0 HD3 ARG A 131 1.840 12.593 -18.057 1.00 15.39 H new ATOM 0 HE ARG A 131 0.447 15.054 -17.888 1.00 15.94 H new ATOM 0 HH11 ARG A 131 -0.259 11.624 -18.347 1.00 17.08 H new ATOM 0 HH12 ARG A 131 -1.832 11.721 -17.549 1.00 17.08 H new ATOM 0 HH21 ARG A 131 -1.572 15.168 -16.854 1.00 17.31 H new ATOM 0 HH22 ARG A 131 -2.573 13.720 -16.707 1.00 17.31 H new ATOM 2028 N ALA A 132 5.304 15.227 -22.562 1.00 11.89 N ATOM 2029 CA ALA A 132 5.073 15.933 -23.810 1.00 11.80 C ATOM 2030 C ALA A 132 5.880 15.311 -24.941 1.00 11.49 C ATOM 2031 O ALA A 132 7.111 15.282 -24.885 1.00 10.98 O ATOM 2032 CB ALA A 132 5.433 17.403 -23.657 1.00 11.27 C ATOM 0 H ALA A 132 6.222 14.788 -22.490 1.00 11.89 H new ATOM 0 HA ALA A 132 4.015 15.851 -24.058 1.00 11.80 H new ATOM 0 HB1 ALA A 132 5.255 17.921 -24.599 1.00 11.27 H new ATOM 0 HB2 ALA A 132 4.817 17.849 -22.876 1.00 11.27 H new ATOM 0 HB3 ALA A 132 6.485 17.494 -23.386 1.00 11.27 H new ATOM 2038 N PRO A 133 5.199 14.784 -25.972 1.00 11.98 N ATOM 2039 CA PRO A 133 5.852 14.225 -27.156 1.00 11.96 C ATOM 2040 C PRO A 133 6.464 15.317 -28.029 1.00 11.21 C ATOM 2041 O PRO A 133 5.963 15.623 -29.116 1.00 11.39 O ATOM 2042 CB PRO A 133 4.724 13.503 -27.906 1.00 12.84 C ATOM 2043 CG PRO A 133 3.552 13.505 -26.981 1.00 13.32 C ATOM 2044 CD PRO A 133 3.739 14.679 -26.066 1.00 12.82 C ATOM 0 HA PRO A 133 6.676 13.563 -26.890 1.00 11.96 H new ATOM 0 HB2 PRO A 133 4.486 14.013 -28.839 1.00 12.84 H new ATOM 0 HB3 PRO A 133 5.016 12.485 -28.165 1.00 12.84 H new ATOM 0 HG2 PRO A 133 2.618 13.590 -27.537 1.00 13.32 H new ATOM 0 HG3 PRO A 133 3.502 12.575 -26.415 1.00 13.32 H new ATOM 0 HD2 PRO A 133 3.293 15.586 -26.474 1.00 12.82 H new ATOM 0 HD3 PRO A 133 3.281 14.510 -25.091 1.00 12.82 H new ATOM 2052 N ARG A 134 7.535 15.916 -27.531 1.00 10.58 N ATOM 2053 CA ARG A 134 8.253 16.950 -28.260 1.00 10.01 C ATOM 2054 C ARG A 134 9.061 16.320 -29.389 1.00 9.69 C ATOM 2055 O ARG A 134 8.692 16.403 -30.561 1.00 10.21 O ATOM 2056 CB ARG A 134 9.186 17.717 -27.314 1.00 10.03 C ATOM 2057 CG ARG A 134 8.479 18.363 -26.131 1.00 10.19 C ATOM 2058 CD ARG A 134 7.629 19.550 -26.556 1.00 10.81 C ATOM 2059 NE ARG A 134 8.440 20.625 -27.127 1.00 11.15 N ATOM 2060 CZ ARG A 134 8.034 21.890 -27.232 1.00 11.83 C ATOM 2061 NH1 ARG A 134 6.832 22.247 -26.796 1.00 12.25 N ATOM 2062 NH2 ARG A 134 8.838 22.799 -27.771 1.00 12.30 N ATOM 0 H ARG A 134 7.929 15.701 -26.615 1.00 10.58 H new ATOM 0 HA ARG A 134 7.531 17.649 -28.682 1.00 10.01 H new ATOM 0 HB2 ARG A 134 9.947 17.033 -26.939 1.00 10.03 H new ATOM 0 HB3 ARG A 134 9.704 18.491 -27.881 1.00 10.03 H new ATOM 0 HG2 ARG A 134 7.848 17.624 -25.637 1.00 10.19 H new ATOM 0 HG3 ARG A 134 9.219 18.690 -25.400 1.00 10.19 H new ATOM 0 HD2 ARG A 134 6.891 19.224 -27.289 1.00 10.81 H new ATOM 0 HD3 ARG A 134 7.078 19.929 -25.695 1.00 10.81 H new ATOM 0 HE ARG A 134 9.374 20.392 -27.466 1.00 11.15 H new ATOM 0 HH11 ARG A 134 6.214 21.552 -26.378 1.00 12.25 H new ATOM 0 HH12 ARG A 134 