USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=40 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 111 GLN : amide:sc= 0.678 X(o=0.17,f=-0.031) USER MOD Set 1.2: A 114 THR OG1 : rot 119:sc= -0.51 USER MOD Set 2.1: A 49 GLN : amide:sc= -0.135 K(o=-1.8,f=-4.9) USER MOD Set 2.2: A 56 LYS NZ :NH3+ -144:sc= -1.71! (180deg=-2.48!) USER MOD Single : A 1 MET CE :methyl 162:sc= -0.104 (180deg=-0.58) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.0746) USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -2.56! X(o=-2.6!,f=-2.1) USER MOD Single : A 15 LYS NZ :NH3+ 165:sc= 0.794 (180deg=0.183) USER MOD Single : A 21 TYR OH : rot 42:sc= 0.371 USER MOD Single : A 26 TYR OH : rot 180:sc= 0.131 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -52:sc= 0.866 USER MOD Single : A 33 GLN : amide:sc= -0.0312 K(o=-0.031,f=-0.75) USER MOD Single : A 35 SER OG : rot 180:sc= 0.00147 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ -116:sc= 2.05 (180deg=0.369) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0.35) USER MOD Single : A 43 THR OG1 : rot -93:sc= 1.25 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -2.21! C(o=-2.2!,f=-5.1!) USER MOD Single : A 52 ASN : amide:sc= -1.13 K(o=-1.1,f=-3.8!) USER MOD Single : A 55 CYS SG : rot 167:sc= -4.48! USER MOD Single : A 57 THR OG1 : rot 53:sc= 1.23 USER MOD Single : A 60 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0155) USER MOD Single : A 67 THR OG1 : rot 71:sc= 1.2 USER MOD Single : A 71 MET CE :methyl 170:sc= -0.527 (180deg=-0.837) USER MOD Single : A 72 MET CE :methyl -166:sc= -0.159 (180deg=-0.649) USER MOD Single : A 73 THR OG1 : rot 78:sc= 1.11 USER MOD Single : A 75 CYS SG : rot 108:sc= -2.27! USER MOD Single : A 76 GLN : amide:sc= -0.703 K(o=-0.7,f=-2.1!) USER MOD Single : A 83 HIS : no HD1:sc= -0.759 X(o=-0.76,f=-0.52) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 141:sc= -0.113 (180deg=-0.713) USER MOD Single : A 93 SER OG : rot 95:sc= 0.44 USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0381 USER MOD Single : A 97 ASN : amide:sc= -2.42 K(o=-2.4,f=-5.9!) USER MOD Single : A 100 THR OG1 : rot -174:sc= -0.753 USER MOD Single : A 102 MET CE :methyl -162:sc= -0.119 (180deg=-0.541) USER MOD Single : A 104 GLN : amide:sc= -0.915! K(o=-0.91!,f=-0.11) USER MOD Single : A 105 LYS NZ :NH3+ 160:sc= -0.0462 (180deg=-0.377) USER MOD Single : A 107 ASN : amide:sc= -0.125 K(o=-0.13,f=-2.3!) USER MOD Single : A 110 ASN : amide:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 158:sc= -0.0924 (180deg=-0.462) USER MOD Single : A 116 LYS NZ :NH3+ -128:sc= 0.945 (180deg=-0.28) USER MOD Single : A 119 ASN : amide:sc= -2.67! C(o=-2.7!,f=-12!) USER MOD Single : A 122 LYS NZ :NH3+ -137:sc= -0.0807 (180deg=-0.481) USER MOD Single : A 128 LYS NZ :NH3+ 171:sc=-0.00796 (180deg=-0.119) USER MOD Single : A 129 ASN : amide:sc= -0.0087 X(o=-0.0087,f=-0.0087) USER MOD Single : A 135 LYS NZ :NH3+ 163:sc= -0.0239 (180deg=-0.246) USER MOD Single : A 136 LYS NZ :NH3+ 177:sc= 1.26 (180deg=1.19) USER MOD Single : A 140 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0249) USER MOD Single : A 143 LYS NZ :NH3+ 173:sc= 1.29 (180deg=1.07) USER MOD Single : A 147 GLN : amide:sc= -1.48! C(o=-1.5!,f=-6.2!) USER MOD Single : A 148 MET CE :methyl -172:sc= 0 (180deg=-0.134) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 GLN : amide:sc= -0.0825 X(o=-0.083,f=-0.083) USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.070 -9.941 -19.940 1.00 20.39 N ATOM 2 CA MET A 1 27.269 -9.543 -21.122 1.00 19.96 C ATOM 3 C MET A 1 27.374 -8.045 -21.359 1.00 19.35 C ATOM 4 O MET A 1 27.895 -7.603 -22.382 1.00 19.23 O ATOM 5 CB MET A 1 25.802 -9.940 -20.937 1.00 20.24 C ATOM 6 CG MET A 1 25.565 -11.440 -20.996 1.00 20.56 C ATOM 7 SD MET A 1 23.850 -11.892 -20.659 1.00 20.81 S ATOM 8 CE MET A 1 22.994 -11.026 -21.976 1.00 20.97 C ATOM 0 H1 MET A 1 28.112 -10.979 -19.882 1.00 20.39 H new ATOM 0 H2 MET A 1 29.034 -9.560 -20.030 1.00 20.39 H new ATOM 0 H3 MET A 1 27.627 -9.564 -19.078 1.00 20.39 H new ATOM 0 HA MET A 1 27.667 -10.065 -21.992 1.00 19.96 H new ATOM 0 HB2 MET A 1 25.451 -9.563 -19.977 1.00 20.24 H new ATOM 0 HB3 MET A 1 25.203 -9.455 -21.708 1.00 20.24 H new ATOM 0 HG2 MET A 1 25.846 -11.809 -21.982 1.00 20.56 H new ATOM 0 HG3 MET A 1 26.215 -11.934 -20.274 1.00 20.56 H new ATOM 0 HE1 MET A 1 21.997 -11.448 -22.101 1.00 20.97 H new ATOM 0 HE2 MET A 1 22.911 -9.969 -21.723 1.00 20.97 H new ATOM 0 HE3 MET A 1 23.553 -11.133 -22.906 1.00 20.97 H new ATOM 20 N TYR A 2 26.883 -7.264 -20.410 1.00 19.08 N ATOM 21 CA TYR A 2 26.939 -5.816 -20.507 1.00 18.61 C ATOM 22 C TYR A 2 26.885 -5.206 -19.115 1.00 17.62 C ATOM 23 O TYR A 2 25.828 -5.173 -18.480 1.00 17.34 O ATOM 24 CB TYR A 2 25.788 -5.288 -21.370 1.00 19.12 C ATOM 25 CG TYR A 2 25.778 -3.783 -21.517 1.00 19.80 C ATOM 26 CD1 TYR A 2 24.811 -3.012 -20.883 1.00 19.93 C ATOM 27 CD2 TYR A 2 26.736 -3.132 -22.284 1.00 20.43 C ATOM 28 CE1 TYR A 2 24.801 -1.639 -21.009 1.00 20.67 C ATOM 29 CE2 TYR A 2 26.731 -1.756 -22.414 1.00 21.16 C ATOM 30 CZ TYR A 2 25.761 -1.015 -21.774 1.00 21.27 C ATOM 31 OH TYR A 2 25.752 0.355 -21.900 1.00 22.10 O ATOM 0 H TYR A 2 26.439 -7.612 -19.560 1.00 19.08 H new ATOM 0 HA TYR A 2 27.877 -5.530 -20.983 1.00 18.61 H new ATOM 0 HB2 TYR A 2 25.851 -5.740 -22.360 1.00 19.12 H new ATOM 0 HB3 TYR A 2 24.842 -5.608 -20.933 1.00 19.12 H new ATOM 0 HD1 TYR A 2 24.055 -3.496 -20.282 1.00 19.93 H new ATOM 0 HD2 TYR A 2 27.497 -3.710 -22.787 1.00 20.43 H new ATOM 0 HE1 TYR A 2 24.043 -1.055 -20.509 1.00 20.67 H new ATOM 0 HE2 TYR A 2 27.483 -1.264 -23.014 1.00 21.16 H new ATOM 0 HH TYR A 2 26.496 0.636 -22.472 1.00 22.10 H new ATOM 41 N SER A 3 28.026 -4.740 -18.642 1.00 17.23 N ATOM 42 CA SER A 3 28.128 -4.174 -17.310 1.00 16.40 C ATOM 43 C SER A 3 28.682 -2.750 -17.369 1.00 15.74 C ATOM 44 O SER A 3 29.898 -2.548 -17.401 1.00 15.62 O ATOM 45 CB SER A 3 29.017 -5.063 -16.443 1.00 16.48 C ATOM 46 OG SER A 3 28.531 -6.396 -16.426 1.00 16.86 O ATOM 0 H SER A 3 28.901 -4.743 -19.165 1.00 17.23 H new ATOM 0 HA SER A 3 27.133 -4.127 -16.867 1.00 16.40 H new ATOM 0 HB2 SER A 3 30.038 -5.048 -16.825 1.00 16.48 H new ATOM 0 HB3 SER A 3 29.051 -4.670 -15.427 1.00 16.48 H new ATOM 0 HG SER A 3 29.115 -6.950 -15.867 1.00 16.86 H new ATOM 52 N PRO A 4 27.793 -1.745 -17.397 1.00 15.46 N ATOM 53 CA PRO A 4 28.194 -0.336 -17.472 1.00 15.00 C ATOM 54 C PRO A 4 28.820 0.160 -16.170 1.00 14.24 C ATOM 55 O PRO A 4 28.751 -0.508 -15.134 1.00 13.43 O ATOM 56 CB PRO A 4 26.877 0.391 -17.748 1.00 15.20 C ATOM 57 CG PRO A 4 25.827 -0.493 -17.175 1.00 15.47 C ATOM 58 CD PRO A 4 26.326 -1.900 -17.356 1.00 15.76 C ATOM 0 HA PRO A 4 28.956 -0.167 -18.233 1.00 15.00 H new ATOM 0 HB2 PRO A 4 26.863 1.376 -17.281 1.00 15.20 H new ATOM 0 HB3 PRO A 4 26.726 0.543 -18.817 1.00 15.20 H new ATOM 0 HG2 PRO A 4 25.662 -0.270 -16.121 1.00 15.47 H new ATOM 0 HG3 PRO A 4 24.874 -0.348 -17.684 1.00 15.47 H new ATOM 0 HD2 PRO A 4 26.014 -2.545 -16.535 1.00 15.76 H new ATOM 0 HD3 PRO A 4 25.944 -2.346 -18.274 1.00 15.76 H new ATOM 66 N THR A 5 29.415 1.346 -16.231 1.00 14.65 N ATOM 67 CA THR A 5 30.112 1.926 -15.091 1.00 14.22 C ATOM 68 C THR A 5 29.155 2.209 -13.935 1.00 13.17 C ATOM 69 O THR A 5 29.566 2.265 -12.777 1.00 12.56 O ATOM 70 CB THR A 5 30.817 3.233 -15.487 1.00 15.22 C ATOM 71 OG1 THR A 5 31.540 3.045 -16.711 1.00 15.79 O ATOM 72 CG2 THR A 5 31.770 3.681 -14.390 1.00 15.33 C ATOM 0 H THR A 5 29.428 1.929 -17.068 1.00 14.65 H new ATOM 0 HA THR A 5 30.853 1.195 -14.766 1.00 14.22 H new ATOM 0 HB THR A 5 30.061 4.005 -15.628 1.00 15.22 H new ATOM 0 HG1 THR A 5 31.986 3.882 -16.959 1.00 15.79 H new ATOM 0 HG21 THR A 5 32.259 4.608 -14.689 1.00 15.33 H new ATOM 0 HG22 THR A 5 31.212 3.846 -13.468 1.00 15.33 H new ATOM 0 HG23 THR A 5 32.523 2.910 -14.225 1.00 15.33 H new ATOM 80 N SER A 6 27.877 2.358 -14.262 1.00 13.06 N ATOM 81 CA SER A 6 26.843 2.650 -13.275 1.00 12.17 C ATOM 82 C SER A 6 26.787 1.587 -12.173 1.00 11.07 C ATOM 83 O SER A 6 26.228 1.824 -11.103 1.00 10.23 O ATOM 84 CB SER A 6 25.487 2.757 -13.974 1.00 12.55 C ATOM 85 OG SER A 6 25.540 3.702 -15.032 1.00 13.32 O ATOM 0 H SER A 6 27.528 2.280 -15.217 1.00 13.06 H new ATOM 0 HA SER A 6 27.090 3.598 -12.798 1.00 12.17 H new ATOM 0 HB2 SER A 6 25.196 1.782 -14.365 1.00 12.55 H new ATOM 0 HB3 SER A 6 24.724 3.052 -13.254 1.00 12.55 H new ATOM 0 HG SER A 6 24.664 3.755 -15.468 1.00 13.32 H new ATOM 91 N ILE A 7 27.377 0.424 -12.435 1.00 11.18 N ATOM 92 CA ILE A 7 27.399 -0.657 -11.459 1.00 10.37 C ATOM 93 C ILE A 7 28.488 -0.417 -10.415 1.00 9.98 C ATOM 94 O ILE A 7 28.318 -0.727 -9.244 1.00 9.20 O ATOM 95 CB ILE A 7 27.622 -2.023 -12.141 1.00 10.88 C ATOM 96 CG1 ILE A 7 26.518 -2.280 -13.168 1.00 11.65 C ATOM 97 CG2 ILE A 7 27.662 -3.145 -11.108 1.00 10.56 C ATOM 98 CD1 ILE A 7 26.689 -3.573 -13.930 1.00 12.15 C ATOM 0 H ILE A 7 27.845 0.208 -13.315 1.00 11.18 H new ATOM 0 HA ILE A 7 26.428 -0.673 -10.965 1.00 10.37 H new ATOM 0 HB ILE A 7 28.584 -2.002 -12.654 1.00 10.88 H new ATOM 0 HG12 ILE A 7 25.555 -2.294 -12.658 1.00 11.65 H new ATOM 0 HG13 ILE A 7 26.492 -1.452 -13.876 1.00 11.65 H new ATOM 0 HG21 ILE A 7 27.820 -4.098 -11.612 1.00 10.56 H new ATOM 0 HG22 ILE A 7 28.477 -2.965 -10.407 1.00 10.56 H new ATOM 0 HG23 ILE A 7 26.717 -3.174 -10.565 1.00 10.56 H new ATOM 0 HD11 ILE A 7 25.870 -3.688 -14.640 1.00 12.15 H new ATOM 0 HD12 ILE A 7 27.636 -3.555 -14.469 1.00 12.15 H new ATOM 0 HD13 ILE A 7 26.684 -4.410 -13.232 1.00 12.15 H new ATOM 110 N LEU A 8 29.606 0.144 -10.844 1.00 10.74 N ATOM 111 CA LEU A 8 30.688 0.478 -9.932 1.00 10.77 C ATOM 112 C LEU A 8 30.409 1.827 -9.276 1.00 10.46 C ATOM 113 O LEU A 8 30.951 2.157 -8.220 1.00 10.30 O ATOM 114 CB LEU A 8 32.020 0.532 -10.690 1.00 11.94 C ATOM 115 CG LEU A 8 32.590 -0.815 -11.170 1.00 12.47 C ATOM 116 CD1 LEU A 8 31.635 -1.547 -12.104 1.00 12.44 C ATOM 117 CD2 LEU A 8 33.908 -0.581 -11.872 1.00 13.09 C ATOM 0 H LEU A 8 29.789 0.378 -11.820 1.00 10.74 H new ATOM 0 HA LEU A 8 30.753 -0.290 -9.162 1.00 10.77 H new ATOM 0 HB2 LEU A 8 31.893 1.178 -11.559 1.00 11.94 H new ATOM 0 HB3 LEU A 8 32.761 1.006 -10.046 1.00 11.94 H new ATOM 0 HG LEU A 8 32.734 -1.445 -10.292 1.00 12.47 H new ATOM 0 HD11 LEU A 8 32.082 -2.491 -12.415 1.00 12.44 H new ATOM 0 HD12 LEU A 8 30.697 -1.744 -11.584 1.00 12.44 H new ATOM 0 HD13 LEU A 8 31.441 -0.931 -12.982 1.00 12.44 H new ATOM 0 HD21 LEU A 8 34.313 -1.534 -12.213 1.00 13.09 H new ATOM 0 HD22 LEU A 8 33.752 0.074 -12.729 1.00 13.09 H new ATOM 0 HD23 LEU A 8 34.610 -0.114 -11.181 1.00 13.09 H new ATOM 129 N ASP A 9 29.534 2.585 -9.913 1.00 10.57 N ATOM 130 CA ASP A 9 29.232 3.953 -9.514 1.00 10.51 C ATOM 131 C ASP A 9 27.861 4.033 -8.836 1.00 9.48 C ATOM 132 O ASP A 9 27.172 5.047 -8.927 1.00 9.50 O ATOM 133 CB ASP A 9 29.287 4.866 -10.745 1.00 11.48 C ATOM 134 CG ASP A 9 29.326 6.343 -10.401 1.00 12.16 C ATOM 135 OD1 ASP A 9 28.293 7.025 -10.567 1.00 12.46 O ATOM 136 OD2 ASP A 9 30.396 6.834 -9.983 1.00 12.54 O ATOM 0 H ASP A 9 29.008 2.269 -10.728 1.00 10.57 H new ATOM 0 HA ASP A 9 29.976 4.286 -8.790 1.00 10.51 H new ATOM 0 HB2 ASP A 9 30.169 4.615 -11.335 1.00 11.48 H new ATOM 0 HB3 ASP A 9 28.417 4.670 -11.372 1.00 11.48 H new ATOM 141 N ILE A 10 27.448 2.936 -8.199 1.00 8.74 N ATOM 142 CA ILE A 10 26.142 2.858 -7.521 1.00 7.86 C ATOM 143 C ILE A 10 26.027 3.782 -6.297 1.00 7.43 C ATOM 144 O ILE A 10 25.458 3.401 -5.273 1.00 6.73 O ATOM 145 CB ILE A 10 25.770 1.411 -7.072 1.00 7.25 C ATOM 146 CG1 ILE A 10 26.700 0.866 -5.963 1.00 7.42 C ATOM 147 CG2 ILE A 10 25.739 0.466 -8.260 1.00 7.55 C ATOM 148 CD1 ILE A 10 28.148 0.660 -6.359 1.00 7.84 C ATOM 0 H ILE A 10 28.000 2.081 -8.135 1.00 8.74 H new ATOM 0 HA ILE A 10 25.440 3.193 -8.285 1.00 7.86 H new ATOM 0 HB ILE A 10 24.770 1.469 -6.641 1.00 7.25 H new ATOM 0 HG12 ILE A 10 26.668 1.554 -5.118 1.00 7.42 H new ATOM 0 HG13 ILE A 10 26.299 -0.086 -5.614 1.00 7.42 H new ATOM 0 HG21 ILE A 10 25.477 -0.536 -7.921 1.00 7.55 H new ATOM 0 HG22 ILE A 10 24.997 0.811 -8.980 1.00 7.55 H new ATOM 0 HG23 ILE A 10 26.721 0.444 -8.733 1.00 7.55 H new ATOM 0 HD11 ILE A 10 28.707 0.276 -5.506 1.00 7.84 H new ATOM 0 HD12 ILE A 10 28.202 -0.055 -7.180 1.00 7.84 H new ATOM 0 HD13 ILE A 10 28.577 1.610 -6.676 1.00 7.84 H new ATOM 160 N ARG A 11 26.547 4.995 -6.400 1.00 8.07 N ATOM 161 CA ARG A 11 26.336 5.984 -5.360 1.00 7.96 C ATOM 162 C ARG A 11 24.929 6.520 -5.499 1.00 7.79 C ATOM 163 O ARG A 11 24.391 6.574 -6.610 1.00 8.29 O ATOM 164 CB ARG A 11 27.329 7.135 -5.460 1.00 9.08 C ATOM 165 CG ARG A 11 28.780 6.704 -5.479 1.00 9.98 C ATOM 166 CD ARG A 11 29.679 7.889 -5.211 1.00 10.66 C ATOM 167 NE ARG A 11 31.079 7.609 -5.525 1.00 11.50 N ATOM 168 CZ ARG A 11 32.059 8.502 -5.415 1.00 12.34 C ATOM 169 NH1 ARG A 11 31.791 9.742 -5.020 1.00 12.46 N ATOM 170 NH2 ARG A 11 33.310 8.155 -5.702 1.00 13.19 N ATOM 0 H ARG A 11 27.113 5.314 -7.186 1.00 8.07 H new ATOM 0 HA ARG A 11 26.484 5.509 -4.390 1.00 7.96 H new ATOM 0 HB2 ARG A 11 27.119 7.703 -6.366 1.00 9.08 H new ATOM 0 HB3 ARG A 11 27.173 7.809 -4.617 1.00 9.08 H new ATOM 0 HG2 ARG A 11 28.948 5.933 -4.727 1.00 9.98 H new ATOM 0 HG3 ARG A 11 29.024 6.264 -6.446 1.00 9.98 H new ATOM 0 HD2 ARG A 11 29.340 8.740 -5.802 1.00 10.66 H new ATOM 0 HD3 ARG A 11 29.595 8.176 -4.163 1.00 10.66 H new ATOM 0 HE ARG A 11 31.319 6.672 -5.848 1.00 11.50 H new ATOM 0 HH11 ARG A 11 30.832 10.011 -4.800 1.00 12.46 H new ATOM 0 HH12 ARG A 11 32.544 10.425 -4.936 1.00 12.46 H new ATOM 0 HH21 ARG A 11 33.518 7.204 -6.007 1.00 13.19 H new ATOM 0 HH22 ARG A 11 34.061 8.840 -5.618 1.00 13.19 H new ATOM 184 N GLN A 12 24.329 6.932 -4.406 1.00 7.29 N ATOM 185 CA GLN A 12 22.921 7.283 -4.463 1.00 7.16 C ATOM 186 C GLN A 12 22.622 8.656 -3.903 1.00 7.82 C ATOM 187 O GLN A 12 23.373 9.205 -3.094 1.00 8.10 O ATOM 188 CB GLN A 12 22.066 6.242 -3.757 1.00 6.33 C ATOM 189 CG GLN A 12 20.867 5.843 -4.591 1.00 6.44 C ATOM 190 CD GLN A 12 21.265 5.037 -5.818 1.00 6.33 C ATOM 191 OE1 GLN A 12 22.221 4.267 -5.792 1.00 6.37 O ATOM 192 NE2 GLN A 12 20.562 5.235 -6.917 1.00 6.60 N ATOM 0 H GLN A 12 24.772 7.032 -3.493 1.00 7.29 H new ATOM 0 HA GLN A 12 22.667 7.305 -5.523 1.00 7.16 H new ATOM 0 HB2 GLN A 12 22.670 5.360 -3.542 1.00 6.33 H new ATOM 0 HB3 GLN A 12 21.728 6.638 -2.799 1.00 6.33 H new ATOM 0 HG2 GLN A 12 20.180 5.257 -3.980 1.00 6.44 H new ATOM 0 HG3 GLN A 12 20.330 6.738 -4.905 1.00 6.44 H new ATOM 0 HE21 GLN A 12 19.773 5.881 -6.908 1.00 6.60 H new ATOM 0 HE22 GLN A 12 20.808 4.742 -7.775 1.00 6.60 H new ATOM 201 N GLY A 13 21.496 9.194 -4.354 1.00 8.30 N ATOM 202 CA GLY A 13 21.041 10.486 -3.910 1.00 9.01 C ATOM 203 C GLY A 13 19.811 10.363 -3.038 1.00 8.63 C ATOM 204 O GLY A 13 19.388 9.252 -2.723 1.00 7.84 O ATOM 0 H GLY A 13 20.883 8.743 -5.033 1.00 8.30 H new ATOM 0 HA2 GLY A 13 21.836 10.983 -3.354 1.00 9.01 H new ATOM 0 HA3 GLY A 13 20.817 11.112 -4.774 1.00 9.01 H new ATOM 208 N PRO A 14 19.184 11.483 -2.671 1.00 9.33 N ATOM 209 CA PRO A 14 18.070 11.494 -1.730 1.00 9.17 C ATOM 210 C PRO A 14 16.720 11.269 -2.404 1.00 8.90 C ATOM 211 O PRO A 14 15.680 11.652 -1.869 1.00 8.50 O ATOM 212 CB PRO A 14 18.153 12.901 -1.149 1.00 10.25 C ATOM 213 CG PRO A 14 18.677 13.744 -2.266 1.00 10.91 C ATOM 214 CD PRO A 14 19.497 12.837 -3.156 1.00 10.46 C ATOM 0 HA PRO A 14 18.139 10.693 -0.994 1.00 9.17 H new ATOM 0 HB2 PRO A 14 17.176 13.250 -0.815 1.00 10.25 H new ATOM 0 HB3 PRO A 14 18.816 12.934 -0.284 1.00 10.25 H new ATOM 0 HG2 PRO A 14 17.858 14.196 -2.825 1.00 10.91 H new ATOM 0 HG3 PRO A 14 19.287 14.560 -1.880 1.00 10.91 H new ATOM 0 HD2 PRO A 14 19.227 12.957 -4.205 1.00 10.46 H new ATOM 0 HD3 PRO A 14 20.562 13.054 -3.074 1.00 10.46 H new ATOM 222 N LYS A 15 16.737 10.656 -3.577 1.00 9.36 N ATOM 223 CA LYS A 15 15.505 10.424 -4.315 1.00 9.53 C ATOM 224 C LYS A 15 15.264 8.936 -4.548 1.00 9.20 C ATOM 225 O LYS A 15 14.308 8.558 -5.224 1.00 9.66 O ATOM 226 CB LYS A 15 15.500 11.188 -5.652 1.00 10.67 C ATOM 227 CG LYS A 15 16.402 10.620 -6.749 1.00 11.41 C ATOM 228 CD LYS A 15 17.882 10.819 -6.460 1.00 12.05 C ATOM 229 CE LYS A 15 18.719 10.658 -7.722 1.00 12.96 C ATOM 230 NZ LYS A 15 18.474 9.361 -8.405 1.00 13.55 N ATOM 0 H LYS A 15 17.581 10.313 -4.035 1.00 9.36 H new ATOM 0 HA LYS A 15 14.688 10.805 -3.703 1.00 9.53 H new ATOM 0 HB2 LYS A 15 14.477 11.217 -6.028 1.00 10.67 H new ATOM 0 HB3 LYS A 15 15.798 12.219 -5.460 1.00 10.67 H new ATOM 0 HG2 LYS A 15 16.199 9.555 -6.864 1.00 11.41 H new ATOM 0 HG3 LYS A 15 16.155 11.096 -7.698 1.00 11.41 H new ATOM 0 HD2 LYS A 15 18.042 11.812 -6.039 1.00 12.05 H new ATOM 0 HD3 LYS A 15 18.208 10.098 -5.710 1.00 12.05 H new ATOM 0 HE2 LYS A 15 18.496 11.475 -8.409 1.00 12.96 H new ATOM 0 HE3 LYS A 15 19.776 10.736 -7.466 1.00 12.96 H new ATOM 0 HZ1 LYS A 15 18.859 9.399 -9.370 1.00 13.55 H new ATOM 0 HZ2 LYS A 15 18.940 8.597 -7.876 1.00 13.55 H new ATOM 0 HZ3 LYS A 15 17.451 9.179 -8.448 1.00 13.55 H new ATOM 244 N GLU A 16 16.118 8.090 -3.989 1.00 8.57 N ATOM 245 CA GLU A 16 15.968 6.655 -4.165 1.00 8.39 C ATOM 246 C GLU A 16 15.237 6.009 -3.004 1.00 7.72 C ATOM 247 O GLU A 16 15.561 6.249 -1.842 1.00 6.94 O ATOM 248 CB GLU A 16 17.322 5.981 -4.328 1.00 8.10 C ATOM 249 CG GLU A 16 17.631 5.597 -5.758 1.00 8.26 C ATOM 250 CD GLU A 16 17.796 6.802 -6.661 1.00 9.36 C ATOM 251 OE1 GLU A 16 18.906 7.372 -6.697 1.00 9.85 O ATOM 252 OE2 GLU A 16 16.827 7.183 -7.348 1.00 9.91 O ATOM 0 H GLU A 16 16.914 8.370 -3.416 1.00 8.57 H new ATOM 0 HA GLU A 16 15.375 6.518 -5.069 1.00 8.39 H new ATOM 0 HB2 GLU A 16 18.100 6.651 -3.963 1.00 8.10 H new ATOM 0 HB3 GLU A 16 17.353 5.088 -3.704 1.00 8.10 H new ATOM 0 HG2 GLU A 16 18.544 5.002 -5.782 1.00 8.26 H new ATOM 0 HG3 GLU A 16 16.829 4.966 -6.142 1.00 8.26 H new ATOM 259 N PRO A 17 14.216 5.203 -3.312 1.00 8.28 N ATOM 260 CA PRO A 17 13.632 4.282 -2.348 1.00 8.07 C ATOM 261 C PRO A 17 14.598 3.135 -2.066 1.00 7.31 C ATOM 262 O PRO A 17 15.339 2.721 -2.961 1.00 7.39 O ATOM 263 CB PRO A 17 12.362 3.763 -3.041 1.00 9.21 C ATOM 264 CG PRO A 17 12.168 4.636 -4.239 1.00 9.95 C ATOM 265 CD PRO A 17 13.528 5.147 -4.610 1.00 9.45 C ATOM 0 HA PRO A 17 13.417 4.754 -1.389 1.00 8.07 H new ATOM 0 HB2 PRO A 17 12.474 2.719 -3.332 1.00 9.21 H new ATOM 0 HB3 PRO A 17 11.502 3.818 -2.374 1.00 9.21 H new ATOM 0 HG2 PRO A 17 11.725 4.075 -5.062 1.00 9.95 H new ATOM 0 HG3 PRO A 17 11.491 5.460 -4.014 1.00 9.95 H new ATOM 0 HD2 PRO A 17 14.034 4.481 -5.309 1.00 9.45 H new ATOM 0 HD3 PRO A 17 13.477 6.127 -5.084 1.00 9.45 H new ATOM 273 N PHE A 18 14.596 2.641 -0.834 1.00 6.75 N ATOM 274 CA PHE A 18 15.551 1.619 -0.394 1.00 6.11 C ATOM 275 C PHE A 18 15.702 0.486 -1.411 1.00 6.56 C ATOM 276 O PHE A 18 16.799 0.246 -1.921 1.00 6.14 O ATOM 277 CB PHE A 18 15.122 1.039 0.955 1.00 6.14 C ATOM 278 CG PHE A 18 16.094 0.035 1.514 1.00 5.98 C ATOM 279 CD1 PHE A 18 15.853 -1.326 1.396 1.00 6.36 C ATOM 280 CD2 PHE A 18 17.248 0.454 2.155 1.00 5.83 C ATOM 281 CE1 PHE A 18 16.744 -2.249 1.912 1.00 6.55 C ATOM 282 CE2 PHE A 18 18.141 -0.465 2.671 1.00 6.04 C ATOM 283 CZ PHE A 18 17.889 -1.817 2.549 1.00 6.38 C ATOM 0 H PHE A 18 13.938 2.933 -0.111 1.00 6.75 H new ATOM 0 HA PHE A 18 16.519 2.110 -0.298 1.00 6.11 H new ATOM 0 HB2 PHE A 18 15.002 1.853 1.670 1.00 6.14 H new ATOM 0 HB3 PHE A 18 14.146 0.566 0.844 1.00 6.14 H new ATOM 0 HD1 PHE A 18 14.959 -1.669 0.895 1.00 6.36 H new ATOM 0 HD2 PHE A 18 17.452 1.510 2.252 1.00 5.83 H new ATOM 0 HE1 PHE A 18 16.544 -3.306 1.817 1.00 6.55 H new ATOM 0 HE2 PHE A 18 19.037 -0.126 3.170 1.00 6.04 H new ATOM 0 HZ PHE A 18 18.587 -2.536 2.952 1.00 6.38 H new ATOM 293 N ARG A 19 14.599 -0.190 -1.714 1.00 7.57 N ATOM 294 CA ARG A 19 14.618 -1.344 -2.618 1.00 8.30 C ATOM 295 C ARG A 19 15.161 -1.001 -4.011 1.00 8.53 C ATOM 296 O ARG A 19 15.596 -1.888 -4.745 1.00 8.98 O ATOM 297 CB ARG A 19 13.222 -1.987 -2.717 1.00 9.53 C ATOM 298 CG ARG A 19 12.063 -1.017 -2.926 1.00 10.28 C ATOM 299 CD ARG A 19 12.006 -0.457 -4.339 1.00 11.35 C ATOM 300 NE ARG A 19 10.918 0.504 -4.488 1.00 12.03 N ATOM 301 CZ ARG A 19 10.654 1.179 -5.604 1.00 13.02 C ATOM 302 NH1 ARG A 19 11.393 1.002 -6.689 1.00 13.43 N ATOM 303 NH2 ARG A 19 9.640 2.031 -5.633 1.00 13.72 N ATOM 0 H ARG A 19 13.675 0.039 -1.347 1.00 7.57 H new ATOM 0 HA ARG A 19 15.308 -2.068 -2.184 1.00 8.30 H new ATOM 0 HB2 ARG A 19 13.228 -2.701 -3.541 1.00 9.53 H new ATOM 0 HB3 ARG A 19 13.037 -2.554 -1.805 1.00 9.53 H new ATOM 0 HG2 ARG A 19 11.125 -1.527 -2.705 1.00 10.28 H new ATOM 0 HG3 ARG A 19 12.153 -0.193 -2.218 1.00 10.28 H new ATOM 0 HD2 ARG A 19 12.954 0.024 -4.580 1.00 11.35 H new ATOM 0 HD3 ARG A 19 11.873 -1.272 -5.050 1.00 11.35 H new ATOM 0 HE ARG A 19 10.318 0.670 -3.680 1.00 12.03 H new ATOM 0 HH11 ARG A 19 12.172 0.344 -6.674 1.00 13.43 H new ATOM 0 HH12 ARG A 19 11.183 1.524 -7.540 1.00 13.43 H new ATOM 0 HH21 ARG A 19 9.065 2.168 -4.802 1.00 13.72 H new ATOM 0 HH22 ARG A 19 9.434 2.550 -6.487 1.00 13.72 H new ATOM 317 N ASP A 20 15.159 0.279 -4.359 1.00 8.44 N ATOM 318 CA ASP A 20 15.632 0.721 -5.665 1.00 9.01 C ATOM 319 C ASP A 20 17.133 0.974 -5.610 1.00 8.27 C ATOM 320 O ASP A 20 17.876 0.609 -6.518 1.00 8.68 O ATOM 321 CB ASP A 20 14.893 1.991 -6.084 1.00 9.59 C ATOM 322 CG ASP A 20 15.183 2.400 -7.513 1.00 10.55 C ATOM 323 OD1 ASP A 20 14.862 1.625 -8.436 1.00 11.24 O ATOM 324 OD2 ASP A 20 15.708 3.512 -7.725 1.00 10.78 O ATOM 0 H ASP A 20 14.834 1.032 -3.753 1.00 8.44 H new ATOM 0 HA ASP A 20 15.433 -0.057 -6.402 1.00 9.01 H new ATOM 0 HB2 ASP A 20 13.820 1.836 -5.967 1.00 9.59 H new ATOM 0 HB3 ASP A 20 15.173 2.805 -5.415 1.00 9.59 H new ATOM 329 N TYR A 21 17.567 1.601 -4.524 1.00 7.30 N ATOM 330 CA TYR A 21 18.987 1.801 -4.246 1.00 6.73 C ATOM 331 C TYR A 21 19.690 0.447 -4.193 1.00 6.19 C ATOM 332 O TYR A 21 20.732 0.237 -4.816 1.00 6.24 O ATOM 333 CB TYR A 21 19.130 2.546 -2.906 1.00 6.06 C ATOM 334 CG TYR A 21 20.552 2.850 -2.454 1.00 5.92 C ATOM 335 CD1 TYR A 21 20.781 3.374 -1.189 1.00 6.01 C ATOM 336 CD2 TYR A 21 21.653 2.624 -3.274 1.00 6.13 C ATOM 337 CE1 TYR A 21 22.059 3.665 -0.756 1.00 6.36 C ATOM 338 CE2 TYR A 21 22.934 2.910 -2.846 1.00 6.47 C ATOM 339 CZ TYR A 21 23.132 3.433 -1.587 1.00 6.60 C ATOM 340 OH TYR A 21 24.404 3.722 -1.157 1.00 7.29 O ATOM 0 H TYR A 21 16.947 1.985 -3.811 1.00 7.30 H new ATOM 0 HA TYR A 21 19.449 2.396 -5.034 1.00 6.73 H new ATOM 0 HB2 TYR A 21 18.585 3.487 -2.977 1.00 6.06 H new ATOM 0 HB3 TYR A 21 18.643 1.954 -2.131 1.00 6.06 H new ATOM 0 HD1 TYR A 21 19.944 3.557 -0.532 1.00 6.01 H new ATOM 0 HD2 TYR A 21 21.503 2.217 -4.263 1.00 6.13 H new ATOM 0 HE1 TYR A 21 22.217 4.073 0.231 1.00 6.36 H new ATOM 0 HE2 TYR A 21 23.777 2.725 -3.495 1.00 6.47 H new ATOM 0 HH TYR A 21 24.507 3.437 -0.225 1.00 7.29 H new ATOM 350 N VAL A 22 19.075 -0.477 -3.479 1.00 5.96 N ATOM 351 CA VAL A 22 19.643 -1.808 -3.288 1.00 5.81 C ATOM 352 C VAL A 22 19.684 -2.586 -4.602 1.00 6.77 C ATOM 353 O VAL A 22 20.569 -3.408 -4.818 1.00 6.77 O ATOM 354 CB VAL A 22 18.857 -2.609 -2.226 1.00 5.93 C ATOM 355 CG1 VAL A 22 19.413 -4.020 -2.073 1.00 6.61 C ATOM 356 CG2 VAL A 22 18.891 -1.885 -0.893 1.00 5.41 C ATOM 0 H VAL A 22 18.177 -0.334 -3.017 1.00 5.96 H new ATOM 0 HA VAL A 22 20.664 -1.672 -2.932 1.00 5.81 H new ATOM 0 HB VAL A 22 17.823 -2.690 -2.562 1.00 5.93 H new ATOM 0 HG11 VAL A 22 18.839 -4.558 -1.319 1.00 6.61 H new ATOM 0 HG12 VAL A 22 19.341 -4.545 -3.026 1.00 6.61 H new ATOM 0 HG13 VAL A 22 20.457 -3.968 -1.765 1.00 6.61 H new ATOM 0 HG21 VAL A 22 18.334 -2.459 -0.153 1.00 5.41 H new ATOM 0 HG22 VAL A 22 19.925 -1.776 -0.565 1.00 5.41 H new ATOM 0 HG23 VAL A 22 18.439 -0.899 -1.003 1.00 5.41 H new ATOM 366 N ASP A 23 18.740 -2.292 -5.489 1.00 7.71 N ATOM 367 CA ASP A 23 18.641 -2.972 -6.780 1.00 8.82 C ATOM 368 C ASP A 23 19.955 -2.908 -7.560 1.00 8.87 C ATOM 369 O ASP A 23 20.435 -3.922 -8.069 1.00 9.30 O ATOM 370 CB ASP A 23 17.512 -2.361 -7.611 1.00 9.88 C ATOM 371 CG ASP A 23 17.427 -2.942 -9.010 1.00 11.09 C ATOM 372 OD1 ASP A 23 17.679 -2.193 -9.980 1.00 11.57 O ATOM 373 OD2 ASP A 23 17.098 -4.138 -9.148 1.00 11.68 O ATOM 0 H ASP A 23 18.025 -1.581 -5.337 1.00 7.71 H new ATOM 0 HA ASP A 23 18.423 -4.021 -6.582 1.00 8.82 H new ATOM 0 HB2 ASP A 23 16.563 -2.521 -7.099 1.00 9.88 H new ATOM 0 HB3 ASP A 23 17.660 -1.283 -7.679 1.00 9.88 H new ATOM 378 N ARG A 24 20.551 -1.724 -7.630 1.00 8.57 N ATOM 379 CA ARG A 24 21.788 -1.551 -8.381 1.00 8.91 C ATOM 380 C ARG A 24 22.989 -1.916 -7.517 1.00 8.10 C ATOM 381 O ARG A 24 23.996 -2.414 -8.018 1.00 8.53 O ATOM 382 CB ARG A 24 21.939 -0.119 -8.916 1.00 9.20 C ATOM 383 CG ARG A 24 22.087 0.946 -7.837 1.00 9.35 C ATOM 384 CD ARG A 24 20.794 1.706 -7.610 1.00 9.42 C ATOM 385 NE ARG A 24 20.394 2.466 -8.792 1.00 10.13 N ATOM 386 CZ ARG A 24 19.210 3.052 -8.932 1.00 10.62 C ATOM 387 NH1 ARG A 24 18.291 2.915 -7.990 1.00 10.53 N ATOM 388 NH2 ARG A 24 18.943 3.755 -10.020 1.00 11.36 N ATOM 0 H ARG A 24 20.202 -0.877 -7.181 1.00 8.57 H new ATOM 0 HA ARG A 24 21.744 -2.222 -9.239 1.00 8.91 H new ATOM 0 HB2 ARG A 24 22.810 -0.079 -9.570 1.00 9.20 H new ATOM 0 HB3 ARG A 24 21.069 0.120 -9.528 1.00 9.20 H new ATOM 0 HG2 ARG A 24 22.401 0.477 -6.905 1.00 9.35 H new ATOM 0 HG3 ARG A 24 22.873 1.645 -8.122 1.00 9.35 H new ATOM 0 HD2 ARG A 24 20.003 1.005 -7.344 1.00 9.42 H new ATOM 0 HD3 ARG A 24 20.915 2.385 -6.766 1.00 9.42 H new ATOM 0 HE ARG A 24 21.064 2.552 -9.556 1.00 10.13 H new ATOM 0 HH11 ARG A 24 18.492 2.360 -7.158 1.00 10.53 H new ATOM 0 HH12 ARG A 24 17.381 3.364 -8.096 1.00 10.53 H new ATOM 0 HH21 ARG A 24 19.647 3.848 -10.753 1.00 11.36 H new ATOM 0 HH22 ARG A 24 18.034 4.204 -10.126 1.00 11.36 H new ATOM 402 N PHE A 25 22.874 -1.681 -6.214 1.00 7.02 N ATOM 403 CA PHE A 25 23.949 -1.980 -5.288 1.00 6.32 C ATOM 404 C PHE A 25 24.171 -3.483 -5.181 1.00 6.59 C ATOM 405 O PHE A 25 25.290 -3.939 -4.963 1.00 6.62 O ATOM 406 CB PHE A 25 23.629 -1.396 -3.915 1.00 5.33 C ATOM 407 CG PHE A 25 24.697 -1.650 -2.895 1.00 4.98 C ATOM 408 CD1 PHE A 25 25.857 -0.896 -2.891 1.00 4.85 C ATOM 409 CD2 PHE A 25 24.543 -2.645 -1.942 1.00 5.26 C ATOM 410 CE1 PHE A 25 26.843 -1.128 -1.957 1.00 4.99 C ATOM 411 CE2 PHE A 25 25.528 -2.882 -1.004 1.00 5.43 C ATOM 412 CZ PHE A 25 26.681 -2.121 -1.011 1.00 5.29 C ATOM 0 H PHE A 25 22.042 -1.283 -5.779 1.00 7.02 H new ATOM 0 HA PHE A 25 24.866 -1.527 -5.665 1.00 6.32 H new ATOM 0 HB2 PHE A 25 23.478 -0.321 -4.012 1.00 5.33 H new ATOM 0 HB3 PHE A 25 22.689 -1.819 -3.559 1.00 5.33 H new ATOM 0 HD1 PHE A 25 25.991 -0.118 -3.628 1.00 4.85 H new ATOM 0 HD2 PHE A 25 23.643 -3.241 -1.933 1.00 5.26 H new ATOM 0 HE1 PHE A 25 27.744 -0.532 -1.965 1.00 