6.527 23.217 -26.879 1.00 12.25 H new ATOM 0 HH21 ARG A 134 9.764 22.528 -28.103 1.00 12.30 H new ATOM 0 HH22 ARG A 134 8.530 23.768 -27.853 1.00 12.30 H new ATOM 2076 N LYS A 135 10.151 15.665 -29.020 1.00 9.06 N ATOM 2077 CA LYS A 135 11.007 14.991 -29.976 1.00 9.00 C ATOM 2078 C LYS A 135 11.658 13.786 -29.331 1.00 9.08 C ATOM 2079 O LYS A 135 11.257 13.380 -28.241 1.00 9.30 O ATOM 2080 CB LYS A 135 12.074 15.940 -30.504 1.00 8.75 C ATOM 2081 CG LYS A 135 12.601 16.917 -29.465 1.00 8.95 C ATOM 2082 CD LYS A 135 13.814 17.662 -29.984 1.00 9.28 C ATOM 2083 CE LYS A 135 13.930 19.053 -29.379 1.00 9.72 C ATOM 2084 NZ LYS A 135 14.011 19.021 -27.893 1.00 10.11 N ATOM 0 H LYS A 135 10.464 15.587 -28.052 1.00 9.06 H new ATOM 0 HA LYS A 135 10.394 14.659 -30.814 1.00 9.00 H new ATOM 0 HB2 LYS A 135 12.907 15.354 -30.892 1.00 8.75 H new ATOM 0 HB3 LYS A 135 11.663 16.503 -31.342 1.00 8.75 H new ATOM 0 HG2 LYS A 135 11.819 17.629 -29.200 1.00 8.95 H new ATOM 0 HG3 LYS A 135 12.863 16.378 -28.554 1.00 8.95 H new ATOM 0 HD2 LYS A 135 14.715 17.091 -29.757 1.00 9.28 H new ATOM 0 HD3 LYS A 135 13.753 17.743 -31.069 1.00 9.28 H new ATOM 0 HE2 LYS A 135 14.816 19.547 -29.778 1.00 9.72 H new ATOM 0 HE3 LYS A 135 13.069 19.650 -29.680 1.00 9.72 H new ATOM 0 HZ1 LYS A 135 14.123 19.989 -27.530 1.00 10.11 H new ATOM 0 HZ2 LYS A 135 13.140 18.605 -27.507 1.00 10.11 H new ATOM 0 HZ3 LYS A 135 14.827 18.446 -27.602 1.00 10.11 H new ATOM 2098 N LYS A 136 12.662 13.236 -30.017 1.00 9.17 N ATOM 2099 CA LYS A 136 13.353 12.017 -29.608 1.00 9.54 C ATOM 2100 C LYS A 136 12.483 10.784 -29.836 1.00 9.54 C ATOM 2101 O LYS A 136 12.989 9.699 -30.127 1.00 9.99 O ATOM 2102 CB LYS A 136 13.784 12.101 -28.148 1.00 10.03 C ATOM 2103 CG LYS A 136 14.850 13.147 -27.863 1.00 10.42 C ATOM 2104 CD LYS A 136 16.081 12.934 -28.721 1.00 10.60 C ATOM 2105 CE LYS A 136 17.282 13.700 -28.185 1.00 11.32 C ATOM 2106 NZ LYS A 136 17.077 15.170 -28.241 1.00 11.69 N ATOM 0 H LYS A 136 13.021 13.633 -30.885 1.00 9.17 H new ATOM 0 HA LYS A 136 14.245 11.921 -30.227 1.00 9.54 H new ATOM 0 HB2 LYS A 136 12.908 12.317 -27.536 1.00 10.03 H new ATOM 0 HB3 LYS A 136 14.158 11.126 -27.836 1.00 10.03 H new ATOM 0 HG2 LYS A 136 14.444 14.141 -28.048 1.00 10.42 H new ATOM 0 HG3 LYS A 136 15.128 13.107 -26.810 1.00 10.42 H new ATOM 0 HD2 LYS A 136 16.317 11.871 -28.761 1.00 10.60 H new ATOM 0 HD3 LYS A 136 15.872 13.253 -29.742 1.00 10.60 H new ATOM 0 HE2 LYS A 136 17.472 13.400 -27.155 1.00 11.32 H new ATOM 0 HE3 LYS A 136 18.168 13.436 -28.763 1.00 11.32 H new ATOM 0 HZ1 LYS A 136 17.925 15.653 -27.882 1.00 11.69 H new ATOM 0 HZ2 LYS A 136 16.904 15.459 -29.225 1.00 11.69 H new ATOM 0 HZ3 LYS A 136 16.258 15.429 -27.655 1.00 11.69 H new ATOM 2120 N GLY A 137 11.174 10.963 -29.735 1.00 9.28 N ATOM 2121 CA GLY A 137 10.256 9.853 -29.873 1.00 9.53 C ATOM 2122 C GLY A 137 10.010 9.153 -28.554 1.00 9.53 C ATOM 2123 O GLY A 137 9.637 9.788 -27.568 1.00 9.44 O ATOM 0 H GLY A 137 10.730 11.864 -29.559 1.00 9.28 H new ATOM 0 HA2 GLY A 137 9.309 10.214 -30.274 1.00 9.53 H new ATOM 0 HA3 GLY A 137 10.656 9.139 -30.593 1.00 9.53 H new ATOM 2127 N CYS A 138 10.209 7.847 -28.533 1.00 9.89 N ATOM 2128 CA CYS A 138 10.050 7.073 -27.316 1.00 10.22 C ATOM 2129 C CYS A 138 11.270 7.223 -26.418 1.00 9.92 C ATOM 2130 O CYS A 138 12.371 6.828 -26.786 1.00 9.94 O ATOM 2131 CB CYS A 138 9.825 5.600 -27.658 1.00 11.12 C ATOM 2132 SG CYS A 138 10.202 4.447 -26.318 1.00 12.01 S ATOM 0 H CYS A 138 10.482 7.299 -29.349 1.00 9.89 H new ATOM 0 HA CYS A 138 9.180 7.450 -26.778 1.00 10.22 H new ATOM 0 HB2 CYS A 138 8.785 5.465 -27.954 1.00 11.12 H new ATOM 0 HB3 CYS A 138 10.438 5.344 -28.522 1.00 11.12 H new ATOM 2137 N TRP A 139 11.071 7.801 -25.244 1.00 9.89 N ATOM 2138 CA TRP A 139 12.141 7.910 -24.260 1.00 9.90 C ATOM 2139 C TRP A 139 12.034 6.755 -23.277 1.00 10.86 C ATOM 2140 O TRP A 139 12.926 6.521 -22.463 1.00 11.32 O ATOM 2141 CB TRP A 139 12.043 9.227 -23.480 1.00 9.65 C ATOM 2142 CG TRP A 139 11.514 10.379 -24.279 1.00 9.03 C ATOM 2143 CD1 TRP A 139 12.225 11.239 -25.060 1.00 8.51 C ATOM 2144 CD2 TRP A 139 10.150 10.798 -24.357 1.00 9.20 C ATOM 2145 NE1 TRP A 139 11.384 12.170 -25.619 1.00 8.35 N ATOM 2146 CE2 TRP A 139 10.104 11.917 -25.205 1.00 8.78 C ATOM 2147 CE3 TRP A 139 8.960 10.329 -23.791 1.00 9.91 C ATOM 2148 CZ2 TRP A 139 8.914 12.577 -25.501 1.00 9.11 C ATOM 2149 CZ3 TRP A 139 7.782 10.984 -24.086 1.00 10.19 C ATOM 2150 CH2 TRP A 139 7.765 12.096 -24.933 1.00 9.81 C ATOM 0 H TRP A 139 10.181 8.202 -24.948 1.00 9.89 H new ATOM 0 HA TRP A 139 13.095 7.883 -24.787 1.00 9.90 H new ATOM 0 HB2 TRP A 139 11.400 9.075 -22.613 1.00 9.65 H new ATOM 0 HB3 TRP A 139 13.032 9.486 -23.102 1.00 9.65 H new ATOM 0 HD1 TRP A 139 13.293 11.195 -25.217 1.00 8.51 H new ATOM 0 HE1 TRP A 139 11.667 12.927 -26.241 1.00 8.35 H new ATOM 0 HE3 TRP A 139 8.963 9.471 -23.136 1.00 9.91 H new ATOM 0 HZ2 TRP A 139 8.898 13.437 -26.155 1.00 9.11 H new ATOM 0 HZ3 TRP A 139 6.857 10.631 -23.655 1.00 10.19 H new ATOM 0 HH2 TRP A 139 6.826 12.586 -25.144 1.00 9.81 H new ATOM 2161 N LYS A 140 10.930 6.029 -23.380 1.00 11.35 N ATOM 2162 CA LYS A 140 10.556 5.046 -22.377 1.00 12.41 C ATOM 2163 C LYS A 140 11.322 3.737 -22.541 1.00 12.91 C ATOM 2164 O LYS A 140 11.964 3.264 -21.605 1.00 13.52 O ATOM 2165 CB LYS A 140 9.056 4.777 -22.466 1.00 13.04 C ATOM 2166 CG LYS A 140 8.441 4.246 -21.183 1.00 14.05 C ATOM 2167 CD LYS A 140 8.499 5.276 -20.064 1.00 14.34 C ATOM 2168 CE LYS A 140 7.631 4.868 -18.886 1.00 15.50 C ATOM 2169 NZ LYS A 140 8.014 3.535 -18.351 1.00 16.11 N ATOM 0 H LYS A 140 10.273 6.105 -24.156 1.00 11.35 H new ATOM 0 HA LYS A 140 10.811 5.455 -21.399 1.00 12.41 H new ATOM 0 HB2 LYS A 140 8.549 5.701 -22.744 1.00 13.04 H new ATOM 0 HB3 LYS A 140 8.874 4.060 -23.267 1.00 13.04 H new ATOM 0 HG2 LYS A 140 7.404 3.965 -21.366 1.00 14.05 H new ATOM 0 HG3 LYS A 140 8.967 3.343 -20.874 1.00 14.05 H new ATOM 0 HD2 LYS A 140 9.530 5.397 -19.733 