4.99 H new ATOM 0 HE2 PHE A 25 25.397 -3.660 -0.267 1.00 5.43 H new ATOM 0 HZ PHE A 25 27.454 -2.302 -0.279 1.00 5.29 H new ATOM 422 N TYR A 26 23.111 -4.249 -5.369 1.00 7.06 N ATOM 423 CA TYR A 26 23.184 -5.694 -5.215 1.00 7.60 C ATOM 424 C TYR A 26 23.894 -6.295 -6.413 1.00 8.54 C ATOM 425 O TYR A 26 24.488 -7.371 -6.335 1.00 8.87 O ATOM 426 CB TYR A 26 21.788 -6.305 -5.061 1.00 8.10 C ATOM 427 CG TYR A 26 21.816 -7.791 -4.779 1.00 8.84 C ATOM 428 CD1 TYR A 26 21.361 -8.708 -5.719 1.00 9.57 C ATOM 429 CD2 TYR A 26 22.316 -8.277 -3.578 1.00 9.04 C ATOM 430 CE1 TYR A 26 21.403 -10.065 -5.466 1.00 10.37 C ATOM 431 CE2 TYR A 26 22.359 -9.633 -3.318 1.00 9.88 C ATOM 432 CZ TYR A 26 21.902 -10.522 -4.265 1.00 10.50 C ATOM 433 OH TYR A 26 21.951 -11.875 -4.014 1.00 11.44 O ATOM 0 H TYR A 26 22.190 -3.897 -5.628 1.00 7.06 H new ATOM 0 HA TYR A 26 23.746 -5.920 -4.309 1.00 7.60 H new ATOM 0 HB2 TYR A 26 21.264 -5.798 -4.251 1.00 8.10 H new ATOM 0 HB3 TYR A 26 21.217 -6.125 -5.972 1.00 8.10 H new ATOM 0 HD1 TYR A 26 20.969 -8.354 -6.661 1.00 9.57 H new ATOM 0 HD2 TYR A 26 22.678 -7.583 -2.834 1.00 9.04 H new ATOM 0 HE1 TYR A 26 21.046 -10.766 -6.206 1.00 10.37 H new ATOM 0 HE2 TYR A 26 22.749 -9.994 -2.378 1.00 9.88 H new ATOM 0 HH TYR A 26 22.330 -12.029 -3.124 1.00 11.44 H new ATOM 443 N LYS A 27 23.846 -5.566 -7.516 1.00 9.08 N ATOM 444 CA LYS A 27 24.513 -5.977 -8.738 1.00 10.12 C ATOM 445 C LYS A 27 26.023 -6.047 -8.534 1.00 10.01 C ATOM 446 O LYS A 27 26.708 -6.848 -9.168 1.00 10.69 O ATOM 447 CB LYS A 27 24.165 -5.005 -9.862 1.00 10.87 C ATOM 448 CG LYS A 27 22.713 -5.092 -10.301 1.00 11.19 C ATOM 449 CD LYS A 27 22.420 -4.192 -11.492 1.00 12.15 C ATOM 450 CE LYS A 27 23.143 -4.661 -12.746 1.00 12.87 C ATOM 451 NZ LYS A 27 22.712 -3.902 -13.949 1.00 13.47 N ATOM 0 H LYS A 27 23.347 -4.679 -7.589 1.00 9.08 H new ATOM 0 HA LYS A 27 24.168 -6.974 -9.011 1.00 10.12 H new ATOM 0 HB2 LYS A 27 24.378 -3.988 -9.533 1.00 10.87 H new ATOM 0 HB3 LYS A 27 24.809 -5.204 -10.718 1.00 10.87 H new ATOM 0 HG2 LYS A 27 22.474 -6.124 -10.559 1.00 11.19 H new ATOM 0 HG3 LYS A 27 22.066 -4.814 -9.469 1.00 11.19 H new ATOM 0 HD2 LYS A 27 21.346 -4.173 -11.677 1.00 12.15 H new ATOM 0 HD3 LYS A 27 22.722 -3.171 -11.259 1.00 12.15 H new ATOM 0 HE2 LYS A 27 24.218 -4.546 -12.610 1.00 12.87 H new ATOM 0 HE3 LYS A 27 22.953 -5.723 -12.899 1.00 12.87 H new ATOM 0 HZ1 LYS A 27 23.227 -4.251 -14.782 1.00 13.47 H new ATOM 0 HZ2 LYS A 27 21.690 -4.032 -14.094 1.00 13.47 H new ATOM 0 HZ3 LYS A 27 22.917 -2.891 -13.814 1.00 13.47 H new ATOM 465 N THR A 28 26.534 -5.225 -7.624 1.00 9.28 N ATOM 466 CA THR A 28 27.958 -5.216 -7.322 1.00 9.35 C ATOM 467 C THR A 28 28.346 -6.494 -6.588 1.00 8.90 C ATOM 468 O THR A 28 29.425 -7.045 -6.799 1.00 9.29 O ATOM 469 CB THR A 28 28.348 -3.993 -6.465 1.00 9.07 C ATOM 470 OG1 THR A 28 27.878 -4.150 -5.121 1.00 9.27 O ATOM 471 CG2 THR A 28 27.759 -2.723 -7.047 1.00 8.30 C ATOM 0 H THR A 28 25.983 -4.558 -7.084 1.00 9.28 H new ATOM 0 HA THR A 28 28.495 -5.156 -8.268 1.00 9.35 H new ATOM 0 HB THR A 28 29.436 -3.921 -6.464 1.00 9.07 H new ATOM 0 HG1 THR A 28 26.922 -4.366 -5.132 1.00 9.27 H new ATOM 0 HG21 THR A 28 28.045 -1.872 -6.428 1.00 8.30 H new ATOM 0 HG22 THR A 28 28.135 -2.578 -8.060 1.00 8.30 H new ATOM 0 HG23 THR A 28 26.672 -2.804 -7.072 1.00 8.30 H new ATOM 479 N LEU A 29 27.430 -6.982 -5.754 1.00 8.24 N ATOM 480 CA LEU A 29 27.665 -8.185 -4.966 1.00 8.03 C ATOM 481 C LEU A 29 27.777 -9.407 -5.866 1.00 8.87 C ATOM 482 O LEU A 29 28.439 -10.384 -5.523 1.00 9.09 O ATOM 483 CB LEU A 29 26.543 -8.399 -3.943 1.00 7.48 C ATOM 484 CG LEU A 29 26.675 -7.620 -2.630 1.00 7.10 C ATOM 485 CD1 LEU A 29 26.592 -6.121 -2.862 1.00 6.93 C ATOM 486 CD2 LEU A 29 25.602 -8.063 -1.650 1.00 6.99 C ATOM 0 H LEU A 29 26.514 -6.558 -5.608 1.00 8.24 H new ATOM 0 HA LEU A 29 28.606 -8.051 -4.432 1.00 8.03 H new ATOM 0 HB2 LEU A 29 25.596 -8.128 -4.410 1.00 7.48 H new ATOM 0 HB3 LEU A 29 26.490 -9.462 -3.708 1.00 7.48 H new ATOM 0 HG LEU A 29 27.656 -7.836 -2.208 1.00 7.10 H new ATOM 0 HD11 LEU A 29 26.689 -5.600 -1.910 1.00 6.93 H new ATOM 0 HD12 LEU A 29 27.396 -5.811 -3.529 1.00 6.93 H new ATOM 0 HD13 LEU A 29 25.631 -5.875 -3.314 1.00 6.93 H new ATOM 0 HD21 LEU A 29 25.705 -7.503 -0.720 1.00 6.99 H new ATOM 0 HD22 LEU A 29 24.618 -7.876 -2.079 1.00 6.99 H new ATOM 0 HD23 LEU A 29 25.713 -9.128 -1.446 1.00 6.99 H new ATOM 498 N ARG A 30 27.134 -9.339 -7.022 1.00 9.50 N ATOM 499 CA ARG A 30 27.163 -10.439 -7.976 1.00 10.45 C ATOM 500 C ARG A 30 28.462 -10.413 -8.774 1.00 10.98 C ATOM 501 O ARG A 30 28.946 -11.449 -9.238 1.00 11.61 O ATOM 502 CB ARG A 30 25.969 -10.353 -8.933 1.00 11.14 C ATOM 503 CG ARG A 30 24.625 -10.163 -8.241 1.00 11.16 C ATOM 504 CD ARG A 30 24.365 -11.232 -7.189 1.00 11.94 C ATOM 505 NE ARG A 30 24.407 -12.584 -7.743 1.00 12.66 N ATOM 506 CZ ARG A 30 24.034 -13.674 -7.073 1.00 13.44 C ATOM 507 NH1 ARG A 30 23.555 -13.572 -5.839 1.00 13.60 N ATOM 508 NH2 ARG A 30 24.134 -14.866 -7.641 1.00 14.19 N ATOM 0 H ARG A 30 26.585 -8.534 -7.323 1.00 9.50 H new ATOM 0 HA ARG A 30 27.103 -11.374 -7.420 1.00 10.45 H new ATOM 0 HB2 ARG A 30 26.130 -9.525 -9.623 1.00 11.14 H new ATOM 0 HB3 ARG A 30 25.931 -11.263 -9.531 1.00 11.14 H new ATOM 0 HG2 ARG A 30 24.595 -9.179 -7.772 1.00 11.16 H new ATOM 0 HG3 ARG A 30 23.829 -10.186 -8.985 1.00 11.16 H new ATOM 0 HD2 ARG A 30 25.107 -11.145 -6.396 1.00 11.94 H new ATOM 0 HD3 ARG A 30 23.390 -11.060 -6.734 1.00 11.94 H new ATOM 0 HE ARG A 30 24.742 -12.700 -8.699 1.00 12.66 H new ATOM 0 HH11 ARG A 30 23.471 -12.656 -5.399 1.00 13.60 H new ATOM 0 HH12 ARG A 30 23.271 -14.410 -5.331 1.00 13.60 H new ATOM 0 HH21 ARG A 30 24.496 -14.950 -8.591 1.00 14.19 H new ATOM 0 HH22 ARG A 30 23.849 -15.701 -7.129 1.00 14.19 H new ATOM 522 N ALA A 31 29.022 -9.220 -8.924 1.00 10.87 N ATOM 523 CA ALA A 31 30.234 -9.031 -9.710 1.00 11.56 C ATOM 524 C ALA A 31 31.493 -9.290 -8.886 1.00 11.34 C ATOM 525 O ALA A 31 32.545 -9.617 -9.438 1.00 11.93 O ATOM 526 CB ALA A 31 30.266 -7.626 -10.292 1.00 11.84 C ATOM 0 H ALA A 31 28.654 -8.364 -8.509 1.00 10.87 H new ATOM 0 HA ALA A 31 30.218 -9.758 -10.522 1.00 11.56 H new ATOM 0 HB1 ALA A 31 31.176 -7.495 -10.878 1.00 11.84 H new ATOM 0 HB2 ALA A 31 29.397 -7.478 -10.934 1.00 11.84 H new ATOM 0 HB3 ALA A 31 30.248 -6.896 -9.482 1.00 11.84 H new ATOM 532 N GLU A 32 31.382 -9.132 -7.573 1.00 10.61 N ATOM 533 CA GLU A 32 32.513 -9.338 -6.672 1.00 10.60 C ATOM 534 C GLU A 32 32.633 -10.810 -6.280 1.00 10.54 C ATOM 535 O GLU A 32 31.991 -11.676 -6.879 1.00 10.89 O ATOM 536 CB GLU A 32 32.341 -8.491 -5.408 1.00 10.22 C ATOM 537 CG GLU A 32 31.138 -8.911 -4.579 1.00 9.56 C ATOM 538 CD GLU A 32 31.011 -8.152 -3.274 1.00 9.48 C ATOM 539 OE1 GLU A 32 30.844 -6.914 -3.304 1.00 9.47 O ATOM 540 OE2 GLU A 32 31.052 -8.802 -2.206 1.00 9.62 O ATOM 0 H GLU A 32 30.517 -8.861 -7.105 1.00 10.61 H new ATOM 0 HA GLU A 32 33.421 -9.036 -7.194 1.00 10.60 H new ATOM 0 HB2 GLU A 32 33.242 -8.568 -4.799 1.00 10.22 H new ATOM 0 HB3 GLU A 32 32.235 -7.443 -5.689 1.00 10.22 H new ATOM 0 HG2 GLU A 32 30.232 -8.763 -5.166 1.00 9.56 H new ATOM 0 HG3 GLU A 32 31.208 -9.977 -4.365 1.00 9.56 H new ATOM 547 N GLN A 33 33.452 -11.082 -5.268 1.00 10.31 N ATOM 548 CA GLN A 33 33.585 -12.426 -4.724 1.00 10.45 C ATOM 549 C GLN A 33 32.251 -12.902 -4.152 1.00 10.39 C ATOM 550 O GLN A 33 31.431 -12.105 -3.699 1.00 10.09 O ATOM 551 CB GLN A 33 34.657 -12.454 -3.633 1.00 10.44 C ATOM 552 CG GLN A 33 36.052 -12.099 -4.126 1.00 10.76 C ATOM 553 CD GLN A 33 36.628 -13.136 -5.070 1.00 11.12 C ATOM 554 OE1 GLN A 33 36.317 -14.322 -4.979 1.00 11.23 O ATOM 555 NE2 GLN A 33 37.482 -12.696 -5.978 1.00 11.52 N ATOM 0 H GLN A 33 34.036 -10.384 -4.807 1.00 10.31 H new ATOM 0 HA GLN A 33 33.883 -13.096 -5.530 1.00 10.45 H new ATOM 0 HB2 GLN A 33 34.374 -11.759 -2.843 1.00 10.44 H new ATOM 0 HB3 GLN A 33 34.682 -13.449 -3.188 1.00 10.44 H new ATOM 0 HG2 GLN A 33 36.018 -11.134 -4.632 1.00 10.76 H new ATOM 0 HG3 GLN A 33 36.717 -11.987 -3.269 1.00 10.76 H new ATOM 0 HE21 GLN A 33 37.714 -11.704 -6.021 1.00 11.52 H new ATOM 0 HE22 GLN A 33 37.909 -13.349 -6.636 1.00 11.52 H new ATOM 564 N ALA A 34 32.048 -14.206 -4.186 1.00 10.90 N ATOM 565 CA ALA A 34 30.799 -14.821 -3.752 1.00 11.19 C ATOM 566 C ALA A 34 30.714 -14.928 -2.236 1.00 11.09 C ATOM 567 O ALA A 34 29.623 -15.079 -1.689 1.00 11.27 O ATOM 568 CB ALA A 34 30.643 -16.196 -4.381 1.00 11.97 C ATOM 0 H ALA A 34 32.745 -14.874 -4.516 1.00 10.90 H new ATOM 0 HA ALA A 34 29.985 -14.176 -4.084 1.00 11.19 H new ATOM 0 HB1 ALA A 34 29.707 -16.644 -4.049 1.00 11.97 H new ATOM 0 HB2 ALA A 34 30.634 -16.101 -5.467 1.00 11.97 H new ATOM 0 HB3 ALA A 34 31.476 -16.831 -4.079 1.00 11.97 H new ATOM 574 N SER A 35 31.867 -14.868 -1.577 1.00 11.05 N ATOM 575 CA SER A 35 31.955 -14.993 -0.124 1.00 11.21 C ATOM 576 C SER A 35 30.976 -14.053 0.589 1.00 10.64 C ATOM 577 O SER A 35 31.179 -12.839 0.632 1.00 10.19 O ATOM 578 CB SER A 35 33.387 -14.705 0.322 1.00 11.48 C ATOM 579 OG SER A 35 34.307 -15.516 -0.393 1.00 12.02 O ATOM 0 H SER A 35 32.768 -14.731 -2.035 1.00 11.05 H new ATOM 0 HA SER A 35 31.681 -16.012 0.149 1.00 11.21 H new ATOM 0 HB2 SER A 35 33.619 -13.653 0.159 1.00 11.48 H new ATOM 0 HB3 SER A 35 33.485 -14.891 1.391 1.00 11.48 H new ATOM 0 HG SER A 35 35.219 -15.316 -0.095 1.00 12.02 H new ATOM 585 N GLN A 36 29.920 -14.633 1.151 1.00 10.85 N ATOM 586 CA GLN A 36 28.866 -13.861 1.795 1.00 10.51 C ATOM 587 C GLN A 36 29.322 -13.310 3.140 1.00 10.66 C ATOM 588 O GLN A 36 28.842 -12.267 3.583 1.00 10.26 O ATOM 589 CB GLN A 36 27.608 -14.715 1.978 1.00 11.11 C ATOM 590 CG GLN A 36 26.961 -15.140 0.668 1.00 11.25 C ATOM 591 CD GLN A 36 25.682 -15.928 0.875 1.00 11.80 C ATOM 592 OE1 GLN A 36 25.700 -17.155 0.967 1.00 12.14 O ATOM 593 NE2 GLN A 36 24.562 -15.229 0.949 1.00 12.09 N ATOM 0 H GLN A 36 29.772 -15.642 1.173 1.00 10.85 H new ATOM 0 HA GLN A 36 28.632 -13.018 1.145 1.00 10.51 H new ATOM 0 HB2 GLN A 36 27.864 -15.605 2.552 1.00 11.11 H new ATOM 0 HB3 GLN A 36 26.882 -14.155 2.567 1.00 11.11 H new ATOM 0 HG2 GLN A 36 26.745 -14.254 0.070 1.00 11.25 H new ATOM 0 HG3 GLN A 36 27.667 -15.744 0.098 1.00 11.25 H new ATOM 0 HE21 GLN A 36 24.589 -14.213 0.868 1.00 12.09 H new ATOM 0 HE22 GLN A 36 23.671 -15.706 1.087 1.00 12.09 H new ATOM 602 N GLU A 37 30.258 -14.007 3.779 1.00 11.37 N ATOM 603 CA GLU A 37 30.778 -13.585 5.078 1.00 11.85 C ATOM 604 C GLU A 37 31.404 -12.196 4.996 1.00 11.40 C ATOM 605 O GLU A 37 31.346 -11.422 5.951 1.00 11.56 O ATOM 606 CB GLU A 37 31.807 -14.590 5.607 1.00 12.76 C ATOM 607 CG GLU A 37 32.972 -14.842 4.660 1.00 12.82 C ATOM 608 CD GLU A 37 34.093 -15.626 5.308 1.00 13.79 C ATOM 609 OE1 GLU A 37 33.854 -16.767 5.756 1.00 14.44 O ATOM 610 OE2 GLU A 37 35.226 -15.105 5.369 1.00 13.98 O ATOM 0 H GLU A 37 30.672 -14.867 3.419 1.00 11.37 H new ATOM 0 HA GLU A 37 29.937 -13.545 5.770 1.00 11.85 H new ATOM 0 HB2 GLU A 37 32.197 -14.228 6.558 1.00 12.76 H new ATOM 0 HB3 GLU A 37 31.305 -15.536 5.808 1.00 12.76 H new ATOM 0 HG2 GLU A 37 32.613 -15.385 3.785 1.00 12.82 H new ATOM 0 HG3 GLU A 37 33.360 -13.887 4.306 1.00 12.82 H new ATOM 617 N VAL A 38 31.989 -11.881 3.850 1.00 11.01 N ATOM 618 CA VAL A 38 32.631 -10.593 3.654 1.00 10.78 C ATOM 619 C VAL A 38 31.592 -9.526 3.331 1.00 9.91 C ATOM 620 O VAL A 38 31.693 -8.388 3.788 1.00 9.82 O ATOM 621 CB VAL A 38 33.675 -10.649 2.519 1.00 10.99 C ATOM 622 CG1 VAL A 38 34.373 -9.309 2.362 1.00 11.05 C ATOM 623 CG2 VAL A 38 34.688 -11.755 2.776 1.00 11.61 C ATOM 0 H VAL A 38 32.032 -12.502 3.042 1.00 11.01 H new ATOM 0 HA VAL A 38 33.142 -10.338 4.582 1.00 10.78 H new ATOM 0 HB VAL A 38 33.154 -10.872 1.588 1.00 10.99 H new ATOM 0 HG11 VAL A 38 35.105 -9.372 1.556 1.00 11.05 H new ATOM 0 HG12 VAL A 38 33.637 -8.541 2.125 1.00 11.05 H new ATOM 0 HG13 VAL A 38 34.879 -9.051 3.292 1.00 11.05 H new ATOM 0 HG21 VAL A 38 35.415 -11.778 1.964 1.00 11.61 H new ATOM 0 HG22 VAL A 38 35.202 -11.566 3.719 1.00 11.61 H new ATOM 0 HG23 VAL A 38 34.173 -12.714 2.829 1.00 11.61 H new ATOM 633 N LYS A 39 30.573 -9.919 2.577 1.00 9.40 N ATOM 634 CA LYS A 39 29.554 -8.987 2.105 1.00 8.62 C ATOM 635 C LYS A 39 28.874 -8.275 3.264 1.00 8.49 C ATOM 636 O LYS A 39 28.724 -7.058 3.246 1.00 8.00 O ATOM 637 CB LYS A 39 28.507 -9.720 1.270 1.00 8.48 C ATOM 638 CG LYS A 39 29.084 -10.412 0.052 1.00 8.87 C ATOM 639 CD LYS A 39 28.010 -11.134 -0.741 1.00 8.96 C ATOM 640 CE LYS A 39 28.607 -11.868 -1.927 1.00 9.53 C ATOM 641 NZ LYS A 39 29.211 -10.933 -2.909 1.00 9.78 N ATOM 0 H LYS A 39 30.429 -10.883 2.277 1.00 9.40 H new ATOM 0 HA LYS A 39 30.053 -8.240 1.487 1.00 8.62 H new ATOM 0 HB2 LYS A 39 28.007 -10.459 1.896 1.00 8.48 H new ATOM 0 HB3 LYS A 39 27.747 -9.008 0.948 1.00 8.48 H new ATOM 0 HG2 LYS A 39 29.576 -9.678 -0.586 1.00 8.87 H new ATOM 0 HG3 LYS A 39 29.847 -11.125 0.365 1.00 8.87 H new ATOM 0 HD2 LYS A 39 27.491 -11.842 -0.095 1.00 8.96 H new ATOM 0 HD3 LYS A 39 27.267 -10.417 -1.090 1.00 8.96 H new ATOM 0 HE2 LYS A 39 29.366 -12.567 -1.577 1.00 9.53 H new ATOM 0 HE3 LYS A 39 27.832 -12.458 -2.416 1.00 9.53 H new ATOM 0 HZ1 LYS A 39 28.693 -10.992 -3.809 1.00 9.78 H new ATOM 0 HZ2 LYS A 39 29.157 -9.961 -2.542 1.00 9.78 H new ATOM 0 HZ3 LYS A 39 30.207 -11.189 -3.065 1.00 9.78 H new ATOM 655 N ASN