1.00 14.34 H new ATOM 0 HD3 LYS A 140 8.170 6.244 -20.442 1.00 14.34 H new ATOM 0 HE2 LYS A 140 7.717 5.614 -18.096 1.00 15.50 H new ATOM 0 HE3 LYS A 140 6.586 4.849 -19.195 1.00 15.50 H new ATOM 0 HZ1 LYS A 140 7.493 3.352 -17.470 1.00 16.11 H new ATOM 0 HZ2 LYS A 140 7.781 2.801 -19.050 1.00 16.11 H new ATOM 0 HZ3 LYS A 140 9.036 3.519 -18.159 1.00 16.11 H new ATOM 2183 N CYS A 141 11.257 3.150 -23.729 1.00 12.82 N ATOM 2184 CA CYS A 141 11.831 1.827 -23.930 1.00 13.44 C ATOM 2185 C CYS A 141 12.864 1.833 -25.047 1.00 13.01 C ATOM 2186 O CYS A 141 13.708 0.939 -25.127 1.00 13.56 O ATOM 2187 CB CYS A 141 10.726 0.816 -24.247 1.00 13.82 C ATOM 2188 SG CYS A 141 10.244 0.726 -25.989 1.00 13.97 S ATOM 0 H CYS A 141 10.821 3.560 -24.555 1.00 12.82 H new ATOM 0 HA CYS A 141 12.333 1.537 -23.007 1.00 13.44 H new ATOM 0 HB2 CYS A 141 11.056 -0.172 -23.926 1.00 13.82 H new ATOM 0 HB3 CYS A 141 9.846 1.066 -23.655 1.00 13.82 H new ATOM 2193 N GLY A 142 12.811 2.845 -25.896 1.00 12.16 N ATOM 2194 CA GLY A 142 13.727 2.911 -27.010 1.00 11.86 C ATOM 2195 C GLY A 142 14.801 3.942 -26.784 1.00 11.95 C ATOM 2196 O GLY A 142 15.981 3.682 -27.031 1.00 12.26 O ATOM 0 H GLY A 142 12.151 3.620 -25.833 1.00 12.16 H new ATOM 0 HA2 GLY A 142 14.186 1.934 -27.163 1.00 11.86 H new ATOM 0 HA3 GLY A 142 13.177 3.151 -27.920 1.00 11.86 H new ATOM 2200 N LYS A 143 14.376 5.108 -26.306 1.00 11.90 N ATOM 2201 CA LYS A 143 15.258 6.248 -26.039 1.00 12.23 C ATOM 2202 C LYS A 143 15.731 6.869 -27.351 1.00 11.90 C ATOM 2203 O LYS A 143 15.438 8.025 -27.645 1.00 11.44 O ATOM 2204 CB LYS A 143 16.450 5.837 -25.164 1.00 13.11 C ATOM 2205 CG LYS A 143 17.125 7.000 -24.451 1.00 13.82 C ATOM 2206 CD LYS A 143 17.937 7.872 -25.394 1.00 14.46 C ATOM 2207 CE LYS A 143 18.538 9.064 -24.668 1.00 15.30 C ATOM 2208 NZ LYS A 143 19.372 8.646 -23.512 1.00 15.88 N ATOM 0 H LYS A 143 13.397 5.294 -26.089 1.00 11.90 H new ATOM 0 HA LYS A 143 14.690 6.996 -25.487 1.00 12.23 H new ATOM 0 HB2 LYS A 143 16.110 5.116 -24.420 1.00 13.11 H new ATOM 0 HB3 LYS A 143 17.187 5.329 -25.787 1.00 13.11 H new ATOM 0 HG2 LYS A 143 16.367 7.610 -23.961 1.00 13.82 H new ATOM 0 HG3 LYS A 143 17.777 6.612 -23.668 1.00 13.82 H new ATOM 0 HD2 LYS A 143 18.733 7.280 -25.845 1.00 14.46 H new ATOM 0 HD3 LYS A 143 17.301 8.222 -26.207 1.00 14.46 H new ATOM 0 HE2 LYS A 143 19.145 9.644 -25.363 1.00 15.30 H new ATOM 0 HE3 LYS A 143 17.738 9.718 -24.321 1.00 15.30 H new ATOM 0 HZ1 LYS A 143 19.897 9.467 -23.148 1.00 15.88 H new ATOM 0 HZ2 LYS A 143 18.760 8.266 -22.762 1.00 15.88 H new ATOM 0 HZ3 LYS A 143 20.044 7.912 -23.816 1.00 15.88 H new ATOM 2222 N GLU A 144 16.470 6.095 -28.126 1.00 12.31 N ATOM 2223 CA GLU A 144 16.945 6.540 -29.428 1.00 12.29 C ATOM 2224 C GLU A 144 15.896 6.298 -30.512 1.00 12.31 C ATOM 2225 O GLU A 144 16.042 6.774 -31.641 1.00 12.33 O ATOM 2226 CB GLU A 144 18.246 5.825 -29.796 1.00 13.02 C ATOM 2227 CG GLU A 144 19.438 6.247 -28.954 1.00 13.41 C ATOM 2228 CD GLU A 