A 40 28.486 -9.035 4.274 1.00 9.12 N ATOM 656 CA ASN A 40 27.749 -8.491 5.410 1.00 9.38 C ATOM 657 C ASN A 40 28.580 -7.470 6.180 1.00 9.55 C ATOM 658 O ASN A 40 28.051 -6.472 6.664 1.00 9.39 O ATOM 659 CB ASN A 40 27.295 -9.611 6.348 1.00 10.35 C ATOM 660 CG ASN A 40 26.163 -10.438 5.769 1.00 10.85 C ATOM 661 OD1 ASN A 40 26.389 -11.445 5.099 1.00 10.92 O ATOM 662 ND2 ASN A 40 24.934 -10.012 6.018 1.00 11.43 N ATOM 0 H ASN A 40 28.669 -10.037 4.333 1.00 9.12 H new ATOM 0 HA ASN A 40 26.870 -7.983 5.014 1.00 9.38 H new ATOM 0 HB2 ASN A 40 28.141 -10.263 6.565 1.00 10.35 H new ATOM 0 HB3 ASN A 40 26.975 -9.178 7.296 1.00 10.35 H new ATOM 0 HD21 ASN A 40 24.132 -10.524 5.650 1.00 11.43 H new ATOM 0 HD22 ASN A 40 24.789 -9.172 6.578 1.00 11.43 H new ATOM 669 N ALA A 41 29.878 -7.715 6.279 1.00 10.04 N ATOM 670 CA ALA A 41 30.769 -6.818 7.004 1.00 10.52 C ATOM 671 C ALA A 41 31.118 -5.599 6.160 1.00 9.85 C ATOM 672 O ALA A 41 31.384 -4.517 6.685 1.00 10.08 O ATOM 673 CB ALA A 41 32.032 -7.553 7.425 1.00 11.43 C ATOM 0 H ALA A 41 30.339 -8.527 5.867 1.00 10.04 H new ATOM 0 HA ALA A 41 30.251 -6.473 7.899 1.00 10.52 H new ATOM 0 HB1 ALA A 41 32.687 -6.870 7.965 1.00 11.43 H new ATOM 0 HB2 ALA A 41 31.768 -8.390 8.071 1.00 11.43 H new ATOM 0 HB3 ALA A 41 32.547 -7.927 6.540 1.00 11.43 H new ATOM 679 N ALA A 42 31.114 -5.782 4.850 1.00 9.19 N ATOM 680 CA ALA A 42 31.444 -4.709 3.928 1.00 8.71 C ATOM 681 C ALA A 42 30.242 -3.809 3.674 1.00 7.86 C ATOM 682 O ALA A 42 30.268 -2.618 3.984 1.00 7.82 O ATOM 683 CB ALA A 42 31.953 -5.292 2.619 1.00 8.58 C ATOM 0 H ALA A 42 30.885 -6.668 4.400 1.00 9.19 H new ATOM 0 HA ALA A 42 32.227 -4.099 4.379 1.00 8.71 H new ATOM 0 HB1 ALA A 42 32.199 -4.483 1.931 1.00 8.58 H new ATOM 0 HB2 ALA A 42 32.844 -5.890 2.809 1.00 8.58 H new ATOM 0 HB3 ALA A 42 31.181 -5.922 2.177 1.00 8.58 H new ATOM 689 N THR A 43 29.181 -4.398 3.142 1.00 7.35 N ATOM 690 CA THR A 43 28.006 -3.655 2.712 1.00 6.63 C ATOM 691 C THR A 43 27.385 -2.841 3.842 1.00 6.87 C ATOM 692 O THR A 43 26.832 -1.775 3.593 1.00 6.42 O ATOM 693 CB THR A 43 26.935 -4.591 2.118 1.00 6.60 C ATOM 694 OG1 THR A 43 26.557 -5.581 3.083 1.00 6.93 O ATOM 695 CG2 THR A 43 27.448 -5.275 0.861 1.00 6.92 C ATOM 0 H THR A 43 29.111 -5.405 2.996 1.00 7.35 H new ATOM 0 HA THR A 43 28.354 -2.965 1.943 1.00 6.63 H new ATOM 0 HB THR A 43 26.066 -3.988 1.856 1.00 6.60 H new ATOM 0 HG1 THR A 43 27.102 -6.386 2.956 1.00 6.93 H new ATOM 0 HG21 THR A 43 26.674 -5.930 0.461 1.00 6.92 H new ATOM 0 HG22 THR A 43 27.706 -4.522 0.117 1.00 6.92 H new ATOM 0 HG23 THR A 43 28.332 -5.864 1.103 1.00 6.92 H new ATOM 703 N GLU A 44 27.492 -3.323 5.080 1.00 7.76 N ATOM 704 CA GLU A 44 26.869 -2.639 6.210 1.00 8.32 C ATOM 705 C GLU A 44 27.333 -1.183 6.292 1.00 8.48 C ATOM 706 O GLU A 44 26.516 -0.271 6.407 1.00 8.35 O ATOM 707 CB GLU A 44 27.141 -3.376 7.533 1.00 9.53 C ATOM 708 CG GLU A 44 28.608 -3.465 7.926 1.00 10.03 C ATOM 709 CD GLU A 44 28.803 -3.968 9.341 1.00 11.07 C ATOM 710 OE1 GLU A 44 29.067 -3.135 10.236 1.00 11.69 O ATOM 711 OE2 GLU A 44 28.685 -5.192 9.572 1.00 11.42 O ATOM 0 H GLU A 44 27.998 -4.174 5.323 1.00 7.76 H new ATOM 0 HA GLU A 44 25.792 -2.644 6.044 1.00 8.32 H new ATOM 0 HB2 GLU A 44 26.596 -2.873 8.331 1.00 9.53 H new ATOM 0 HB3 GLU A 44 26.738 -4.386 7.459 1.00 9.53 H new ATOM 0 HG2 GLU A 44 29.126 -4.129 7.234 1.00 10.03 H new ATOM 0 HG3 GLU A 44 29.067 -2.481 7.828 1.00 10.03 H new ATOM 718 N THR A 45 28.639 -0.963 6.225 1.00 8.95 N ATOM 719 CA THR A 45 29.176 0.385 6.252 1.00 9.49 C ATOM 720 C THR A 45 29.230 0.977 4.843 1.00 8.79 C ATOM 721 O THR A 45 28.980 2.160 4.644 1.00 9.04 O ATOM 722 CB THR A 45 30.574 0.433 6.918 1.00 10.61 C ATOM 723 OG1 THR A 45 31.053 1.785 6.979 1.00 11.34 O ATOM 724 CG2 THR A 45 31.582 -0.433 6.172 1.00 11.01 C ATOM 0 H THR A 45 29.341 -1.699 6.152 1.00 8.95 H new ATOM 0 HA THR A 45 28.502 0.991 6.857 1.00 9.49 H new ATOM 0 HB THR A 45 30.467 0.038 7.928 1.00 10.61 H new ATOM 0 HG1 THR A 45 31.936 1.800 7.403 1.00 11.34 H new ATOM 0 HG21 THR A 45 32.550 -0.374 6.669 1.00 11.01 H new ATOM 0 HG22 THR A 45 31.239 -1.468 6.167 1.00 11.01 H new ATOM 0 HG23 THR A 45 31.678 -0.078 5.146 1.00 11.01 H new ATOM 732 N LEU A 46 29.518 0.133 3.863 1.00 8.07 N ATOM 733 CA LEU A 46 29.755 0.581 2.497 1.00 7.71 C ATOM 734 C LEU A 46 28.464 1.098 1.843 1.00 6.77 C ATOM 735 O LEU A 46 28.491 2.081 1.106 1.00 6.93 O ATOM 736 CB LEU A 46 30.391 -0.576 1.707 1.00 7.55 C ATOM 737 CG LEU A 46 30.934 -0.265 0.305 1.00 7.70 C ATOM 738 CD1 LEU A 46 29.857 -0.473 -0.738 1.00 7.76 C ATOM 739 CD2 LEU A 46 31.490 1.151 0.232 1.00 8.22 C ATOM 0 H LEU A 46 29.594 -0.876 3.990 1.00 8.07 H new ATOM 0 HA LEU A 46 30.444 1.426 2.499 1.00 7.71 H new ATOM 0 HB2 LEU A 46 31.210 -0.979 2.303 1.00 7.55 H new ATOM 0 HB3 LEU A 46 29.647 -1.367 1.611 1.00 7.55 H new ATOM 0 HG LEU A 46 31.753 -0.955 0.099 1.00 7.70 H new ATOM 0 HD11 LEU A 46 30.259 -0.248 -1.726 1.00 7.76 H new ATOM 0 HD12 LEU A 46 29.519 -1.509 -0.711 1.00 7.76 H new ATOM 0 HD13 LEU A 46 29.016 0.188 -0.529 1.00 7.76 H new ATOM 0 HD21 LEU A 46 31.867 1.342 -0.773 1.00 8.22 H new ATOM 0 HD22 LEU A 46 30.700 1.865 0.465 1.00 8.22 H new ATOM 0 HD23 LEU A 46 32.302 1.261 0.951 1.00 8.22 H new ATOM 751 N LEU A 47 27.335 0.461 2.141 1.00 5.99 N ATOM 752 CA LEU A 47 26.047 0.882 1.586 1.00 5.15 C ATOM 753 C LEU A 47 25.660 2.257 2.133 1.00 5.48 C ATOM 754 O LEU A 47 25.287 3.153 1.377 1.00 5.21 O ATOM 755 CB LEU A 47 24.964 -0.169 1.911 1.00 4.73 C ATOM 756 CG LEU A 47 23.577 0.004 1.251 1.00 4.22 C ATOM 757 CD1 LEU A 47 22.760 1.090 1.938 1.00 4.20 C ATOM 758 CD2 LEU A 47 23.710 0.300 -0.238 1.00 4.34 C ATOM 0 H LEU A 47 27.283 -0.347 2.762 1.00 5.99 H new ATOM 0 HA LEU A 47 26.133 0.961 0.502 1.00 5.15 H new ATOM 0 HB2 LEU A 47 25.351 -1.148 1.628 1.00 4.73 H new ATOM 0 HB3 LEU A 47 24.822 -0.182 2.992 1.00 4.73 H new ATOM 0 HG LEU A 47 23.045 -0.940 1.368 1.00 4.22 H new ATOM 0 HD11 LEU A 47 21.792 1.183 1.446 1.00 4.20 H new ATOM 0 HD12 LEU A 47 22.612 0.826 2.985 1.00 4.20 H new ATOM 0 HD13 LEU A 47 23.291 2.040 1.875 1.00 4.20 H new ATOM 0 HD21 LEU A 47 22.719 0.417 -0.676 1.00 4.34 H new ATOM 0 HD22 LEU A 47 24.279 1.220 -0.377 1.00 4.34 H new ATOM 0 HD23 LEU A 47 24.228 -0.524 -0.728 1.00 4.34 H new ATOM 770 N VAL A 48 25.777 2.428 3.447 1.00 6.32 N ATOM 771 CA VAL A 48 25.365 3.671 4.091 1.00 6.92 C ATOM 772 C VAL A 48 26.328 4.816 3.781 1.00 7.62 C ATOM 773 O VAL A 48 25.945 5.981 3.782 1.00 7.93 O ATOM 774 CB VAL A 48 25.229 3.515 5.622 1.00 7.91 C ATOM 775 CG1 VAL A 48 24.163 2.485 5.963 1.00 7.84 C ATOM 776 CG2 VAL A 48 26.555 3.140 6.265 1.00 8.67 C ATOM 0 H VAL A 48 26.152 1.725 4.084 1.00 6.32 H new ATOM 0 HA VAL A 48 24.385 3.913 3.679 1.00 6.92 H new ATOM 0 HB VAL A 48 24.925 4.481 6.026 1.00 7.91 H new ATOM 0 HG11 VAL A 48 24.082 2.390 7.046 1.00 7.84 H new ATOM 0 HG12 VAL A 48 23.204 2.805 5.555 1.00 7.84 H new ATOM 0 HG13 VAL A 48 24.437 1.522 5.533 1.00 7.84 H new ATOM 0 HG21 VAL A 48 26.421 3.039 7.342 1.00 8.67 H new ATOM 0 HG22 VAL A 48 26.905 2.194 5.852 1.00 8.67 H new ATOM 0 HG23 VAL A 48 27.291 3.918 6.062 1.00 8.67 H new ATOM 786 N GLN A 49 27.578 4.484 3.509 1.00 8.03 N ATOM 787 CA GLN A 49 28.580 5.494 3.186 1.00 8.97 C ATOM 788 C GLN A 49 28.416 6.003 1.762 1.00 8.65 C ATOM 789 O GLN A 49 28.889 7.088 1.425 1.00 9.36 O ATOM 790 CB GLN A 49 29.990 4.938 3.381 1.00 9.65 C ATOM 791 CG GLN A 49 30.385 4.795 4.839 1.00 10.72 C ATOM 792 CD GLN A 49 30.400 6.123 5.566 1.00 11.48 C ATOM 793 OE1 GLN A 49 29.387 6.557 6.110 1.00 11.55 O ATOM 794 NE2 GLN A 49 31.548 6.778 5.578 1.00 12.22 N ATOM 0 H GLN A 49 27.926 3.525 3.504 1.00 8.03 H new ATOM 0 HA GLN A 49 28.431 6.332 3.868 1.00 8.97 H new ATOM 0 HB2 GLN A 49 30.059 3.964 2.896 1.00 9.65 H new ATOM 0 HB3 GLN A 49 30.703 5.594 2.882 1.00 9.65 H new ATOM 0 HG2 GLN A 49 29.689 4.119 5.336 1.00 10.72 H new ATOM 0 HG3 GLN A 49 31.373 4.338 4.902 1.00 10.72 H new ATOM 0 HE21 GLN A 49 32.366 6.382 5.114 1.00 12.22 H new ATOM 0 HE22 GLN A 49 31.616 7.679 6.051 1.00 12.22 H new ATOM 803 N ASN A 50 27.723 5.232 0.944 1.00 7.73 N ATOM 804 CA ASN A 50 27.594 5.537 -0.476 1.00 7.72 C ATOM 805 C ASN A 50 26.291 6.274 -0.775 1.00 7.17 C ATOM 806 O ASN A 50 25.929 6.464 -1.939 1.00 7.27 O ATOM 807 CB ASN A 50 27.663 4.235 -1.282 1.00 7.34 C ATOM 808 CG ASN A 50 28.383 4.401 -2.605 1.00 7.66 C ATOM 809 OD1 ASN A 50 29.298 5.218 -2.732 1.00 8.30 O ATOM 810 ND2 ASN A 50 27.985 3.626 -3.600 1.00 7.49 N ATOM 0 H ASN A 50 27.237 4.385 1.237 1.00 7.73 H new ATOM 0 HA ASN A 50 28.415 6.194 -0.764 1.00 7.72 H new ATOM 0 HB2 ASN A 50 28.171 3.473 -0.690 1.00 7.34 H new ATOM 0 HB3 ASN A 50 26.651 3.873 -1.467 1.00 7.34 H new ATOM 0 HD21 ASN A 50 28.439 3.692 -4.511 1.00 7.49 H new ATOM 0 HD22 ASN A 50 27.224 2.962 -3.456 1.00 7.49 H new ATOM 817 N ALA A 51 25.593 6.721 0.267 1.00 6.83 N ATOM 818 CA ALA A 51 24.310 7.372 0.076 1.00 6.42 C ATOM 819 C ALA A 51 24.442 8.883 0.199 1.00 7.39 C ATOM 820 O ALA A 51 25.529 9.405 0.453 1.00 8.36 O ATOM 821 CB ALA A 51 23.292 6.837 1.073 1.00 5.86 C ATOM 0 H ALA A 51 25.894 6.643 1.239 1.00 6.83 H new ATOM 0 HA ALA A 51 23.959 7.148 -0.931 1.00 6.42 H new ATOM 0 HB1 ALA A 51 22.335 7.334 0.918 1.00 5.86 H new ATOM 0 HB2 ALA A 51 23.171 5.763 0.929 1.00 5.86 H new ATOM 0 HB3 ALA A 51 23.641 7.029 2.088 1.00 5.86 H new ATOM 827 N ASN A 52 23.331 9.577 0.002 1.00 7.23 N ATOM 828 CA ASN A 52 23.283 11.025 0.157 1.00 8.14 C ATOM 829 C ASN A 52 23.378 11.407 1.630 1.00 8.57 C ATOM 830 O ASN A 52 22.833 10.698 2.474 1.00 8.09 O ATOM 831 CB ASN A 52 21.978 11.571 -0.438 1.00 7.94 C ATOM 832 CG ASN A 52 21.787 13.059 -0.199 1.00 8.81 C ATOM 833 OD1 ASN A 52 21.233 13.471 0.820 1.00 9.40 O ATOM 834 ND2 ASN A 52 22.236 13.873 -1.139 1.00 9.07 N ATOM 0 H ASN A 52 22.442 9.156 -0.268 1.00 7.23 H new ATOM 0 HA ASN A 52 24.131 11.460 -0.373 1.00 8.14 H new ATOM 0 HB2 ASN A 52 21.967 11.378 -1.511 1.00 7.94 H new ATOM 0 HB3 ASN A 52 21.136 11.030 -0.008 1.00 7.94 H new ATOM 0 HD21 ASN A 52 22.129 14.882 -1.034 1.00 9.07 H new ATOM 0 HD22 ASN A 52 22.690 13.492 -1.969 1.00 9.07 H new ATOM 841 N PRO A 53 24.094 12.502 1.960 1.00 9.68 N ATOM 842 CA PRO A 53 24.247 12.986 3.336 1.00 10.41 C ATOM 843 C PRO A 53 22.985 12.823 4.184 1.00 10.13 C ATOM 844 O PRO A 53 23.036 12.253 5.275 1.00 10.29 O ATOM 845 CB PRO A 53 24.567 14.463 3.129 1.00 11.56 C ATOM 846 CG PRO A 53 25.337 14.502 1.851 1.00 11.66 C ATOM 847 CD PRO A 53 24.845 13.348 1.010 1.00 10.51 C ATOM 0 HA PRO A 53 25.005 12.426 3.883 1.00 10.41 H new ATOM 0 HB2 PRO A 53 23.658 15.061 3.063 1.00 11.56 H new ATOM 0 HB3 PRO A 53 25.152 14.862 3.957 1.00 11.56 H new ATOM 0 HG2 PRO A 53 25.182 15.450 1.335 1.00 11.66 H new ATOM 0 HG3 PRO A 53 26.407 14.413 2.041 1.00 11.66 H new ATOM 0 HD2 PRO A 53 24.209 13.692 0.194 1.00 10.51 H new ATOM 0 HD3 PRO A 53 25.674 12.802 0.559 1.00 10.51 H new ATOM 855 N ASP A 54 21.854 13.287 3.657 1.00 9.86 N ATOM 856 CA ASP A 54 20.582 13.261 4.384 1.00 9.76 C ATOM 857 C ASP A 54 20.127 11.828 4.640 1.00 8.93 C ATOM 858 O ASP A 54 19.717 11.476 5.745 1.00 9.26 O ATOM 859 CB ASP A 54 19.508 13.993 3.578 1.00 9.71 C ATOM 860 CG ASP A 54 18.288 14.344 4.407 1.00 9.98 C ATOM 861 OD1 ASP A 54 18.218 15.486 4.910 1.00 10.64 O ATOM 862 OD2 ASP A 54 17.390 13.491 4.558 1.00 9.67 O ATOM 0 H ASP A 54 21.791 13.689 2.722 1.00 9.86 H new ATOM 0 HA ASP A 54 20.731 13.758 5.343 1.00 9.76 H new ATOM 0 HB2 ASP A 54 19.933 14.906 3.160 1.00 9.71 H new ATOM 0 HB3 ASP A 54 19.203 13.370 2.737 1.00 9.71 H new ATOM 867 N CYS A 55 20.225 11.010 3.604 1.00 8.04 N ATOM 868 CA CYS A 55 19.809 9.610 3.667 1.00 7.30 C ATOM 869 C CYS A 55 20.666 8.824 4.655 1.00 7.57 C ATOM 870 O CYS A 55 20.183 7.926 5.338 1.00 7.74 O ATOM 871 CB CYS A 55 19.897 8.975 2.281 1.00 6.46 C ATOM 872 SG CYS A 55 18.973 9.867 1.011 1.00 6.30 S ATOM 0 H CYS A 55 20.594 11.293 2.696 1.00 8.04 H new ATOM 0 HA CYS A 55 18.776 9.579 4.014 1.00 7.30 H new ATOM 0 HB2 CYS A 55 20.944 8.919 1.983 1.00 6.46 H new ATOM 0 HB3 CYS A 55 19.526 7.952 2.336 1.00 6.46 H new ATOM 0 HG CYS A 55 19.320 9.432 -0.164 1.00 6.30 H new ATOM 878 N LYS A 56 21.946 9.162 4.718 1.00 7.87 N ATOM 879 CA LYS A 56 22.847 8.560 5.693 1.00 8.36 C ATOM 880 C LYS A 56 22.496 9.068 7.083 1.00 9.50 C ATOM 881 O LYS A 56 22.486 8.318 8.061 1.00 10.04 O ATOM 882 CB LYS A 56 24.291 8.936 5.374 1.00 8.58 C ATOM 883 CG LYS A 56 24.722 8.635 3.958 1.00 8.84 C ATOM 884 CD LYS A 56 25.831 9.580 3.530 1.00 8.68 C ATOM 885 CE LYS A 56 26.996 9.579 4.513 1.00 9.50 C ATOM 886 NZ LYS A 56 27.703 8.273 4.542 1.00 9.81 N ATOM 0 H LYS A 56 22.385 9.850 4.106 1.00 7.87 H new ATOM 0 HA LYS A 56 22.741 7.476 5.654 1.00 8.36 H new ATOM 0 HB2 LYS A 56 24.425 10.001 5.562 1.00 8.58 H new ATOM 0 HB3 LYS A 56 24.951 8.406 6.061 1.00 8.58 H new ATOM 0 HG2 LYS A 56 25.067 7.603 3.888 1.00 8.84 H new ATOM 0 HG3 LYS A 56 23.871 8.733 3.284 1.00 8.84 H new ATOM 0 HD2 LYS A 56 26.191 9.292 2.542 1.00 8.68 H new ATOM 0 HD3 LYS A 56 25.432 10.591 3.442 1.00 8.68 H new ATOM 0 HE2 LYS A 56 27.700 10.366 4.241 1.00 9.50 H new ATOM 0 HE3 LYS A 56 26.627 9.813 5.512 1.00 9.50 H new ATOM 0 HZ1 LYS A 56 28.016 8.069 5.513 1.00 9.81 H new ATOM 0 HZ2 LYS A 56 27.059 7.522 4.221 1.00 9.81 H new ATOM 0 HZ3 LYS A 56 28.530 8.312 3.912 1.00 