144 19.728 7.731 -29.052 1.00 13.89 C ATOM 2229 OE1 GLU A 144 19.857 8.240 -30.183 1.00 14.11 O ATOM 2230 OE2 GLU A 144 19.833 8.394 -27.999 1.00 14.20 O ATOM 0 H GLU A 144 16.757 5.149 -27.876 1.00 12.31 H new ATOM 0 HA GLU A 144 17.132 7.612 -29.364 1.00 12.29 H new ATOM 0 HB2 GLU A 144 18.101 4.750 -29.690 1.00 13.02 H new ATOM 0 HB3 GLU A 144 18.469 6.015 -30.846 1.00 13.02 H new ATOM 0 HG2 GLU A 144 19.252 5.985 -27.912 1.00 13.41 H new ATOM 0 HG3 GLU A 144 20.318 5.687 -29.271 1.00 13.41 H new ATOM 2237 N GLY A 145 14.837 5.576 -30.170 1.00 12.50 N ATOM 2238 CA GLY A 145 13.821 5.256 -31.153 1.00 12.76 C ATOM 2239 C GLY A 145 12.542 4.724 -30.536 1.00 12.89 C ATOM 2240 O GLY A 145 12.298 4.914 -29.344 1.00 13.35 O ATOM 0 H GLY A 145 14.664 5.208 -29.235 1.00 12.50 H new ATOM 0 HA2 GLY A 145 13.593 6.149 -31.734 1.00 12.76 H new ATOM 0 HA3 GLY A 145 14.217 4.516 -31.848 1.00 12.76 H new ATOM 2244 N HIS A 146 11.754 4.040 -31.370 1.00 12.67 N ATOM 2245 CA HIS A 146 10.431 3.505 -31.020 1.00 12.99 C ATOM 2246 C HIS A 146 9.370 4.611 -31.026 1.00 12.58 C ATOM 2247 O HIS A 146 9.644 5.764 -30.687 1.00 11.92 O ATOM 2248 CB HIS A 146 10.423 2.756 -29.670 1.00 13.11 C ATOM 2249 CG HIS A 146 9.142 2.003 -29.441 1.00 13.73 C ATOM 2250 ND1 HIS A 146 8.270 2.312 -28.410 1.00 13.78 N ATOM 2251 CD2 HIS A 146 8.603 1.011 -30.193 1.00 14.46 C ATOM 2252 CE1 HIS A 146 7.230 1.511 -28.587 1.00 14.54 C ATOM 2253 NE2 HIS A 146 7.389 0.711 -29.648 1.00 14.96 N ATOM 0 H HIS A 146 12.023 3.837 -32.333 1.00 12.67 H new ATOM 0 HA HIS A 146 10.184 2.774 -31.790 1.00 12.99 H new ATOM 0 HB2 HIS A 146 11.261 2.060 -29.639 1.00 13.11 H new ATOM 0 HB3 HIS A 146 10.571 3.470 -28.860 1.00 13.11 H new ATOM 0 HD2 HIS A 146 9.050 0.547 -31.059 1.00 14.46 H new ATOM 0 HE1 HIS A 146 6.357 1.504 -27.951 1.00 14.54 H new ATOM 0 HE2 HIS A 146 6.728 0.011 -29.985 1.00 14.96 H new ATOM 2261 N GLN A 147 8.162 4.246 -31.443 1.00 13.15 N ATOM 2262 CA GLN A 147 7.042 5.178 -31.502 1.00 13.06 C ATOM 2263 C GLN A 147 6.474 5.433 -30.109 1.00 12.82 C ATOM 2264 O GLN A 147 5.925 4.530 -29.478 1.00 13.08 O ATOM 2265 CB GLN A 147 5.942 4.626 -32.409 1.00 14.01 C ATOM 2266 CG GLN A 147 6.359 4.478 -33.862 1.00 14.38 C ATOM 2267 CD GLN A 147 5.308 3.772 -34.695 1.00 14.79 C ATOM 2268 OE1 GLN A 147 4.414 4.406 -35.258 1.00 14.85 O ATOM 2269 NE2 GLN A 147 5.405 2.454 -34.778 1.00 15.24 N ATOM 0 H GLN A 147 7.933 3.300 -31.748 1.00 13.15 H new ATOM 0 HA GLN A 147 7.408 6.120 -31.909 1.00 13.06 H new ATOM 0 HB2 GLN A 147 5.627 3.654 -32.031 1.00 14.01 H new ATOM 0 HB3 GLN A 147 5.075 5.285 -32.355 1.00 14.01 H new ATOM 0 HG2 GLN A 147 6.551 5.464 -34.284 1.00 14.38 H new ATOM 0 HG3 GLN A 147 7.295 3.921 -33.914 1.00 14.38 H new ATOM 0 HE21 GLN A 147 6.161 1.967 -34.296 1.00 15.24 H new ATOM 0 HE22 GLN A 147 4.724 1.926 -35.324 1.00 15.24 H new ATOM 2278 N MET A 148 6.584 6.673 -29.646 1.00 12.52 N ATOM 2279 CA MET A 148 6.120 7.038 -28.305 1.00 12.47 C ATOM 2280 C MET A 148 