9.81 H new ATOM 900 N THR A 57 22.202 10.359 7.135 1.00 9.98 N ATOM 901 CA THR A 57 21.858 11.053 8.366 1.00 11.08 C ATOM 902 C THR A 57 20.706 10.377 9.112 1.00 11.16 C ATOM 903 O THR A 57 20.837 10.054 10.292 1.00 12.08 O ATOM 904 CB THR A 57 21.502 12.521 8.056 1.00 11.53 C ATOM 905 OG1 THR A 57 22.687 13.236 7.684 1.00 12.00 O ATOM 906 CG2 THR A 57 20.834 13.209 9.234 1.00 12.46 C ATOM 0 H THR A 57 22.196 10.961 6.312 1.00 9.98 H new ATOM 0 HA THR A 57 22.730 11.015 9.019 1.00 11.08 H new ATOM 0 HB THR A 57 20.790 12.521 7.230 1.00 11.53 H new ATOM 0 HG1 THR A 57 23.144 12.758 6.961 1.00 12.00 H new ATOM 0 HG21 THR A 57 20.602 14.240 8.969 1.00 12.46 H new ATOM 0 HG22 THR A 57 19.913 12.684 9.488 1.00 12.46 H new ATOM 0 HG23 THR A 57 21.507 13.197 10.091 1.00 12.46 H new ATOM 914 N ILE A 58 19.593 10.152 8.424 1.00 10.34 N ATOM 915 CA ILE A 58 18.415 9.565 9.059 1.00 10.60 C ATOM 916 C ILE A 58 18.725 8.210 9.687 1.00 10.65 C ATOM 917 O ILE A 58 18.267 7.915 10.787 1.00 11.46 O ATOM 918 CB ILE A 58 17.245 9.392 8.071 1.00 9.96 C ATOM 919 CG1 ILE A 58 17.705 8.632 6.827 1.00 8.86 C ATOM 920 CG2 ILE A 58 16.659 10.744 7.696 1.00 10.22 C ATOM 921 CD1 ILE A 58 16.581 8.229 5.906 1.00 8.44 C ATOM 0 H ILE A 58 19.480 10.365 7.433 1.00 10.34 H new ATOM 0 HA ILE A 58 18.121 10.268 9.838 1.00 10.60 H new ATOM 0 HB ILE A 58 16.463 8.808 8.557 1.00 9.96 H new ATOM 0 HG12 ILE A 58 18.410 9.253 6.274 1.00 8.86 H new ATOM 0 HG13 ILE A 58 18.245 7.738 7.139 1.00 8.86 H new ATOM 0 HG21 ILE A 58 15.834 10.602 6.998 1.00 10.22 H new ATOM 0 HG22 ILE A 58 16.293 11.243 8.593 1.00 10.22 H new ATOM 0 HG23 ILE A 58 17.429 11.357 7.228 1.00 10.22 H new ATOM 0 HD11 ILE A 58 16.988 7.695 5.047 1.00 8.44 H new ATOM 0 HD12 ILE A 58 15.887 7.581 6.441 1.00 8.44 H new ATOM 0 HD13 ILE A 58 16.055 9.120 5.563 1.00 8.44 H new ATOM 933 N LEU A 59 19.522 7.405 8.992 1.00 9.90 N ATOM 934 CA LEU A 59 19.843 6.056 9.445 1.00 9.98 C ATOM 935 C LEU A 59 20.524 6.081 10.807 1.00 11.20 C ATOM 936 O LEU A 59 20.151 5.338 11.718 1.00 11.84 O ATOM 937 CB LEU A 59 20.747 5.356 8.429 1.00 9.07 C ATOM 938 CG LEU A 59 20.191 5.283 7.006 1.00 7.91 C ATOM 939 CD1 LEU A 59 21.158 4.552 6.090 1.00 7.28 C ATOM 940 CD2 LEU A 59 18.832 4.604 6.998 1.00 7.92 C ATOM 0 H LEU A 59 19.960 7.665 8.108 1.00 9.90 H new ATOM 0 HA LEU A 59 18.908 5.503 9.537 1.00 9.98 H new ATOM 0 HB2 LEU A 59 21.706 5.874 8.402 1.00 9.07 H new ATOM 0 HB3 LEU A 59 20.943 4.342 8.778 1.00 9.07 H new ATOM 0 HG LEU A 59 20.069 6.300 6.634 1.00 7.91 H new ATOM 0 HD11 LEU A 59 20.744 4.511 5.082 1.00 7.28 H new ATOM 0 HD12 LEU A 59 22.111 5.081 6.070 1.00 7.28 H new ATOM 0 HD13 LEU A 59 21.314 3.539 6.460 1.00 7.28 H new ATOM 0 HD21 LEU A 59 18.453 4.561 5.977 1.00 7.92 H new ATOM 0 HD22 LEU A 59 18.928 3.592 7.392 1.00 7.92 H new ATOM 0 HD23 LEU A 59 18.139 5.171 7.619 1.00 7.92 H new ATOM 952 N LYS A 60 21.511 6.949 10.950 1.00 11.67 N ATOM 953 CA LYS A 60 22.264 7.041 12.192 1.00 12.90 C ATOM 954 C LYS A 60 21.496 7.857 13.227 1.00 13.86 C ATOM 955 O LYS A 60 21.729 7.734 14.429 1.00 14.91 O ATOM 956 CB LYS A 60 23.651 7.635 11.931 1.00 13.23 C ATOM 957 CG LYS A 60 23.627 9.044 11.364 1.00 13.20 C ATOM 958 CD LYS A 60 24.908 9.365 10.612 1.00 13.44 C ATOM 959 CE LYS A 60 26.143 9.223 11.491 1.00 14.35 C ATOM 960 NZ LYS A 60 26.155 10.200 12.611 1.00 14.91 N ATOM 0 H LYS A 60 21.810 7.600 10.224 1.00 11.67 H new ATOM 0 HA LYS A 60 22.398 6.037 12.595 1.00 12.90 H new ATOM 0 HB2 LYS A 60 24.213 7.640 12.865 1.00 13.23 H new ATOM 0 HB3 LYS A 60 24.188 6.986 11.239 1.00 13.23 H new ATOM 0 HG2 LYS A 60 22.774 9.153 10.694 1.00 13.20 H new ATOM 0 HG3 LYS A 60 23.490 9.761 12.174 1.00 13.20 H new ATOM 0 HD2 LYS A 60 24.998 8.701 9.752 1.00 13.44 H new ATOM 0 HD3 LYS A 60 24.855 10.383 10.225 1.00 13.44 H new ATOM 0 HE2 LYS A 60 26.185 8.211 11.894 1.00 14.35 H new ATOM 0 HE3 LYS A 60 27.037 9.361 10.883 1.00 14.35 H new ATOM 0 HZ1 LYS A 60 27.053 10.122 13.130 1.00 14.91 H new ATOM 0 HZ2 LYS A 60 26.057 11.164 12.232 1.00 14.91 H new ATOM 0 HZ3 LYS A 60 25.364 9.999 13.255 1.00 14.91 H new ATOM 974 N ALA A 61 20.558 8.667 12.756 1.00 13.54 N ATOM 975 CA ALA A 61 19.735 9.482 13.638 1.00 14.41 C ATOM 976 C ALA A 61 18.624 8.652 14.270 1.00 14.65 C ATOM 977 O ALA A 61 17.965 9.097 15.207 1.00 15.64 O ATOM 978 CB ALA A 61 19.152 10.667 12.884 1.00 14.06 C ATOM 0 H ALA A 61 20.348 8.777 11.764 1.00 13.54 H new ATOM 0 HA ALA A 61 20.372 9.861 14.438 1.00 14.41 H new ATOM 0 HB1 ALA A 61 18.540 11.264 13.561 1.00 14.06 H new ATOM 0 HB2 ALA A 61 19.961 11.281 12.490 1.00 14.06 H new ATOM 0 HB3 ALA A 61 18.536 10.307 12.060 1.00 14.06 H new ATOM 984 N LEU A 62 18.406 7.451 13.739 1.00 13.84 N ATOM 985 CA LEU A 62 17.444 6.525 14.323 1.00 14.21 C ATOM 986 C LEU A 62 17.944 6.021 15.669 1.00 14.97 C ATOM 987 O LEU A 62 17.163 5.789 16.590 1.00 15.72 O ATOM 988 CB LEU A 62 17.210 5.338 13.388 1.00 13.37 C ATOM 989 CG LEU A 62 16.638 5.689 12.015 1.00 12.15 C ATOM 990 CD1 LEU A 62 16.722 4.487 11.094 1.00 11.39 C ATOM 991 CD2 LEU A 62 15.202 6.173 12.139 1.00 12.25 C ATOM 0 H LEU A 62 18.882 7.099 12.908 1.00 13.84 H new ATOM 0 HA LEU A 62 16.503 7.056 14.467 1.00 14.21 H new ATOM 0 HB2 LEU A 62 18.157 4.817 13.246 1.00 13.37 H new ATOM 0 HB3 LEU A 62 16.532 4.639 13.878 1.00 13.37 H new ATOM 0 HG LEU A 62 17.230 6.498 11.587 1.00 12.15 H new ATOM 0 HD11 LEU A 62 16.312 4.747 10.118 1.00 11.39 H new ATOM 0 HD12 LEU A 62 17.764 4.187 10.982 1.00 11.39 H new ATOM 0 HD13 LEU A 62 16.151 3.662 11.519 1.00 11.39 H new ATOM 0 HD21 LEU A 62 14.814 6.418 11.150 1.00 12.25 H new ATOM 0 HD22 LEU A 62 14.591 5.388 12.585 1.00 12.25 H new ATOM 0 HD23 LEU A 62 15.170 7.061 12.771 1.00 12.25 H new ATOM 1003 N GLY A 63 19.257 5.852 15.773 1.00 14.89 N ATOM 1004 CA GLY A 63 19.847 5.359 17.001 1.00 15.66 C ATOM 1005 C GLY A 63 20.804 4.208 16.759 1.00 16.04 C ATOM 1006 O GLY A 63 22.018 4.394 16.803 1.00 16.17 O ATOM 0 H GLY A 63 19.924 6.048 15.027 1.00 14.89 H new ATOM 0 HA2 GLY A 63 20.378 6.171 17.498 1.00 15.66 H new ATOM 0 HA3 GLY A 63 19.056 5.035 17.677 1.00 15.66 H new ATOM 1010 N PRO A 64 20.280 3.002 16.471 1.00 16.36 N ATOM 1011 CA PRO A 64 21.108 1.808 16.252 1.00 16.89 C ATOM 1012 C PRO A 64 21.904 1.874 14.953 1.00 16.41 C ATOM 1013 O PRO A 64 22.758 1.028 14.688 1.00 16.65 O ATOM 1014 CB PRO A 64 20.086 0.669 16.191 1.00 17.44 C ATOM 1015 CG PRO A 64 18.814 1.319 15.770 1.00 16.99 C ATOM 1016 CD PRO A 64 18.840 2.706 16.350 1.00 16.40 C ATOM 0 HA PRO A 64 21.856 1.690 17.036 1.00 16.89 H new ATOM 0 HB2 PRO A 64 20.392 -0.099 15.480 1.00 17.44 H new ATOM 0 HB3 PRO A 64 19.979 0.182 17.160 1.00 17.44 H new ATOM 0 HG2 PRO A 64 18.735 1.353 14.683 1.00 16.99 H new ATOM 0 HG3 PRO A 64 17.952 0.761 16.135 1.00 16.99 H new ATOM 0 HD2 PRO A 64 18.336 3.422 15.701 1.00 16.40 H new ATOM 0 HD3 PRO A 64 18.339 2.746 17.317 1.00 16.40 H new ATOM 1024 N GLY A 65 21.617 2.879 14.140 1.00 15.83 N ATOM 1025 CA GLY A 65 22.315 3.033 12.882 1.00 15.53 C ATOM 1026 C GLY A 65 21.609 2.320 11.752 1.00 14.59 C ATOM 1027 O GLY A 65 22.103 2.302 10.625 1.00 14.42 O ATOM 0 H GLY A 65 20.912 3.591 14.330 1.00 15.83 H new ATOM 0 HA2 GLY A 65 22.403 4.093 12.643 1.00 15.53 H new ATOM 0 HA3 GLY A 65 23.328 2.643 12.980 1.00 15.53 H new ATOM 1031 N ALA A 66 20.454 1.735 12.073 1.00 14.15 N ATOM 1032 CA ALA A 66 19.633 1.006 11.109 1.00 13.39 C ATOM 1033 C ALA A 66 20.316 -0.281 10.655 1.00 13.11 C ATOM 1034 O ALA A 66 21.277 -0.260 9.887 1.00 12.58 O ATOM 1035 CB ALA A 66 19.288 1.888 9.916 1.00 12.24 C ATOM 0 H ALA A 66 20.061 1.755 13.014 1.00 14.15 H new ATOM 0 HA ALA A 66 18.705 0.728 11.608 1.00 13.39 H new ATOM 0 HB1 ALA A 66 18.676 1.324 9.212 1.00 12.24 H new ATOM 0 HB2 ALA A 66 18.735 2.763 10.258 1.00 12.24 H new ATOM 0 HB3 ALA A 66 20.206 2.209 9.423 1.00 12.24 H new ATOM 1041 N THR A 67 19.814 -1.403 11.147 1.00 13.60 N ATOM 1042 CA THR A 67 20.376 -2.700 10.816 1.00 13.52 C ATOM 1043 C THR A 67 20.056 -3.102 9.372 1.00 12.33 C ATOM 1044 O THR A 67 20.938 -3.097 8.516 1.00 11.64 O ATOM 1045 CB THR A 67 19.872 -3.777 11.791 1.00 14.67 C ATOM 1046 OG1 THR A 67 19.977 -3.293 13.137 1.00 15.33 O ATOM 1047 CG2 THR A 67 20.679 -5.057 11.649 1.00 15.45 C ATOM 0 H THR A 67 19.015 -1.440 11.780 1.00 13.60 H new ATOM 0 HA THR A 67 21.459 -2.619 10.910 1.00 13.52 H new ATOM 0 HB THR A 67 18.831 -3.996 11.555 1.00 14.67 H new ATOM 0 HG1 THR A 67 19.306 -2.595 13.287 1.00 15.33 H new ATOM 0 HG21 THR A 67 20.304 -5.803 12.349 1.00 15.45 H new ATOM 0 HG22 THR A 67 20.586 -5.435 10.631 1.00 15.45 H new ATOM 0 HG23 THR A 67 21.727 -4.852 11.865 1.00 15.45 H new ATOM 1055 N LEU A 68 18.804 -3.449 9.095 1.00 12.22 N ATOM 1056 CA LEU A 68 18.409 -3.820 7.738 1.00 11.25 C ATOM 1057 C LEU A 68 16.998 -3.320 7.442 1.00 11.10 C ATOM 1058 O LEU A 68 16.801 -2.467 6.581 1.00 10.12 O ATOM 1059 CB LEU A 68 18.503 -5.347 7.554 1.00 11.69 C ATOM 1060 CG LEU A 68 18.515 -5.871 6.104 1.00 10.84 C ATOM 1061 CD1 LEU A 68 17.142 -5.763 5.457 1.00 10.70 C ATOM 1062 CD2 LEU A 68 19.554 -5.130 5.272 1.00 9.79 C ATOM 0 H LEU A 68 18.051 -3.482 9.782 1.00 12.22 H new ATOM 0 HA LEU A 68 19.091 -3.349 7.030 1.00 11.25 H new ATOM 0 HB2 LEU A 68 19.410 -5.694 8.049 1.00 11.69 H new ATOM 0 HB3 LEU A 68 17.662 -5.805 8.074 1.00 11.69 H new ATOM 0 HG LEU A 68 18.783 -6.927 6.140 1.00 10.84 H new ATOM 0 HD11 LEU A 68 17.190 -6.142 4.436 1.00 10.70 H new ATOM 0 HD12 LEU A 68 16.423 -6.350 6.028 1.00 10.70 H new ATOM 0 HD13 LEU A 68 16.828 -4.719 5.442 1.00 10.70 H new ATOM 0 HD21 LEU A 68 19.546 -5.515 4.252 1.00 9.79 H new ATOM 0 HD22 LEU A 68 19.319 -4.066 5.260 1.00 9.79 H new ATOM 0 HD23 LEU A 68 20.542 -5.278 5.708 1.00 9.79 H new ATOM 1074 N GLU A 69 16.015 -3.832 8.170 1.00 12.16 N ATOM 1075 CA GLU A 69 14.631 -3.425 7.951 1.00 12.26 C ATOM 1076 C GLU A 69 14.431 -1.991 8.419 1.00 11.96 C ATOM 1077 O GLU A 69 13.538 -1.281 7.951 1.00 11.57 O ATOM 1078 CB GLU A 69 13.667 -4.365 8.678 1.00 13.61 C ATOM 1079 CG GLU A 69 13.893 -4.431 10.179 1.00 14.60 C ATOM 1080 CD GLU A 69 12.950 -5.390 10.869 1.00 15.86 C ATOM 1081 OE1 GLU A 69 13.284 -6.590 10.974 1.00 16.53 O ATOM 1082 OE2 GLU A 69 11.875 -4.949 11.320 1.00 16.24 O ATOM 0 H GLU A 69 16.146 -4.522 8.910 1.00 12.16 H new ATOM 0 HA GLU A 69 14.417 -3.481 6.884 1.00 12.26 H new ATOM 0 HB2 GLU A 69 12.644 -4.040 8.488 1.00 13.61 H new ATOM 0 HB3 GLU A 69 13.766 -5.367 8.260 1.00 13.61 H new ATOM 0 HG2 GLU A 69 14.921 -4.735 10.374 1.00 14.60 H new ATOM 0 HG3 GLU A 69 13.769 -3.436 10.605 1.00 14.60 H new ATOM 1089 N GLU A 70 15.288 -1.573 9.333 1.00 12.26 N ATOM 1090 CA GLU A 70 15.252 -0.225 9.865 1.00 12.19 C ATOM 1091 C GLU A 70 15.633 0.777 8.784 1.00 10.92 C ATOM 1092 O GLU A 70 14.928 1.757 8.558 1.00 10.57 O ATOM 1093 CB GLU A 70 16.207 -0.119 11.046 1.00 13.06 C ATOM 1094 CG GLU A 70 16.148 -1.321 11.973 1.00 14.21 C ATOM 1095 CD GLU A 70 16.909 -1.100 13.259 1.00 15.02 C ATOM 1096 OE1 GLU A 70 16.315 -0.561 14.213 1.00 15.56 O ATOM 1097 OE2 GLU A 70 18.104 -1.457 13.313 1.00 15.23 O ATOM 0 H GLU A 70 16.026 -2.157 9.726 1.00 12.26 H new ATOM 0 HA GLU A 70 14.241 0.002 10.203 1.00 12.19 H new ATOM 0 HB2 GLU A 70 17.225 -0.006 10.673 1.00 13.06 H new ATOM 0 HB3 GLU A 70 15.974 0.782 11.614 1.00 13.06 H new ATOM 0 HG2 GLU A 70 15.107 -1.546 12.205 1.00 14.21 H new ATOM 0 HG3 GLU A 70 16.555 -2.192 11.459 1.00 14.21 H new ATOM 1104 N MET A 71 16.739 0.507 8.094 1.00 10.30 N ATOM 1105 CA MET A 71 17.190 1.383 7.016 1.00 9.14 C ATOM 1106 C MET A 71 16.235 1.302 5.834 1.00 8.31 C ATOM 1107 O MET A 71 16.090 2.258 5.081 1.00 7.58 O ATOM 1108 CB MET A 71 18.625 1.053 6.569 1.00 8.85 C ATOM 1109 CG MET A 71 18.816 -0.360 6.045 1.00 8.69 C ATOM 1110 SD MET A 71 20.447 -0.630 5.321 1.00 8.41 S ATOM 1111 CE MET A 71 21.515 -0.292 6.716 1.00 8.50 C ATOM 0 H MET A 71 17.335 -0.304 8.260 1.00 10.30 H new ATOM 0 HA MET A 71 17.195 2.402 7.403 1.00 9.14 H new ATOM 0 HB2 MET A 71 18.920 1.758 5.791 1.00 8.85 H new ATOM 0 HB3 MET A 71 19.299 1.208 7.412 1.00 8.85 H new ATOM 0 HG2 MET A 71 18.665 -1.067 6.860 1.00 8.69 H new ATOM 0 HG3 MET A 71 18.053 -0.570 5.296 1.00 8.69 H new ATOM 0 HE1 MET A 71 22.535 -0.588 6.473 1.00 8.50 H new ATOM 0 HE2 MET A 71 21.491 0.774 6.943 1.00 8.50 H new ATOM 0 HE3 MET A 71 21.170 -0.855 7.583 1.00 8.50 H new ATOM 1121 N MET A 72 15.565 0.165 5.692 1.00 8.67 N ATOM 1122 CA MET A 72 14.564 0.004 4.647 1.00 8.32 C ATOM 1123 C MET A 72 13.403 0.948 4.896 1.00 8.63 C ATOM 1124 O MET A 72 13.015 1.719 4.025 1.00 8.10 O ATOM 1125 CB MET A 72 14.060 -1.438 4.601 1.00 9.08 C ATOM 1126 CG MET A 72 13.104 -1.710 3.448 1.00 9.10 C ATOM 1127 SD MET A 72 12.417 -3.375 3.497 1.00 10.28 S ATOM 1128 CE MET A 72 13.911 -4.358 3.403 1.00 11.15 C ATOM 0 H MET A 72 15.696 -0.655 6.284 1.00 8.67 H new ATOM 0 HA MET A 72 15.023 0.241 3.687 1.00 8.32 H new ATOM 0 HB2 MET A 72 14.914 -2.111 4.521 1.00 9.08 H new ATOM 0 HB3 MET A 72 13.559 -1.670 5.541 1.00 9.08 H new ATOM 0 HG2 MET A 72 12.291 -0.984 3.476 1.00 9.10 H new ATOM 0 HG3 MET A 72 13.629 -1.565 2.504 1.00 9.10 H new ATOM 0 HE1 MET A 72 13.653 -5.392 3.173 1.00 11.15 H new ATOM 0 HE2 MET A 72 14.558 -3.963 2.620 1.00 11.15 H new ATOM 0 HE3 MET A 72 14.433 -4.318 4.359 1.00 11.15 H new ATOM 1138 N THR A 73 12.877 0.888 6.107 1.00 9.62 N ATOM 1139 