4.603 6.927 -28.164 1.00 13.37 C ATOM 2281 O MET A 148 4.085 6.855 -27.049 1.00 13.85 O ATOM 2282 CB MET A 148 6.595 8.448 -27.907 1.00 11.69 C ATOM 2283 CG MET A 148 6.420 9.532 -28.971 1.00 11.72 C ATOM 2284 SD MET A 148 4.701 9.864 -29.407 1.00 11.68 S ATOM 2285 CE MET A 148 4.920 11.141 -30.641 1.00 11.96 C ATOM 0 H MET A 148 6.989 7.445 -30.176 1.00 12.52 H new ATOM 0 HA MET A 148 6.567 6.317 -27.620 1.00 12.47 H new ATOM 0 HB2 MET A 148 6.055 8.754 -27.011 1.00 11.69 H new ATOM 0 HB3 MET A 148 7.650 8.394 -27.640 1.00 11.69 H new ATOM 0 HG2 MET A 148 6.878 10.454 -28.614 1.00 11.72 H new ATOM 0 HG3 MET A 148 6.961 9.235 -29.870 1.00 11.72 H new ATOM 0 HE1 MET A 148 3.981 11.677 -30.781 1.00 11.96 H new ATOM 0 HE2 MET A 148 5.690 11.838 -30.310 1.00 11.96 H new ATOM 0 HE3 MET A 148 5.223 10.687 -31.585 1.00 11.96 H new ATOM 2295 N LYS A 149 3.893 6.898 -29.285 1.00 13.75 N ATOM 2296 CA LYS A 149 2.441 6.822 -29.267 1.00 14.74 C ATOM 2297 C LYS A 149 1.968 5.389 -29.072 1.00 15.59 C ATOM 2298 O LYS A 149 0.862 5.153 -28.589 1.00 16.38 O ATOM 2299 CB LYS A 149 1.878 7.392 -30.566 1.00 15.07 C ATOM 2300 CG LYS A 149 2.704 7.032 -31.790 1.00 14.89 C ATOM 2301 CD LYS A 149 1.975 7.363 -33.074 1.00 14.96 C ATOM 2302 CE LYS A 149 1.569 8.829 -33.144 1.00 15.59 C ATOM 2303 NZ LYS A 149 2.744 9.743 -33.098 1.00 15.96 N ATOM 0 H LYS A 149 4.302 6.926 -30.219 1.00 13.75 H new ATOM 0 HA LYS A 149 2.076 7.412 -28.426 1.00 14.74 H new ATOM 0 HB2 LYS A 149 0.860 7.027 -30.703 1.00 15.07 H new ATOM 0 HB3 LYS A 149 1.819 8.477 -30.483 1.00 15.07 H new ATOM 0 HG2 LYS A 149 3.652 7.570 -31.761 1.00 14.89 H new ATOM 0 HG3 LYS A 149 2.940 5.968 -31.770 1.00 14.89 H new ATOM 0 HD2 LYS A 149 2.614 7.124 -33.924 1.00 14.96 H new ATOM 0 HD3 LYS A 149 1.086 6.737 -33.157 1.00 14.96 H new ATOM 0 HE2 LYS A 149 1.010 9.005 -34.063 1.00 15.59 H new ATOM 0 HE3 LYS A 149 0.900 9.059 -32.315 1.00 15.59 H new ATOM 0 HZ1 LYS A 149 2.471 10.678 -33.463 1.00 15.96 H new ATOM 0 HZ2 LYS A 149 3.072 9.838 -32.116 1.00 15.96 H new ATOM 0 HZ3 LYS A 149 3.510 9.353 -33.683 1.00 15.96 H new ATOM 2317 N ASP A 150 2.814 4.437 -29.430 1.00 15.52 N ATOM 2318 CA ASP A 150 2.466 3.027 -29.312 1.00 16.41 C ATOM 2319 C ASP A 150 3.272 2.369 -28.206 1.00 16.34 C ATOM 2320 O ASP A 150 3.422 1.146 -28.166 1.00 17.13 O ATOM 2321 CB ASP A 150 2.683 2.295 -30.638 1.00 16.67 C ATOM 2322 CG ASP A 150 1.531 2.493 -31.600 1.00 17.24 C ATOM 2323 OD1 ASP A 150 0.635 1.620 -31.649 1.00 17.41 O ATOM 2324 OD2 ASP A 150 1.507 3.519 -32.313 1.00 17.63 O ATOM 0 H ASP A 150 3.746 4.613 -29.805 1.00 15.52 H new ATOM 0 HA ASP A 150 1.408 2.962 -29.058 1.00 16.41 H new ATOM 0 HB2 ASP A 150 3.604 2.650 -31.100 1.00 16.67 H new ATOM 0 HB3 ASP A 150 2.813 1.230 -30.445 1.00 16.67 H new ATOM 2329 N CYS A 151 3.789 3.187 -27.310 1.00 15.51 N ATOM 2330 CA CYS A 151 4.565 2.687 -26.198 1.00 15.54 C ATOM 2331 C CYS A 151 3.717 2.689 -24.935 1.00 15.97 C ATOM 2332 O CYS A 151 3.735 3.647 -24.160 