CA THR A 73 11.772 1.738 6.525 1.00 10.09 C ATOM 1140 C THR A 73 12.178 3.214 6.520 1.00 9.53 C ATOM 1141 O THR A 73 11.350 4.104 6.308 1.00 9.49 O ATOM 1142 CB THR A 73 11.294 1.336 7.934 1.00 11.37 C ATOM 1143 OG1 THR A 73 11.025 -0.073 7.963 1.00 12.02 O ATOM 1144 CG2 THR A 73 10.042 2.104 8.337 1.00 11.93 C ATOM 0 H THR A 73 13.204 0.248 6.831 1.00 9.62 H new ATOM 0 HA THR A 73 10.957 1.602 5.814 1.00 10.09 H new ATOM 0 HB THR A 73 12.083 1.581 8.645 1.00 11.37 H new ATOM 0 HG1 THR A 73 11.870 -0.566 8.023 1.00 12.02 H new ATOM 0 HG21 THR A 73 9.732 1.796 9.336 1.00 11.93 H new ATOM 0 HG22 THR A 73 10.255 3.173 8.336 1.00 11.93 H new ATOM 0 HG23 THR A 73 9.242 1.893 7.628 1.00 11.93 H new ATOM 1152 N ALA A 74 13.460 3.457 6.745 1.00 9.27 N ATOM 1153 CA ALA A 74 13.993 4.809 6.780 1.00 9.02 C ATOM 1154 C ALA A 74 14.206 5.368 5.375 1.00 8.01 C ATOM 1155 O ALA A 74 13.838 6.507 5.091 1.00 8.00 O ATOM 1156 CB ALA A 74 15.294 4.827 7.563 1.00 9.32 C ATOM 0 H ALA A 74 14.155 2.728 6.907 1.00 9.27 H new ATOM 0 HA ALA A 74 13.263 5.449 7.277 1.00 9.02 H new ATOM 0 HB1 ALA A 74 15.690 5.842 7.587 1.00 9.32 H new ATOM 0 HB2 ALA A 74 15.110 4.485 8.582 1.00 9.32 H new ATOM 0 HB3 ALA A 74 16.017 4.167 7.083 1.00 9.32 H new ATOM 1162 N CYS A 75 14.788 4.567 4.492 1.00 7.31 N ATOM 1163 CA CYS A 75 15.110 5.022 3.142 1.00 6.51 C ATOM 1164 C CYS A 75 13.941 4.824 2.177 1.00 6.63 C ATOM 1165 O CYS A 75 14.097 4.955 0.965 1.00 6.46 O ATOM 1166 CB CYS A 75 16.350 4.298 2.621 1.00 5.86 C ATOM 1167 SG CYS A 75 17.846 4.608 3.589 1.00 6.16 S ATOM 0 H CYS A 75 15.047 3.599 4.684 1.00 7.31 H new ATOM 0 HA CYS A 75 15.313 6.092 3.198 1.00 6.51 H new ATOM 0 HB2 CYS A 75 16.154 3.226 2.609 1.00 5.86 H new ATOM 0 HB3 CYS A 75 16.528 4.601 1.589 1.00 5.86 H new ATOM 0 HG CYS A 75 18.151 3.543 4.269 1.00 6.16 H new ATOM 1173 N GLN A 76 12.776 4.495 2.708 1.00 7.27 N ATOM 1174 CA GLN A 76 11.579 4.420 1.888 1.00 7.76 C ATOM 1175 C GLN A 76 10.705 5.640 2.156 1.00 8.19 C ATOM 1176 O GLN A 76 10.369 5.939 3.304 1.00 8.73 O ATOM 1177 CB GLN A 76 10.819 3.100 2.126 1.00 8.60 C ATOM 1178 CG GLN A 76 10.207 2.935 3.511 1.00 9.19 C ATOM 1179 CD GLN A 76 8.792 3.473 3.599 1.00 10.10 C ATOM 1180 OE1 GLN A 76 8.047 3.459 2.618 1.00 10.49 O ATOM 1181 NE2 GLN A 76 8.415 3.958 4.771 1.00 10.66 N ATOM 0 H GLN A 76 12.633 4.277 3.694 1.00 7.27 H new ATOM 0 HA GLN A 76 11.864 4.425 0.836 1.00 7.76 H new ATOM 0 HB2 GLN A 76 10.024 3.021 1.385 1.00 8.60 H new ATOM 0 HB3 GLN A 76 11.503 2.270 1.949 1.00 8.60 H new ATOM 0 HG2 GLN A 76 10.206 1.878 3.779 1.00 9.19 H new ATOM 0 HG3 GLN A 76 10.832 3.448 4.242 1.00 9.19 H new ATOM 0 HE21 GLN A 76 9.063 3.951 5.558 1.00 10.66 H new ATOM 0 HE22 GLN A 76 7.476 4.339 4.887 1.00 10.66 H new ATOM 1190 N GLY A 77 10.398 6.382 1.104 1.00 8.13 N ATOM 1191 CA GLY A 77 9.602 7.583 1.254 1.00 8.58 C ATOM 1192 C GLY A 77 10.379 8.696 1.927 1.00 8.30 C ATOM 1193 O GLY A 77 9.793 9.666 2.416 1.00 8.85 O ATOM 0 H GLY A 77 10.686 6.175 0.148 1.00 8.13 H new ATOM 0 HA2 GLY A 77 9.263 7.918 0.274 1.00 8.58 H new ATOM 0 HA3 GLY A 77 8.711 7.357 1.840 1.00 8.58 H new ATOM 1197 N VAL A 78 11.701 8.559 1.949 1.00 7.65 N ATOM 1198 CA VAL A 78 12.558 9.535 2.606 1.00 7.69 C ATOM 1199 C VAL A 78 12.586 10.839 1.818 1.00 8.18 C ATOM 1200 O VAL A 78 13.004 10.878 0.659 1.00 8.24 O ATOM 1201 CB VAL A 78 13.999 9.000 2.815 1.00 7.30 C ATOM 1202 CG1 VAL A 78 14.610 8.509 1.510 1.00 7.56 C ATOM 1203 CG2 VAL A 78 14.882 10.065 3.452 1.00 7.23 C ATOM 0 H VAL A 78 12.201 7.781 1.519 1.00 7.65 H new ATOM 0 HA VAL A 78 12.134 9.724 3.592 1.00 7.69 H new ATOM 0 HB VAL A 78 13.937 8.148 3.492 1.00 7.30 H new ATOM 0 HG11 VAL A 78 15.619 8.142 1.696 1.00 7.56 H new ATOM 0 HG12 VAL A 78 14.000 7.703 1.103 1.00 7.56 H new ATOM 0 HG13 VAL A 78 14.649 9.331 0.795 1.00 7.56 H new ATOM 0 HG21 VAL A 78 15.888 9.669 3.590 1.00 7.23 H new ATOM 0 HG22 VAL A 78 14.922 10.940 2.803 1.00 7.23 H new ATOM 0 HG23 VAL A 78 14.469 10.349 4.420 1.00 7.23 H new ATOM 1213 N GLY A 79 12.113 11.900 2.443 1.00 8.79 N ATOM 1214 CA GLY A 79 12.048 13.183 1.781 1.00 9.46 C ATOM 1215 C GLY A 79 10.714 13.401 1.105 1.00 9.86 C ATOM 1216 O GLY A 79 10.452 14.475 0.563 1.00 10.49 O ATOM 0 H GLY A 79 11.770 11.897 3.404 1.00 8.79 H new ATOM 0 HA2 GLY A 79 12.220 13.976 2.509 1.00 9.46 H new ATOM 0 HA3 GLY A 79 12.845 13.251 1.041 1.00 9.46 H new ATOM 1220 N GLY A 80 9.868 12.375 1.138 1.00 9.69 N ATOM 1221 CA GLY A 80 8.548 12.482 0.555 1.00 10.31 C ATOM 1222 C GLY A 80 7.712 13.526 1.263 1.00 10.42 C ATOM 1223 O GLY A 80 7.645 13.526 2.491 1.00 10.24 O ATOM 0 H GLY A 80 10.077 11.470 1.560 1.00 9.69 H new ATOM 0 HA2 GLY A 80 8.635 12.739 -0.501 1.00 10.31 H new ATOM 0 HA3 GLY A 80 8.046 11.516 0.608 1.00 10.31 H new ATOM 1227 N PRO A 81 7.072 14.435 0.510 1.00 10.92 N ATOM 1228 CA PRO A 81 6.289 15.541 1.080 1.00 11.29 C ATOM 1229 C PRO A 81 5.029 15.068 1.808 1.00 11.16 C ATOM 1230 O PRO A 81 3.913 15.192 1.294 1.00 11.39 O ATOM 1231 CB PRO A 81 5.920 16.385 -0.145 1.00 12.10 C ATOM 1232 CG PRO A 81 5.977 15.439 -1.293 1.00 12.10 C ATOM 1233 CD PRO A 81 7.068 14.461 -0.965 1.00 11.39 C ATOM 0 HA PRO A 81 6.855 16.085 1.837 1.00 11.29 H new ATOM 0 HB2 PRO A 81 4.926 16.820 -0.040 1.00 12.10 H new ATOM 0 HB3 PRO A 81 6.617 17.212 -0.280 1.00 12.10 H new ATOM 0 HG2 PRO A 81 5.023 14.929 -1.427 1.00 12.10 H new ATOM 0 HG3 PRO A 81 6.191 15.966 -2.223 1.00 12.10 H new ATOM 0 HD2 PRO A 81 6.863 13.476 -1.384 1.00 11.39 H new ATOM 0 HD3 PRO A 81 8.030 14.783 -1.364 1.00 11.39 H new ATOM 1241 N GLY A 82 5.217 14.530 3.008 1.00 10.99 N ATOM 1242 CA GLY A 82 4.103 14.070 3.807 1.00 11.07 C ATOM 1243 C GLY A 82 3.390 12.894 3.175 1.00 10.54 C ATOM 1244 O GLY A 82 2.228 13.006 2.782 1.00 10.90 O ATOM 0 H GLY A 82 6.131 14.405 3.442 1.00 10.99 H new ATOM 0 HA2 GLY A 82 4.461 13.786 4.796 1.00 11.07 H new ATOM 0 HA3 GLY A 82 3.396 14.888 3.947 1.00 11.07 H new ATOM 1248 N HIS A 83 4.076 11.763 3.068 1.00 9.87 N ATOM 1249 CA HIS A 83 3.468 10.572 2.480 1.00 9.50 C ATOM 1250 C HIS A 83 2.565 9.885 3.503 1.00 9.01 C ATOM 1251 O HIS A 83 2.897 8.840 4.060 1.00 8.60 O ATOM 1252 CB HIS A 83 4.545 9.604 1.944 1.00 9.28 C ATOM 1253 CG HIS A 83 5.598 9.198 2.941 1.00 9.71 C ATOM 1254 ND1 HIS A 83 5.623 7.962 3.552 1.00 9.88 N ATOM 1255 CD2 HIS A 83 6.679 9.864 3.413 1.00 10.26 C ATOM 1256 CE1 HIS A 83 6.667 7.888 4.353 1.00 10.48 C ATOM 1257 NE2 HIS A 83 7.324 9.028 4.286 1.00 10.71 N ATOM 0 H HIS A 83 5.041 11.643 3.376 1.00 9.87 H new ATOM 0 HA HIS A 83 2.856 10.878 1.631 1.00 9.50 H new ATOM 0 HB2 HIS A 83 4.051 8.705 1.575 1.00 9.28 H new ATOM 0 HB3 HIS A 83 5.037 10.070 1.090 1.00 9.28 H new ATOM 0 HD2 HIS A 83 6.977 10.868 3.150 1.00 10.26 H new ATOM 0 HE1 HIS A 83 6.938 7.037 4.961 1.00 10.48 H new ATOM 0 HE2 HIS A 83 8.175 9.252 4.801 1.00 10.71 H new ATOM 1266 N LYS A 84 1.411 10.489 3.733 1.00 9.30 N ATOM 1267 CA LYS A 84 0.471 10.010 4.737 1.00 9.11 C ATOM 1268 C LYS A 84 -0.826 9.519 4.103 1.00 8.52 C ATOM 1269 O LYS A 84 -1.681 8.956 4.781 1.00 8.22 O ATOM 1270 CB LYS A 84 0.178 11.131 5.735 1.00 9.97 C ATOM 1271 CG LYS A 84 -0.286 12.419 5.074 1.00 10.46 C ATOM 1272 CD LYS A 84 -0.439 13.544 6.081 1.00 11.30 C ATOM 1273 CE LYS A 84 -0.862 14.838 5.406 1.00 11.85 C ATOM 1274 NZ LYS A 84 -1.007 15.947 6.383 1.00 12.21 N ATOM 0 H LYS A 84 1.099 11.321 3.233 1.00 9.30 H new ATOM 0 HA LYS A 84 0.924 9.164 5.254 1.00 9.11 H new ATOM 0 HB2 LYS A 84 -0.587 10.794 6.435 1.00 9.97 H new ATOM 0 HB3 LYS A 84 1.077 11.333 6.318 1.00 9.97 H new ATOM 0 HG2 LYS A 84 0.430 12.713 4.307 1.00 10.46 H new ATOM 0 HG3 LYS A 84 -1.238 12.248 4.572 1.00 10.46 H new ATOM 0 HD2 LYS A 84 -1.178 13.265 6.831 1.00 11.30 H new ATOM 0 HD3 LYS A 84 0.505 13.697 6.605 1.00 11.30 H new ATOM 0 HE2 LYS A 84 -0.125 15.112 4.651 1.00 11.85 H new ATOM 0 HE3 LYS A 84 -1.808 14.685 4.887 1.00 11.85 H new ATOM 0 HZ1 LYS A 84 -1.297 16.813 5.885 1.00 12.21 H new ATOM 0 HZ2 LYS A 84 -1.728 15.696 7.089 1.00 12.21 H new ATOM 0 HZ3 LYS A 84 -0.098 16.110 6.861 1.00 12.21 H new ATOM 1288 N ALA A 85 -0.960 9.718 2.800 1.00 8.58 N ATOM 1289 CA ALA A 85 -2.217 9.447 2.108 1.00 8.36 C ATOM 1290 C ALA A 85 -2.614 7.978 2.209 1.00 7.63 C ATOM 1291 O ALA A 85 -3.799 7.646 2.232 1.00 7.43 O ATOM 1292 CB ALA A 85 -2.116 9.869 0.651 1.00 8.99 C ATOM 0 H ALA A 85 -0.214 10.067 2.198 1.00 8.58 H new ATOM 0 HA ALA A 85 -2.996 10.031 2.597 1.00 8.36 H new ATOM 0 HB1 ALA A 85 -3.059 9.662 0.146 1.00 8.99 H new ATOM 0 HB2 ALA A 85 -1.901 10.936 0.595 1.00 8.99 H new ATOM 0 HB3 ALA A 85 -1.315 9.312 0.166 1.00 8.99 H new ATOM 1298 N ARG A 86 -1.623 7.105 2.289 1.00 7.48 N ATOM 1299 CA ARG A 86 -1.872 5.671 2.321 1.00 7.14 C ATOM 1300 C ARG A 86 -2.392 5.243 3.690 1.00 6.68 C ATOM 1301 O ARG A 86 -3.335 4.455 3.777 1.00 6.49 O ATOM 1302 CB ARG A 86 -0.587 4.915 1.952 1.00 7.54 C ATOM 1303 CG ARG A 86 -0.805 3.486 1.474 1.00 7.94 C ATOM 1304 CD ARG A 86 -1.065 2.523 2.617 1.00 8.47 C ATOM 1305 NE ARG A 86 -1.420 1.194 2.126 1.00 9.09 N ATOM 1306 CZ ARG A 86 -2.313 0.401 2.711 1.00 9.85 C ATOM 1307 NH1 ARG A 86 -2.893 0.775 3.841 1.00 10.10 N ATOM 1308 NH2 ARG A 86 -2.609 -0.774 2.168 1.00 10.56 N ATOM 0 H ARG A 86 -0.637 7.364 2.333 1.00 7.48 H new ATOM 0 HA ARG A 86 -2.641 5.426 1.589 1.00 7.14 H new ATOM 0 HB2 ARG A 86 -0.067 5.470 1.171 1.00 7.54 H new ATOM 0 HB3 ARG A 86 0.070 4.897 2.821 1.00 7.54 H new ATOM 0 HG2 ARG A 86 -1.649 3.462 0.784 1.00 7.94 H new ATOM 0 HG3 ARG A 86 0.072 3.155 0.917 1.00 7.94 H new ATOM 0 HD2 ARG A 86 -0.177 2.455 3.246 1.00 8.47 H new ATOM 0 HD3 ARG A 86 -1.870 2.908 3.243 1.00 8.47 H new ATOM 0 HE ARG A 86 -0.955 0.854 1.284 1.00 9.09 H new ATOM 0 HH11 ARG A 86 -2.655 1.672 4.264 1.00 10.10 H new ATOM 0 HH12 ARG A 86 -3.578 0.166 4.289 1.00 10.10 H new ATOM 0 HH21 ARG A 86 -2.152 -1.066 1.304 1.00 10.56 H new ATOM 0 HH22 ARG A 86 -3.294 -1.384 2.615 1.00 10.56 H new ATOM 1322 N VAL A 87 -1.795 5.769 4.753 1.00 6.80 N ATOM 1323 CA VAL A 87 -2.214 5.408 6.101 1.00 6.75 C ATOM 1324 C VAL A 87 -3.522 6.100 6.471 1.00 6.55 C ATOM 1325 O VAL A 87 -4.334 5.554 7.219 1.00 6.49 O ATOM 1326 CB VAL A 87 -1.133 5.731 7.157 1.00 7.42 C ATOM 1327 CG1 VAL A 87 0.136 4.953 6.860 1.00 7.80 C ATOM 1328 CG2 VAL A 87 -0.838 7.223 7.225 1.00 7.90 C ATOM 0 H VAL A 87 -1.028 6.440 4.709 1.00 6.80 H new ATOM 0 HA VAL A 87 -2.368 4.329 6.100 1.00 6.75 H new ATOM 0 HB VAL A 87 -1.519 5.429 8.131 1.00 7.42 H new ATOM 0 HG11 VAL A 87 0.891 5.188 7.610 1.00 7.80 H new ATOM 0 HG12 VAL A 87 -0.078 3.885 6.883 1.00 7.80 H new ATOM 0 HG13 VAL A 87 0.508 5.227 5.873 1.00 7.80 H new ATOM 0 HG21 VAL A 87 -0.073 7.409 7.979 1.00 7.90 H new ATOM 0 HG22 VAL A 87 -0.482 7.568 6.254 1.00 7.90 H new ATOM 0 HG23 VAL A 87 -1.747 7.762 7.490 1.00 7.90 H new ATOM 1338 N LEU A 88 -3.733 7.291 5.927 1.00 6.74 N ATOM 1339 CA LEU A 88 -4.960 8.035 6.179 1.00 6.96 C ATOM 1340 C LEU A 88 -6.144 7.354 5.515 1.00 6.75 C ATOM 1341 O LEU A 88 -7.137 7.046 6.170 1.00 6.87 O ATOM 1342 CB LEU A 88 -4.841 9.478 5.685 1.00 7.72 C ATOM 1343 CG LEU A 88 -3.789 10.328 6.400 1.00 8.06 C ATOM 1344 CD1 LEU A 88 -3.809 11.751 5.870 1.00 8.65 C ATOM 1345 CD2 LEU A 88 -4.014 10.311 7.905 1.00 8.66 C ATOM 0 H LEU A 88 -3.072 7.762 5.309 1.00 6.74 H new ATOM 0 HA LEU A 88 -5.122 8.053 7.257 1.00 6.96 H new ATOM 0 HB2 LEU A 88 -4.609 9.462 4.620 1.00 7.72 H new ATOM 0 HB3 LEU A 88 -5.811 9.963 5.793 1.00 7.72 H new ATOM 0 HG LEU A 88 -2.807 9.900 6.200 1.00 8.06 H new ATOM 0 HD11 LEU A 88 -3.055 12.343 6.389 1.00 8.65 H new ATOM 0 HD12 LEU A 88 -3.593 11.744 4.802 1.00 8.65 H new ATOM 0 HD13 LEU A 88 -4.793 12.188 6.039 1.00 8.65 H new ATOM 0 HD21 LEU A 88 -3.255 10.922 8.393 1.00 8.66 H new ATOM 0 HD22 LEU A 88 -5.002 10.712 8.130 1.00 8.66 H new ATOM 0 HD23 LEU A 88 -3.947 9.287 8.271 1.00 8.66 H new ATOM 1357 N ALA A 89 -6.023 7.097 4.218 1.00 6.75 N ATOM 1358 CA ALA A 89 -7.075 6.412 3.473 1.00 6.99 C ATOM 1359 C ALA A 89 -7.351 5.042 4.081 1.00 6.71 C ATOM 1360 O ALA A 89 -8.475 4.534 4.026 1.00 7.11 O ATOM 1361 CB ALA A 89 -6.693 6.274 2.007 1.00 7.41 C ATOM 0 H ALA A 89 -5.208 7.352 3.660 1.00 6.75 H new ATOM 0 HA ALA A 89 -7.984 7.010 3.536 1.00 6.99 H new ATOM 0 HB1 ALA A 89 -7.491 5.761 1.470 1.00 7.41 H new ATOM 0 HB2 ALA A 89 -6.543 7.264 1.575 1.00 7.41 H new ATOM 0 HB3 ALA A 89 -5.771 5.699 1.924 1.00 7.41 H new ATOM 1367 N GLU A 90 -6.314 4.454 4.666 1.00 6.35 N ATOM 1368 CA GLU A 90 -6.434 3.174 5.344 1.00 6.46 C ATOM 1369 C GLU A 90 -7.327 3.285 6.577 1.00 6.45 C ATOM 1370 O GLU A 90 -8.319 2.564 6.706 1.00 6.84 O ATOM 1371 CB GLU A 90 -5.047 2.671 5.753 1.00 6.55 C ATOM 1372 CG GLU A 90 -5.067 1.410 6.598 1.00 7.09 C ATOM 1373 CD GLU A 90 -5.475 0.180 5.815 1.00 7.80 C ATOM 1374 OE1 GLU A 90 -4.578 -0.552 5.349 1.00 8.05 O ATOM 1375 OE2 GLU A 90 -6.686 -0.065 5.668 1.00 8.34 O ATOM 0 H GLU A 90 -5.374 4.850 4.683 1.00 6.35 H new ATOM 0 HA GLU A 90 -6.892 2.465 4.654 1.00 6.46 H new ATOM 0 HB2 GLU A 90 -4.461 2.483 4.853 1.00 6.55 H new ATOM 0 HB3 GLU A 90 -4.536 3.458 6.307 1.00 6.55 H new ATOM 0 HG2 GLU A 90 -4.077 1.250 7.026 1.00 7.09 H new ATOM 0 HG3 GLU A 90 -5.756 1.549 7.431 1.00 7.09 H new ATOM 1382 N ALA A 91 -6.995 4.218 7.458 1.00 6.32 N ATOM 1383 CA ALA A 91 -7.647 4.304 8.754 1.00 6.63 C ATOM 1384 C ALA A 91 -9.007 4.958 8.633 1.00 6.98 C