1.00 15.64 O ATOM 2333 CB CYS A 151 5.815 3.540 -25.997 1.00 14.63 C ATOM 2334 SG CYS A 151 7.151 2.699 -25.118 1.00 14.46 S ATOM 0 H CYS A 151 3.684 4.201 -27.333 1.00 15.51 H new ATOM 0 HA CYS A 151 4.876 1.665 -26.415 1.00 15.54 H new ATOM 0 HB2 CYS A 151 6.182 3.862 -26.971 1.00 14.63 H new ATOM 0 HB3 CYS A 151 5.542 4.440 -25.446 1.00 14.63 H new ATOM 2339 N THR A 152 2.952 1.629 -24.748 1.00 16.85 N ATOM 2340 CA THR A 152 2.166 1.477 -23.545 1.00 17.48 C ATOM 2341 C THR A 152 2.974 0.704 -22.507 1.00 17.79 C ATOM 2342 O THR A 152 3.581 -0.325 -22.814 1.00 18.21 O ATOM 2343 CB THR A 152 0.813 0.778 -23.827 1.00 18.43 C ATOM 2344 OG1 THR A 152 0.014 0.746 -22.639 1.00 18.64 O ATOM 2345 CG2 THR A 152 1.009 -0.640 -24.349 1.00 18.95 C ATOM 0 H THR A 152 2.861 0.863 -25.415 1.00 16.85 H new ATOM 0 HA THR A 152 1.934 2.468 -23.156 1.00 17.48 H new ATOM 0 HB THR A 152 0.302 1.355 -24.597 1.00 18.43 H new ATOM 0 HG1 THR A 152 -0.839 0.303 -22.830 1.00 18.64 H new ATOM 0 HG21 THR A 152 0.037 -1.097 -24.535 1.00 18.95 H new ATOM 0 HG22 THR A 152 1.579 -0.610 -25.277 1.00 18.95 H new ATOM 0 HG23 THR A 152 1.551 -1.229 -23.609 1.00 18.95 H new ATOM 2353 N GLU A 153 3.021 1.233 -21.298 1.00 17.71 N ATOM 2354 CA GLU A 153 3.802 0.633 -20.231 1.00 18.13 C ATOM 2355 C GLU A 153 3.173 -0.676 -19.779 1.00 19.12 C ATOM 2356 O GLU A 153 2.104 -0.683 -19.160 1.00 19.35 O ATOM 2357 CB GLU A 153 3.921 1.591 -19.041 1.00 17.70 C ATOM 2358 CG GLU A 153 4.267 3.019 -19.433 1.00 17.60 C ATOM 2359 CD GLU A 153 3.041 3.902 -19.575 1.00 17.59 C ATOM 2360 OE1 GLU A 153 2.992 4.963 -18.916 1.00 17.64 O ATOM 2361 OE2 GLU A 153 2.114 3.534 -20.330 1.00 17.65 O ATOM 0 H GLU A 153 2.524 2.082 -21.029 1.00 17.71 H new ATOM 0 HA GLU A 153 4.800 0.430 -20.618 1.00 18.13 H new ATOM 0 HB2 GLU A 153 2.979 1.593 -18.493 1.00 17.70 H new ATOM 0 HB3 GLU A 153 4.685 1.216 -18.360 1.00 17.70 H new ATOM 0 HG2 GLU A 153 4.932 3.446 -18.683 1.00 17.60 H new ATOM 0 HG3 GLU A 153 4.814 3.010 -20.376 1.00 17.60 H new ATOM 2368 N ARG A 154 3.828 -1.779 -20.104 1.00 19.80 N ATOM 2369 CA ARG A 154 3.365 -3.094 -19.701 1.00 20.84 C ATOM 2370 C ARG A 154 4.546 -3.972 -19.314 1.00 21.28 C ATOM 2371 O ARG A 154 5.402 -4.276 -20.148 1.00 21.68 O ATOM 2372 CB ARG A 154 2.562 -3.748 -20.828 1.00 21.38 C ATOM 2373 CG ARG A 154 2.005 -5.113 -20.461 1.00 21.89 C ATOM 2374 CD ARG A 154 1.166 -5.697 -21.584 1.00 22.33 C ATOM 2375 NE ARG A 154 0.679 -7.035 -21.256 1.00 22.67 N ATOM 2376 CZ ARG A 154 -0.209 -7.709 -21.982 1.00 23.08 C ATOM 2377 NH1 ARG A 154 -0.737 -7.167 -23.073 1.00 23.21 N ATOM 2378 NH2 ARG A 154 -0.570 -8.931 -21.613 1.00 23.48 N ATOM 0 H ARG A 154 4.689 -1.787 -20.651 1.00 19.80 H new ATOM 0 HA ARG A 154 2.714 -2.982 -18.834 1.00 20.84 H new ATOM 0 HB2 ARG A 154 1.738 -3.091 -21.105 1.00 21.38 H new ATOM 0 HB3 ARG A 154 3.199 -3.848 -21.707 1.00 21.38 H new ATOM 0 HG2 ARG A 154 2.826 -5.791 -20.230 1.00 21.89 H new ATOM 0 HG3 ARG A 154 1.398 -5.028 -19.559 1.00 21.89 H new ATOM 0 HD2 ARG A 154 0.319 -5.041 -21.785 1.00 22.33 H new ATOM 0 HD3 ARG A 154 1.760 -5.740 -22.497 1.00 22.33 H new ATOM 0 HE ARG A 154 1.044 -7.482 -20.415 1.00 22.67 H new ATOM 0 HH11 ARG A 154 -0.462 -6.227 -23.360 1.00 23.21 H new ATOM 0 HH12 ARG A 154 -1.417 -7.690 -23.624 1.00 23.21 H new ATOM 0 HH21 ARG A 154 -0.167 -9.351 -20.775 1.00 23.48 H new ATOM 0 HH22 ARG A 154 -1.251 -9.451 -22.167 1.00 23.48 H new ATOM 2392 N GLN A 155 4.589 -4.355 -18.038 1.00 21.32 N ATOM 2393 CA GLN A 155 5.655 -5.197 -17.500 1.00 21.85 C ATOM 2394 C GLN A 155 7.022 -4.542 -17.716 1.00 22.14 C ATOM 2395 O GLN A 155 8.018 -5.207 -18.013 1.00 22.34 O ATOM 2396 CB GLN A 155 5.601 -6.594 -18.137 1.00 21.93 C ATOM 2397 CG GLN A 155 6.379 -7.655 -17.369 1.00 22.12 C ATOM 2398 CD GLN A 155 5.840 -7.876 -15.968 1.00 22.30 C ATOM 2399 OE1 GLN A 155 4.644 -7.720 -15.711 1.00 22.37 O ATOM 2400 NE2 GLN A 155 6.718 -8.240 -15.050 1.00 22.51 N ATOM 0 H GLN A 155 3.885 -4.090 -17.349 1.00 21.32 H new ATOM 0 HA GLN A 155 5.506 -5.307 -16.426 1.00 21.85 H new ATOM 0 HB2 GLN A 155 4.560 -6.907 -18.215 1.00 21.93 H new ATOM 0 HB3 GLN A 155 5.993 -6.535 -19.152 1.00 21.93 H new ATOM 0 HG2 GLN A 155 6.344 -8.595 -17.920 1.00 22.12 H new ATOM 0 HG3 GLN A 155 7.426 -7.359 -17.309 1.00 22.12 H new ATOM 0 HE21 GLN A 155 7.699 -8.359 -15.302 1.00 22.51 H new ATOM 0 HE22 GLN A 155 6.414 -8.402 -14.090 1.00 22.51 H new ATOM 2409 N ALA A 156 7.063 -3.226 -17.566 1.00 22.27 N ATOM 2410 CA ALA A 156 8.296 -2.473 -17.741 1.00 22.67 C ATOM 2411 C ALA A 156 8.435 -1.423 -16.648 1.00 23.02 C ATOM 2412 O ALA A 156 9.341 -1.498 -15.814 1.00 23.30 O ATOM 2413 CB ALA A 156 8.327 -1.822 -19.116 1.00 22.74 C ATOM 0 H ALA A 156 6.253 -2.656 -17.323 1.00 22.27 H new ATOM 0 HA ALA A 156 9.138 -3.161 -17.666 1.00 22.67 H new ATOM 0 HB1 ALA A 156 9.255 -1.262 -19.233 1.00 22.74 H new ATOM 0 HB2 ALA A 156 8.269 -2.593 -19.885 1.00 22.74 H new ATOM 0 HB3 ALA A 156 7.479 -1.144 -19.217 1.00 22.74 H new ATOM 2419 N ASN A 157 7.525 -0.457 -16.659 1.00 23.11 N ATOM 2420 CA ASN A 157 7.492 0.605 -15.663 1.00 23.57 C ATOM 2421 C ASN A 157 6.255 1.465 -15.885 1.00 23.76 C ATOM 2422 O ASN A 157 5.186 1.116 -15.342 1.00 23.91 O ATOM 2423 CB ASN A 157 8.760 1.467 -15.731 1.00 23.80 C ATOM 2424 CG ASN A 157 8.790 2.544 -14.662 1.00 23.98 C ATOM 2425 OD1 ASN A 157 8.354 3.673 -14.888 1.00 23.92 O ATOM 2426 ND2 ASN A 157 9.302 2.203 -13.489 1.00 24.30 N ATOM 2427 OXT ASN A 157 6.341 2.458 -16.634 1.00 23.85 O ATOM 0 H ASN A 157 6.788 -0.388 -17.361 1.00 23.11 H new ATOM 0 HA ASN A 157 7.451 0.154 -14.671 1.00 23.57 H new ATOM 0 HB2 ASN A 157 9.636 0.828 -15.622 1.00 23.80 H new ATOM 0 HB3 ASN A 157 8.826 1.934 -16.714 1.00 23.80 H new ATOM 0 HD21 ASN A 157 9.345 2.887 -12.733 1.00 24.30 H new ATOM 0 HD22 ASN A 157 9.653 1.257 -13.341 1.00 24.30 H new TER 2434 ASN A 157 HETATM 2435 ZN ZN A 201 9.304 19.784 -20.661 1.00 9.38 ZN HETATM 2436 ZN ZN A 202 8.944 2.536 -26.538 1.00 13.43 ZN