ATOM 1385 O ALA A 91 -9.963 4.554 9.292 1.00 7.39 O ATOM 1386 CB ALA A 91 -6.775 5.071 9.735 1.00 6.88 C ATOM 0 H ALA A 91 -6.278 4.925 7.298 1.00 6.32 H new ATOM 0 HA ALA A 91 -7.790 3.291 9.131 1.00 6.63 H new ATOM 0 HB1 ALA A 91 -7.277 5.127 10.701 1.00 6.88 H new ATOM 0 HB2 ALA A 91 -5.820 4.558 9.851 1.00 6.88 H new ATOM 0 HB3 ALA A 91 -6.602 6.079 9.357 1.00 6.88 H new ATOM 1392 N MET A 92 -9.093 5.942 7.755 1.00 7.07 N ATOM 1393 CA MET A 92 -10.308 6.744 7.616 1.00 7.77 C ATOM 1394 C MET A 92 -11.494 5.880 7.198 1.00 8.07 C ATOM 1395 O MET A 92 -12.623 6.112 7.627 1.00 8.75 O ATOM 1396 CB MET A 92 -10.101 7.871 6.600 1.00 8.13 C ATOM 1397 CG MET A 92 -11.314 8.780 6.439 1.00 8.95 C ATOM 1398 SD MET A 92 -11.055 10.093 5.227 1.00 9.67 S ATOM 1399 CE MET A 92 -10.770 9.134 3.740 1.00 10.32 C ATOM 0 H MET A 92 -8.337 6.209 7.124 1.00 7.07 H new ATOM 0 HA MET A 92 -10.526 7.182 8.590 1.00 7.77 H new ATOM 0 HB2 MET A 92 -9.245 8.472 6.907 1.00 8.13 H new ATOM 0 HB3 MET A 92 -9.854 7.435 5.632 1.00 8.13 H new ATOM 0 HG2 MET A 92 -12.173 8.180 6.139 1.00 8.95 H new ATOM 0 HG3 MET A 92 -11.558 9.226 7.403 1.00 8.95 H new ATOM 0 HE1 MET A 92 -11.254 9.622 2.894 1.00 10.32 H new ATOM 0 HE2 MET A 92 -9.699 9.062 3.553 1.00 10.32 H new ATOM 0 HE3 MET A 92 -11.184 8.134 3.867 1.00 10.32 H new ATOM 1409 N SER A 93 -11.226 4.878 6.375 1.00 7.80 N ATOM 1410 CA SER A 93 -12.273 3.999 5.883 1.00 8.38 C ATOM 1411 C SER A 93 -12.576 2.889 6.891 1.00 8.44 C ATOM 1412 O SER A 93 -13.666 2.314 6.893 1.00 9.14 O ATOM 1413 CB SER A 93 -11.851 3.396 4.542 1.00 8.44 C ATOM 1414 OG SER A 93 -11.453 4.409 3.631 1.00 8.68 O ATOM 0 H SER A 93 -10.291 4.654 6.034 1.00 7.80 H new ATOM 0 HA SER A 93 -13.182 4.585 5.745 1.00 8.38 H new ATOM 0 HB2 SER A 93 -11.029 2.697 4.696 1.00 8.44 H new ATOM 0 HB3 SER A 93 -12.678 2.826 4.119 1.00 8.44 H new ATOM 0 HG SER A 93 -10.480 4.521 3.671 1.00 8.68 H new ATOM 1420 N GLN A 94 -11.603 2.601 7.751 1.00 7.90 N ATOM 1421 CA GLN A 94 -11.725 1.510 8.711 1.00 8.16 C ATOM 1422 C GLN A 94 -12.430 1.959 9.986 1.00 8.55 C ATOM 1423 O GLN A 94 -13.327 1.276 10.475 1.00 9.08 O ATOM 1424 CB GLN A 94 -10.342 0.951 9.052 1.00 7.85 C ATOM 1425 CG GLN A 94 -10.380 -0.235 10.002 1.00 8.03 C ATOM 1426 CD GLN A 94 -8.995 -0.722 10.377 1.00 8.38 C ATOM 1427 OE1 GLN A 94 -8.048 -0.613 9.599 1.00 8.64 O ATOM 1428 NE2 GLN A 94 -8.864 -1.254 11.581 1.00 8.68 N ATOM 0 H GLN A 94 -10.720 3.109 7.802 1.00 7.90 H new ATOM 0 HA GLN A 94 -12.330 0.730 8.249 1.00 8.16 H new ATOM 0 HB2 GLN A 94 -9.844 0.651 8.130 1.00 7.85 H new ATOM 0 HB3 GLN A 94 -9.739 1.743 9.497 1.00 7.85 H new ATOM 0 HG2 GLN A 94 -10.920 0.045 10.906 1.00 8.03 H new ATOM 0 HG3 GLN A 94 -10.935 -1.050 9.538 1.00 8.03 H new ATOM 0 HE21 GLN A 94 -9.674 -1.327 12.197 1.00 8.68 H new ATOM 0 HE22 GLN A 94 -7.953 -1.591 11.893 1.00 8.68 H new ATOM 1437 N VAL A 95 -12.025 3.112 10.515 1.00 8.52 N ATOM 1438 CA VAL A 95 -12.567 3.618 11.777 1.00 9.16 C ATOM 1439 C VAL A 95 -14.072 3.870 11.672 1.00 9.86 C ATOM 1440 O VAL A 95 -14.777 3.885 12.680 1.00 10.49 O ATOM 1441 CB VAL A 95 -11.846 4.917 12.221 1.00 9.36 C ATOM 1442 CG1 VAL A 95 -12.420 5.449 13.529 1.00 9.64 C ATOM 1443 CG2 VAL A 95 -10.351 4.674 12.366 1.00 9.49 C ATOM 0 H VAL A 95 -11.322 3.716 10.089 1.00 8.52 H new ATOM 0 HA VAL A 95 -12.393 2.850 12.531 1.00 9.16 H new ATOM 0 HB VAL A 95 -12.009 5.668 11.448 1.00 9.36 H new ATOM 0 HG11 VAL A 95 -11.894 6.360 13.813 1.00 9.64 H new ATOM 0 HG12 VAL A 95 -13.480 5.668 13.399 1.00 9.64 H new ATOM 0 HG13 VAL A 95 -12.298 4.700 14.311 1.00 9.64 H new ATOM 0 HG21 VAL A 95 -9.861 5.596 12.678 1.00 9.49 H new ATOM 0 HG22 VAL A 95 -10.179 3.900 13.114 1.00 9.49 H new ATOM 0 HG23 VAL A 95 -9.940 4.351 11.409 1.00 9.49 H new ATOM 1453 N THR A 96 -14.558 4.044 10.446 1.00 9.91 N ATOM 1454 CA THR A 96 -15.973 4.289 10.205 1.00 10.78 C ATOM 1455 C THR A 96 -16.838 3.208 10.848 1.00 11.00 C ATOM 1456 O THR A 96 -17.649 3.483 11.735 1.00 11.80 O ATOM 1457 CB THR A 96 -16.273 4.331 8.697 1.00 11.07 C ATOM 1458 OG1 THR A 96 -15.200 4.980 8.003 1.00 10.84 O ATOM 1459 CG2 THR A 96 -17.572 5.073 8.424 1.00 11.70 C ATOM 0 H THR A 96 -13.987 4.019 9.601 1.00 9.91 H new ATOM 0 HA THR A 96 -16.212 5.254 10.652 1.00 10.78 H new ATOM 0 HB THR A 96 -16.373 3.306 8.341 1.00 11.07 H new ATOM 0 HG1 THR A 96 -15.397 5.002 7.043 1.00 10.84 H new ATOM 0 HG21 THR A 96 -17.763 5.090 7.351 1.00 11.70 H new ATOM 0 HG22 THR A 96 -18.394 4.567 8.931 1.00 11.70 H new ATOM 0 HG23 THR A 96 -17.492 6.095 8.794 1.00 11.70 H new ATOM 1467 N ASN A 97 -16.661 1.981 10.391 1.00 10.45 N ATOM 1468 CA ASN A 97 -17.425 0.852 10.897 1.00 10.82 C ATOM 1469 C ASN A 97 -16.559 -0.406 10.924 1.00 10.83 C ATOM 1470 O ASN A 97 -16.791 -1.355 10.174 1.00 10.47 O ATOM 1471 CB ASN A 97 -18.692 0.637 10.051 1.00 10.70 C ATOM 1472 CG ASN A 97 -18.413 0.422 8.570 1.00 11.05 C ATOM 1473 OD1 ASN A 97 -17.421 0.907 8.023 1.00 11.34 O ATOM 1474 ND2 ASN A 97 -19.300 -0.299 7.904 1.00 11.26 N ATOM 0 H ASN A 97 -15.988 1.739 9.663 1.00 10.45 H new ATOM 0 HA ASN A 97 -17.737 1.069 11.919 1.00 10.82 H new ATOM 0 HB2 ASN A 97 -19.234 -0.226 10.438 1.00 10.70 H new ATOM 0 HB3 ASN A 97 -19.346 1.502 10.166 1.00 10.70 H new ATOM 0 HD21 ASN A 97 -19.174 -0.468 6.906 1.00 11.26 H new ATOM 0 HD22 ASN A 97 -20.110 -0.686 8.388 1.00 11.26 H new ATOM 1481 N PRO A 98 -15.567 -0.449 11.825 1.00 11.40 N ATOM 1482 CA PRO A 98 -14.579 -1.529 11.849 1.00 11.59 C ATOM 1483 C PRO A 98 -15.176 -2.857 12.278 1.00 11.38 C ATOM 1484 O PRO A 98 -14.663 -3.922 11.933 1.00 11.57 O ATOM 1485 CB PRO A 98 -13.541 -1.045 12.862 1.00 12.45 C ATOM 1486 CG PRO A 98 -14.281 -0.106 13.752 1.00 12.70 C ATOM 1487 CD PRO A 98 -15.336 0.539 12.896 1.00 12.08 C ATOM 0 HA PRO A 98 -14.164 -1.720 10.859 1.00 11.59 H new ATOM 0 HB2 PRO A 98 -13.123 -1.878 13.427 1.00 12.45 H new ATOM 0 HB3 PRO A 98 -12.708 -0.546 12.366 1.00 12.45 H new ATOM 0 HG2 PRO A 98 -14.731 -0.637 14.590 1.00 12.70 H new ATOM 0 HG3 PRO A 98 -13.610 0.643 14.173 1.00 12.70 H new ATOM 0 HD2 PRO A 98 -16.246 0.736 13.462 1.00 12.08 H new ATOM 0 HD3 PRO A 98 -14.997 1.494 12.494 1.00 12.08 H new ATOM 1495 N ALA A 99 -16.276 -2.795 13.004 1.00 11.13 N ATOM 1496 CA ALA A 99 -16.943 -4.002 13.456 1.00 11.14 C ATOM 1497 C ALA A 99 -17.834 -4.544 12.350 1.00 10.78 C ATOM 1498 O ALA A 99 -18.173 -5.729 12.325 1.00 10.91 O ATOM 1499 CB ALA A 99 -17.747 -3.732 14.716 1.00 11.25 C ATOM 0 H ALA A 99 -16.725 -1.926 13.293 1.00 11.13 H new ATOM 0 HA ALA A 99 -16.190 -4.752 13.697 1.00 11.14 H new ATOM 0 HB1 ALA A 99 -18.239 -4.650 15.038 1.00 11.25 H new ATOM 0 HB2 ALA A 99 -17.081 -3.382 15.505 1.00 11.25 H new ATOM 0 HB3 ALA A 99 -18.499 -2.970 14.511 1.00 11.25 H new ATOM 1505 N THR A 100 -18.193 -3.668 11.425 1.00 10.51 N ATOM 1506 CA THR A 100 -19.046 -4.041 10.313 1.00 10.39 C ATOM 1507 C THR A 100 -18.209 -4.607 9.170 1.00 10.51 C ATOM 1508 O THR A 100 -18.580 -5.602 8.546 1.00 10.58 O ATOM 1509 CB THR A 100 -19.859 -2.835 9.814 1.00 10.40 C ATOM 1510 OG1 THR A 100 -20.393 -2.117 10.935 1.00 10.60 O ATOM 1511 CG2 THR A 100 -20.998 -3.282 8.911 1.00 10.63 C ATOM 0 H THR A 100 -17.904 -2.690 11.425 1.00 10.51 H new ATOM 0 HA THR A 100 -19.739 -4.806 10.663 1.00 10.39 H new ATOM 0 HB THR A 100 -19.195 -2.188 9.240 1.00 10.40 H new ATOM 0 HG1 THR A 100 -20.987 -1.406 10.615 1.00 10.60 H new ATOM 0 HG21 THR A 100 -21.557 -2.410 8.572 1.00 10.63 H new ATOM 0 HG22 THR A 100 -20.592 -3.811 8.049 1.00 10.63 H new ATOM 0 HG23 THR A 100 -21.662 -3.946 9.464 1.00 10.63 H new ATOM 1519 N ILE A 101 -17.069 -3.970 8.911 1.00 10.71 N ATOM 1520 CA ILE A 101 -16.136 -4.438 7.889 1.00 11.06 C ATOM 1521 C ILE A 101 -15.736 -5.876 8.167 1.00 11.17 C ATOM 1522 O ILE A 101 -15.701 -6.711 7.272 1.00 11.41 O ATOM 1523 CB ILE A 101 -14.862 -3.570 7.850 1.00 11.57 C ATOM 1524 CG1 ILE A 101 -15.231 -2.104 7.661 1.00 11.88 C ATOM 1525 CG2 ILE A 101 -13.930 -4.036 6.737 1.00 11.78 C ATOM 1526 CD1 ILE A 101 -14.036 -1.176 7.575 1.00 12.53 C ATOM 0 H ILE A 101 -16.769 -3.125 9.397 1.00 10.71 H new ATOM 0 HA ILE A 101 -16.642 -4.366 6.926 1.00 11.06 H new ATOM 0 HB ILE A 101 -14.338 -3.677 8.800 1.00 11.57 H new ATOM 0 HG12 ILE A 101 -15.823 -2.003 6.752 1.00 11.88 H new ATOM 0 HG13 ILE A 101 -15.864 -1.789 8.490 1.00 11.88 H new ATOM 0 HG21 ILE A 101 -13.037 -3.412 6.725 1.00 11.78 H new ATOM 0 HG22 ILE A 101 -13.645 -5.074 6.911 1.00 11.78 H new ATOM 0 HG23 ILE A 101 -14.441 -3.956 5.777 1.00 11.78 H new ATOM 0 HD11 ILE A 101 -14.381 -0.151 7.441 1.00 12.53 H new ATOM 0 HD12 ILE A 101 -13.454 -1.246 8.494 1.00 12.53 H new ATOM 0 HD13 ILE A 101 -13.413 -1.463 6.728 1.00 12.53 H new ATOM 1538 N MET A 102 -15.458 -6.143 9.429 1.00 11.16 N ATOM 1539 CA MET A 102 -15.036 -7.467 9.880 1.00 11.48 C ATOM 1540 C MET A 102 -16.042 -8.555 9.495 1.00 11.29 C ATOM 1541 O MET A 102 -15.660 -9.624 9.021 1.00 11.61 O ATOM 1542 CB MET A 102 -14.846 -7.457 11.397 1.00 11.78 C ATOM 1543 CG MET A 102 -14.444 -8.802 11.977 1.00 12.25 C ATOM 1544 SD MET A 102 -14.277 -8.763 13.772 1.00 12.74 S ATOM 1545 CE MET A 102 -12.923 -7.602 13.961 1.00 13.25 C ATOM 0 H MET A 102 -15.517 -5.451 10.176 1.00 11.16 H new ATOM 0 HA MET A 102 -14.093 -7.699 9.384 1.00 11.48 H new ATOM 0 HB2 MET A 102 -14.085 -6.720 11.653 1.00 11.78 H new ATOM 0 HB3 MET A 102 -15.774 -7.133 11.867 1.00 11.78 H new ATOM 0 HG2 MET A 102 -15.188 -9.549 11.701 1.00 12.25 H new ATOM 0 HG3 MET A 102 -13.498 -9.116 11.535 1.00 12.25 H new ATOM 0 HE1 MET A 102 -12.490 -7.706 14.956 1.00 13.25 H new ATOM 0 HE2 MET A 102 -12.160 -7.807 13.210 1.00 13.25 H new ATOM 0 HE3 MET A 102 -13.295 -6.585 13.832 1.00 13.25 H new ATOM 1555 N ILE A 103 -17.327 -8.279 9.681 1.00 10.93 N ATOM 1556 CA ILE A 103 -18.354 -9.301 9.491 1.00 10.95 C ATOM 1557 C ILE A 103 -18.821 -9.383 8.043 1.00 10.91 C ATOM 1558 O ILE A 103 -19.244 -10.442 7.581 1.00 11.12 O ATOM 1559 CB ILE A 103 -19.565 -9.069 10.417 1.00 10.89 C ATOM 1560 CG1 ILE A 103 -20.256 -7.740 10.101 1.00 11.10 C ATOM 1561 CG2 ILE A 103 -19.105 -9.100 11.863 1.00 11.06 C ATOM 1562 CD1 ILE A 103 -21.498 -7.485 10.929 1.00 11.41 C ATOM 0 H ILE A 103 -17.683 -7.365 9.961 1.00 10.93 H new ATOM 0 HA ILE A 103 -17.889 -10.251 9.753 1.00 10.95 H new ATOM 0 HB ILE A 103 -20.292 -9.864 10.251 1.00 10.89 H new ATOM 0 HG12 ILE A 103 -19.549 -6.926 10.263 1.00 11.10 H new ATOM 0 HG13 ILE A 103 -20.525 -7.723 9.045 1.00 11.10 H new ATOM 0 HG21 ILE A 103 -19.959 -8.936 12.520 1.00 11.06 H new ATOM 0 HG22 ILE A 103 -18.659 -10.070 12.082 1.00 11.06 H new ATOM 0 HG23 ILE A 103 -18.366 -8.316 12.027 1.00 11.06 H new ATOM 0 HD11 ILE A 103 -21.932 -6.525 10.648 1.00 11.41 H new ATOM 0 HD12 ILE A 103 -22.224 -8.278 10.749 1.00 11.41 H new ATOM 0 HD13 ILE A 103 -21.233 -7.468 11.986 1.00 11.41 H new ATOM 1574 N GLN A 104 -18.746 -8.273 7.325 1.00 10.83 N ATOM 1575 CA GLN A 104 -19.144 -8.261 5.926 1.00 11.03 C ATOM 1576 C GLN A 104 -17.976 -8.644 5.027 1.00 11.28 C ATOM 1577 O GLN A 104 -18.178 -8.991 3.868 1.00 11.50 O ATOM 1578 CB GLN A 104 -19.691 -6.891 5.513 1.00 11.19 C ATOM 1579 CG GLN A 104 -21.019 -6.530 6.166 1.00 11.48 C ATOM 1580 CD GLN A 104 -21.674 -5.307 5.543 1.00 11.71 C ATOM 1581 OE1 GLN A 104 -22.385 -4.557 6.212 1.00 11.93 O ATOM 1582 NE2 GLN A 104 -21.449 -5.102 4.251 1.00 11.88 N ATOM 0 H GLN A 104 -18.416 -7.377 7.684 1.00 10.83 H new ATOM 0 HA GLN A 104 -19.938 -8.998 5.808 1.00 11.03 H new ATOM 0 HB2 GLN A 104 -18.955 -6.127 5.764 1.00 11.19 H new ATOM 0 HB3 GLN A 104 -19.814 -6.872 4.430 1.00 11.19 H new ATOM 0 HG2 GLN A 104 -21.699 -7.379 6.088 1.00 11.48 H new ATOM 0 HG3 GLN A 104 -20.858 -6.347 7.228 1.00 11.48 H new ATOM 0 HE21 GLN A 104 -20.854 -5.745 3.729 1.00 11.88 H new ATOM 0 HE22 GLN A 104 -21.871 -4.301 3.781 1.00 11.88 H new ATOM 1591 N LYS A 105 -16.768 -8.596 5.590 1.00 11.41 N ATOM 1592 CA LYS A 105 -15.521 -8.785 4.836 1.00 11.86 C ATOM 1593 C LYS A 105 -15.600 -9.943 3.844 1.00 11.85 C ATOM 1594 O LYS A 105 -15.399 -9.750 2.645 1.00 12.20 O ATOM 1595 CB LYS A 105 -14.351 -9.029 5.796 1.00 12.25 C ATOM 1596 CG LYS A 105 -13.020 -9.269 5.093 1.00 12.76 C ATOM 1597 CD LYS A 105 -12.494 -8.009 4.423 1.00 13.39 C ATOM 1598 CE LYS A 105 -11.947 -7.021 5.442 1.00 14.09 C ATOM 1599 NZ LYS A 105 -10.753 -7.556 6.152 1.00 14.37 N ATOM 0 H LYS A 105 -16.623 -8.425 6.585 1.00 11.41 H new ATOM 0 HA LYS A 105 -15.362 -7.869 4.267 1.00 11.86 H new ATOM 0 HB2 LYS A 105 -14.252 -8.170 6.459 1.00 12.25 H new ATOM 0 HB3 LYS A 105 -14.581 -9.890 6.423 1.00 12.25 H new ATOM 0 HG2 LYS A 105 -12.288 -9.628 5.816 1.00 12.76 H new ATOM 0 HG3 LYS A 105 -13.141 -10.053 4.346 1.00 12.76 H new ATOM 0 HD2 LYS A 105 -11.709 -8.273 3.714 1.00 13.39 H new ATOM 0 HD3 LYS A 105 -13.294 -7.538 3.852 1.00 13.39 H new ATOM 0 HE2 LYS A 105 -11.683 -6.090 4.939 1.00 14.09 H new ATOM 0 HE3 LYS A 105 -12.724 -6.782 6.168 1.00 14.09 H new ATOM 0 HZ1 LYS A 105 -10.217 -6.769 6.571 1.00 14.37 H new ATOM 0 HZ2 LYS A 105 -11.059 -8.206 6.904 1.00 14.37 H new ATOM 0 HZ3 LYS A 105 -10.148 -8.067 5.478 1.00 14.37 H new ATOM 1613 N GLY A 106 -15.902 -11.134 4.348 1.00 11.60 N ATOM 1614 CA GLY A 106 -15.901 -12.327 3.519 1.00 11.77 C ATOM 1615 C GLY A 106 -16.786 -12.209 2.292 1.00 11.76 C ATOM 1616 O GLY A 106 -16.405 -12.632 1.204 1.00 12.03 O ATOM 0 H GLY A 106 -16.150 -11.296 5.324 1.00 11.60 H new ATOM 0 HA2 GLY A 106 -14.880 -12.539 3.202 1.00 11.77 H new ATOM 0 HA3 GLY A 106 -16.233 -13.176 4.117 1.00 11.77 H new ATOM 1620 N ASN A 107 -17.967 -11.637 2.463 1.00 11.60 N ATOM 1621 CA ASN A 107 -18.921 -11.517 1.368 1.00 11.78 C ATOM 1622 C ASN A 107 -18.684 -10.252 0.543 1.00 12.07 C ATOM 1623 O ASN A 107 -18.786 -10.269 -0.682 1.00 12.33 O ATOM 1624 CB ASN A 107 -20.358 -11.530 1.901 1.00 11.85 C ATOM 1625 CG ASN A 107 -20.753 -12.866 2.513 1.00 11.96 C ATOM 1626 OD1 ASN A 107 -19.926 -13.577 3.088 1.00 11.97 O ATOM 1627 ND2 ASN A 107 -22.022 -13.220 2.394 1.00 12.28 N ATOM 0 H ASN A 107 -18.290 -11.248 3.349 1.00 11.60 H new ATOM 0 HA ASN A 107 -18.772 -12.377 0.715 1.00 11.78 H new ATOM 0 HB2 ASN A 107 -20.469 -10.746 2.650 1.00 11.85 H new ATOM 0 HB3 ASN A 107 -21.044 -11.292 1.088 1.00 11.85 H new ATOM 0 HD21 ASN A 107 -22.343 -14.106 2.785 1.00 12.28 H new ATOM 0 HD22 ASN A 107 -22.679 -12.607 1.912 1.00 12.28 H new ATOM 1634 N PHE A 108 -18.353 -9.161 1.222 1.00 12.19 N ATOM 1635 CA PHE A 108 -18.261 -7.847 0.588 1.00 12.69 C ATOM 1636 C PHE A 108 -16.970 -7.700 -0.215 1.00 12.92 C ATOM 1637 O PHE A 108 -16.873 -6.848 -1.097 1.00 13.36 O ATOM 1638 CB PHE A 108 -18.357 -6.745 1.648 1.00 13.02 C ATOM 1639 CG PHE A 108 -18.547 -5.368 1.079 1.00 13.41 C ATOM 1640 CD1 PHE A 108 -17.507 -4.452 1.079 1.00 13.60 C ATOM 1641 CD2 PHE A 108 -19.768 -4.993 0.546 1.00 13.76 C ATOM 1642 CE1 PHE A 108 -17.683 -3.187 0.555 1.00 14.16 C ATOM 1643 CE2 PHE A 108 -19.950 -3.729 0.020 1.00 14.30 C ATOM 1644 CZ PHE A 108 -18.907 -2.825 0.025 1.00 14.51 C ATOM 0 H PHE A 108 -18.142 -9.158 2.220 1.00 12.19 H new ATOM 0 HA PHE A 108 -19.095 -7.750 -0.107 1.00 12.69 H new ATOM 0 HB2 PHE A 108 -19.188 -6.969 2.317 1.00 13.02 H new ATOM 0 HB3 PHE A 108 -17.450 -6.756 2.252 1.00 13.02 H new ATOM 0 HD1 PHE A 108 -16.549 -4.731 1.493 1.00 13.60 H new ATOM 0 HD2 PHE A 108 -20.587 -5.696 0.541 1.00 13.76 H new ATOM 0 HE1 PHE A 108 -16.865 -2.481 0.559 1.00 14.16 H new ATOM 0 HE2 PHE A 108 -20.907 -3.448 -0.395 1.00 14.30 H new ATOM 0 HZ PHE A 108 -19.047 -1.836 -0.385 1.00 14.51 H new ATOM 1654 N ARG A 109 -15.982 -8.531 0.095 1.00 12.75 N ATOM 1655 CA ARG A 109 -14.706 -8.507 -0.617 1.00 13.13 C ATOM 1656 C ARG A 109 -14.893 -8.882 -2.086 1.00 13.11 C ATOM 1657 O ARG A 109 -14.011 -8.637 -2.910 1.00 13.55 O ATOM 1658 CB ARG A 109 -13.697 -9.454 0.039 1.00 13.21 C ATOM 1659 CG ARG A 109 -14.075 -10.922 -0.070 1.00 13.63 C ATOM 1660 CD ARG A 109 -13.100 -11.804 0.689 1.00 13.95 C ATOM 1661 NE ARG A 109 -13.431 -13.222 0.560 1.00 14.26 N ATOM 1662 CZ ARG A 109 -12.724 -14.204 1.116 1.00 14.71 C ATOM 1663 NH1 ARG A 109 -11.664 -13.926 1.868 1.00 14.89 N ATOM 1664 NH2 ARG A 109 -13.077 -15.466 0.921 1.00 15.12 N ATOM 0 H ARG A 109 -16.038 -9.231 0.835 1.00 12.75 H new ATOM 0 HA ARG A 109 -14.317 -7.490 -0.564 1.00 13.13 H new ATOM 0 HB2 ARG A 109 -12.720 -9.305 -0.421 1.00 13.21 H new ATOM 0 HB3 ARG A 109 -13.597 -9.191 1.092 1.00 13.21 H new ATOM 0 HG2 ARG A 109 -15.082 -11.070 0.321 1.00 13.63 H new ATOM 0 HG3 ARG A 109 -14.094 -11.217 -1.119 1.00 13.63 H new ATOM 0 HD2 ARG A 109 -12.090 -11.632 0.317 1.00 13.95 H new ATOM 0 HD3 ARG A 109 -13.103 -11.525 1.743 1.00 13.95 H new ATOM 0 HE ARG A 109 -14.253 -13.474 0.011 1.00 14.26 H new ATOM 0 HH11 ARG A 109 -11.388 -12.956 2.022 1.00 14.89 H new ATOM 0 HH12 ARG A 109 -11.126 -14.682 2.291 1.00 14.89 H new ATOM 0 HH21 ARG A 109 -13.890 -15.685 0.345 1.00 15.12 H new ATOM 0 HH22 ARG A 109 -12.536 -16.219 1.347 1.00 15.12 H new ATOM 1678 N ASN A 110 -16.039 -9.492 -2.394 1.00 12.73 N ATOM 1679 CA ASN A 110 -16.364 -9.897 -3.759 1.00 12.86 C ATOM 1680 C ASN A 110 -16.267 -8.714 -4.713 1.00 12.47 C ATOM 1681 O ASN A 110 -17.069 -7.781 -4.638 1.00 12.44 O ATOM 1682 CB ASN A 110 -17.771 -10.502 -3.819 1.00 13.08 C ATOM 1683 CG ASN A 110 -18.173 -10.916 -5.226 1.00 13.55 C ATOM 1684 OD1 ASN A 110 -17.894 -12.034 -5.659 1.00 13.74 O ATOM 1685 ND2 ASN A 110 -18.846 -10.026 -5.942 1.00 13.93 N ATOM 0 H ASN A 110 -16.761 -9.717 -1.709 1.00 12.73 H new ATOM 0 HA ASN A 110 -15.641 -10.652 -4.067 1.00 12.86 H new ATOM 0 HB2 ASN A 110 -17.817 -11.371 -3.162 1.00 13.08 H new ATOM 0 HB3 ASN A 110 -18.490 -9.777 -3.439 1.00 13.08 H new ATOM 0 HD21 ASN A 110 -19.152 -10.258 -6.887 1.00 13.93 H new ATOM 0 HD22 ASN A 110 -19.058 -9.109 -5.548 1.00 13.93 H new ATOM 1692 N GLN A 111 -15.273 -8.772 -5.595 1.00 12.38 N ATOM 1693 CA GLN A 111 -15.009 -7.723 -6.579 1.00 12.20 C ATOM 1694 C GLN A 111 -14.458 -6.464 -5.903 1.00 11.61 C ATOM 1695 O GLN A 111 -13.256 -6.202 -5.964 1.00 11.50 O ATOM 1696 CB GLN A 111 -16.270 -7.390 -7.390 1.00 12.57 C ATOM 1697 CG GLN A 111 -15.997 -6.592 -8.655 1.00 13.05 C ATOM 1698 CD GLN A 111 -17.269 -6.155 -9.353 1.00 13.63 C ATOM 1699 OE1 GLN A 111 -17.792 -5.069 -9.100 1.00 13.90 O ATOM 1700 NE2 GLN A 111 -17.781 -7.000 -10.231 1.00 14.01 N ATOM 0 H GLN A 111 -14.621 -9.555 -5.648 1.00 12.38 H new ATOM 0 HA GLN A 111 -14.254 -8.101 -7.268 1.00 12.20 H new ATOM 0 HB2 GLN A 111 -16.772 -8.319 -7.660 1.00 12.57 H new ATOM 0 HB3 GLN A 111 -16.958 -6.827 -6.759 1.00 12.57 H new ATOM 0 HG2 GLN A 111 -15.404 -5.713 -8.405 1.00 13.05 H new ATOM 0 HG3 GLN A 111 -15.400 -7.195 -9.339 1.00 13.05 H new ATOM 0 HE21 GLN A 111 -17.317 -7.890 -10.412 1.00 14.01 H new ATOM 0 HE22 GLN A 111 -18.640 -6.762 -10.727 1.00 14.01 H new ATOM 1709 N ARG A 112 -15.335 -5.706 -5.242 1.00 11.45 N ATOM 1710 CA ARG A 112 -14.972 -4.434 -4.610 1.00 11.12 C ATOM 1711 C ARG A 112 -16.222 -3.771 -4.039 1.00 10.61 C ATOM 1712 O ARG A 112 -17.304 -4.353 -4.078 1.00 10.60 O ATOM 1713 CB ARG A 112 -14.285 -3.502 -5.617 1.00 11.41 C ATOM 1714 CG ARG A 112 -15.052 -3.342 -6.915 1.00 11.96 C ATOM 1715 CD ARG A 112 -14.148 -2.888 -8.044 1.00 12.50 C ATOM 1716 NE ARG A 112 -14.794 -3.028 -9.348 1.00 13.09 N ATOM 1717 CZ ARG A 112 -14.133 -3.261 -10.482 1.00 13.79 C ATOM 1718 NH1 ARG A 112 -12.807 -3.341 -10.478 1.00 14.01 N ATOM 1719 NH2 ARG A 112 -14.798 -3.411 -11.619 1.00 14.43 N ATOM 0 H ARG A 112 -16.317 -5.956 -5.129 1.00 11.45 H new ATOM 0 HA ARG A 112 -14.269 -4.632 -3.801 1.00 11.12 H new ATOM 0 HB2 ARG A 112 -14.152 -2.521 -5.160 1.00 11.41 H new ATOM 0 HB3 ARG A 112 -13.290 -3.889 -5.838 1.00 11.41 H new ATOM 0 HG2 ARG A 112 -15.520 -4.290 -7.181 1.00 11.96 H new ATOM 0 HG3 ARG A 112 -15.855 -2.618 -6.777 1.00 11.96 H new ATOM 0 HD2 ARG A 112 -13.867 -1.847 -7.888 1.00 12.50 H new ATOM 0 HD3 ARG A 112 -13.228 -3.472 -8.030 1.00 12.50 H new ATOM 0 HE ARG A 112 -15.809 -2.942 -9.393 1.00 13.09 H new ATOM 0 HH11 ARG A 112 -12.292 -3.224 -9.606 1.00 14.01 H new ATOM 0 HH12 ARG A 112 -12.304 -3.519 -11.347 1.00 14.01 H new ATOM 0 HH21 ARG A 112 -15.816 -3.348 -11.627 1.00 14.43 H new ATOM 0 HH22 ARG A 112 -14.292 -3.589 -12.486 1.00 14.43 H new ATOM 1733 N LYS A 113 -16.084 -2.543 -3.538 1.00 10.40 N ATOM 1734 CA LYS A 113 -17.193 -1.858 -2.870 1.00 10.14 C ATOM 1735 C LYS A 113 -18.250 -1.352 -3.858 1.00 9.74 C ATOM 1736 O LYS A 113 -19.095 -0.528 -3.508 1.00 9.59 O ATOM 1737 CB LYS A 113 -16.695 -0.700 -1.988 1.00 10.36 C ATOM 1738 CG LYS A 113 -16.125 0.506 -2.735 1.00 10.98 C ATOM 1739 CD LYS A 113 -14.716 0.258 -3.250 1.00 11.43 C ATOM 1740 CE LYS A 113 -14.057 1.554 -3.699 1.00 11.95 C ATOM 1741 NZ LYS A 113 -13.864 2.505 -2.571 1.00 12.41 N ATOM 0 H LYS A 113 -15.219 -2.003 -3.581 1.00 10.40 H new ATOM 0 HA LYS A 113 -17.667 -2.603 -2.231 1.00 10.14 H new ATOM 0 HB2 LYS A 113 -17.523 -0.360 -1.365 1.00 10.36 H new ATOM 0 HB3 LYS A 113 -15.927 -1.084 -1.316 1.00 10.36 H new ATOM 0 HG2 LYS A 113 -16.777 0.752 -3.573 1.00 10.98 H new ATOM 0 HG3 LYS A 113 -16.119 1.371 -2.072 1.00 10.98 H new ATOM 0 HD2 LYS A 113 -14.116 -0.205 -2.467 1.00 11.43 H new ATOM 0 HD3 LYS A 113 -14.749 -0.444 -4.083 1.00 11.43 H new ATOM 0 HE2 LYS A 113 -13.092 1.331 -4.153 1.00 11.95 H new ATOM 0 HE3 LYS A 113 -14.670 2.024 -4.468 1.00 11.95 H new ATOM 0 HZ1 LYS A 113 -13.111 3.181 -2.812 1.00 12.41 H new ATOM 0 HZ2 LYS A 113 -14.750 3.021 -2.397 1.00 12.41 H new ATOM 0 HZ3 LYS A 113 -13.596 1.979 -1.715 1.00 12.41 H new ATOM 1755 N THR A 114 -18.202 -1.843 -5.085 1.00 9.83 N ATOM 1756 CA THR A 114 -19.229 -1.549 -6.066 1.00 9.78 C ATOM 1757 C THR A 114 -20.390 -2.528 -5.926 1.00 9.62 C ATOM 1758 O THR A 114 -21.484 -2.297 -6.443 1.00 9.64 O ATOM 1759 CB THR A 114 -18.667 -1.618 -7.495 1.00 10.31 C ATOM 1760 OG1 THR A 114 -17.863 -2.792 -7.633 1.00 10.49 O ATOM 1761 CG2 THR A 114 -17.833 -0.387 -7.812 1.00 10.80 C ATOM 0 H THR A 114 -17.457 -2.451 -5.425 1.00 9.83 H new ATOM 0 HA THR A 114 -19.585 -0.535 -5.882 1.00 9.78 H new ATOM 0 HB THR A 114 -19.502 -1.655 -8.195 1.00 10.31 H new ATOM 0 HG1 THR A 114 -18.245 -3.371 -8.326 1.00 10.49 H new ATOM 0 HG21 THR A 114 -17.447 -0.461 -8.829 1.00 10.80 H new ATOM 0 HG22 THR A 114 -18.453 0.505 -7.723 1.00 10.80 H new ATOM 0 HG23 THR A 114 -17.000 -0.322 -7.112 1.00 10.80 H new ATOM 1769 N VAL A 115 -20.145 -3.617 -5.202 1.00 9.74 N ATOM 1770 CA VAL A 115 -21.142 -4.665 -5.021 1.00 9.92 C ATOM 1771 C VAL A 115 -22.118 -4.300 -3.896 1.00 9.30 C ATOM 1772 O VAL A 115 -23.018 -5.068 -3.560 1.00 9.52 O ATOM 1773 CB VAL A 115 -20.465 -6.029 -4.720 1.00 10.85 C ATOM 1774 CG1 VAL A 115 -19.893 -6.060 -3.309 1.00 11.22 C ATOM 1775 CG2 VAL A 115 -21.429 -7.187 -4.944 1.00 11.44 C ATOM 0 H VAL A 115 -19.259 -3.796 -4.729 1.00 9.74 H new ATOM 0 HA VAL A 115 -21.702 -4.756 -5.952 1.00 9.92 H new ATOM 0 HB VAL A 115 -19.637 -6.146 -5.419 1.00 10.85 H new ATOM 0 HG11 VAL A 115 -19.425 -7.028 -3.127 1.00 11.22 H new ATOM 0 HG12 VAL A 115 -19.149 -5.271 -3.201 1.00 11.22 H new ATOM 0 HG13 VAL A 115 -20.695 -5.903 -2.588 1.00 11.22 H new ATOM 0 HG21 VAL A 115 -20.925 -8.128 -4.725 1.00 11.44 H new ATOM 0 HG22 VAL A 115 -22.291 -7.075 -4.286 1.00 11.44 H new ATOM 0 HG23 VAL A 115 -21.762 -7.187 -5.982 1.00 11.44 H new ATOM 1785 N LYS A 116 -21.942 -3.114 -3.326 1.00 8.75 N ATOM 1786 CA LYS A 116 -22.801 -2.656 -2.243 1.00 8.35 C ATOM 1787 C LYS A 116 -24.245 -2.511 -2.716 1.00 7.64 C ATOM 1788 O LYS A 116 -24.517 -1.909 -3.756 1.00 7.40 O ATOM 1789 CB LYS A 116 -22.292 -1.331 -1.662 1.00 8.50 C ATOM 1790 CG LYS A 116 -22.166 -0.202 -2.671 1.00 9.04 C ATOM 1791 CD LYS A 116 -21.773 1.097 -1.989 1.00 9.56 C ATOM 1792 CE LYS A 116 -21.595 2.229 -2.987 1.00 10.24 C ATOM 1793 NZ LYS A 116 -20.502 1.947 -3.953 1.00 10.72 N ATOM 0 H LYS A 116 -21.213 -2.453 -3.596 1.00 8.75 H new ATOM 0 HA LYS A 116 -22.773 -3.409 -1.455 1.00 8.35 H new ATOM 0 HB2 LYS A 116 -22.967 -1.016 -0.867 1.00 8.50 H new ATOM 0 HB3 LYS A 116 -21.318 -1.501 -1.204 1.00 8.50 H new ATOM 0 HG2 LYS A 116 -21.420 -0.462 -3.422 1.00 9.04 H new ATOM 0 HG3 LYS A 116 -23.113 -0.070 -3.194 1.00 9.04 H new ATOM 0 HD2 LYS A 116 -22.537 1.371 -1.262 1.00 9.56 H new ATOM 0 HD3 LYS A 116 -20.845 0.951 -1.436 1.00 9.56 H new ATOM 0 HE2 LYS A 116 -22.528 2.385 -3.529 1.00 10.24 H new ATOM 0 HE3 LYS A 116 -21.378 3.154 -2.453 1.00 10.24 H new ATOM 0 HZ1 LYS A 116 -19.841 2.750 -3.974 1.00 10.72 H new ATOM 0 HZ2 LYS A 116 -19.994 1.088 -3.661 1.00 10.72 H new ATOM 0 HZ3 LYS A 116 -20.905 1.805 -4.901 1.00 10.72 H new ATOM 1807 N CYS A 117 -25.161 -3.105 -1.964 1.00 7.61 N ATOM 1808 CA CYS A 117 -26.581 -3.016 -2.263 1.00 7.28 C ATOM 1809 C CYS A 117 -27.068 -1.599 -2.009 1.00 6.81 C ATOM 1810 O CYS A 117 -27.337 -1.230 -0.863 1.00 6.94 O ATOM 1811 CB CYS A 117 -27.369 -3.983 -1.375 1.00 7.77 C ATOM 1812 SG CYS A 117 -28.945 -4.559 -2.076 1.00 8.16 S ATOM 0 H CYS A 117 -24.942 -3.658 -1.135 1.00 7.61 H new ATOM 0 HA CYS A 117 -26.737 -3.279 -3.309 1.00 7.28 H new ATOM 0 HB2 CYS A 117 -26.744 -4.851 -1.164 1.00 7.77 H new ATOM 0 HB3 CYS A 117 -27.570 -3.495 -0.421 1.00 7.77 H new ATOM 1817 N PHE A 118 -27.186 -0.809 -3.068 1.00 6.60 N ATOM 1818 CA PHE A 118 -27.705 0.544 -2.941 1.00 6.49 C ATOM 1819 C PHE A 118 -29.220 0.510 -2.759 1.00 6.66 C ATOM 1820 O PHE A 118 -29.987 0.944 -3.617 1.00 6.96 O ATOM 1821 CB PHE A 118 -27.282 1.429 -4.128 1.00 6.75 C ATOM 1822 CG PHE A 118 -27.447 0.807 -5.492 1.00 6.84 C ATOM 1823 CD1 PHE A 118 -28.522 1.144 -6.300 1.00 7.09 C ATOM 1824 CD2 PHE A 118 -26.512 -0.098 -5.973 1.00 7.05 C ATOM 1825 CE1 PHE A 118 -28.664 0.586 -7.556 1.00 7.55 C ATOM 1826 CE2 PHE A 118 -26.651 -0.660 -7.227 1.00 7.50 C ATOM 1827 CZ PHE A 118 -27.728 -0.317 -8.021 1.00 7.76 C ATOM 0 H PHE A 118 -26.931 -1.080 -4.018 1.00 6.60 H new ATOM 0 HA PHE A 118 -27.270 0.999 -2.051 1.00 6.49 H new ATOM 0 HB2 PHE A 118 -27.862 2.351 -4.096 1.00 6.75 H new ATOM 0 HB3 PHE A 118 -26.236 1.705 -3.998 1.00 6.75 H new ATOM 0 HD1 PHE A 118 -29.257 1.851 -5.944 1.00 7.09 H new ATOM 0 HD2 PHE A 118 -25.665 -0.366 -5.359 1.00 7.05 H new ATOM 0 HE1 PHE A 118 -29.507 0.856 -8.174 1.00 7.55 H new ATOM 0 HE2 PHE A 118 -25.918 -1.367 -7.586 1.00 7.50 H new ATOM 0 HZ PHE A 118 -27.838 -0.754 -9.003 1.00 7.76 H new ATOM 1837 N ASN A 119 -29.618 -0.047 -1.624 1.00 6.83 N ATOM 1838 CA ASN A 119 -31.012 -0.120 -1.213 1.00 7.37 C ATOM 1839 C ASN A 119 -31.098 -0.722 0.185 1.00 7.84 C ATOM 1840 O ASN A 119 -31.902 -0.289 1.006 1.00 8.35 O ATOM 1841 CB ASN A 119 -31.855 -0.940 -2.191 1.00 7.76 C ATOM 1842 CG ASN A 119 -33.337 -0.770 -1.927 1.00 8.38 C ATOM 1843 OD1 ASN A 119 -33.947 0.193 -2.386 1.00 8.64 O ATOM 1844 ND2 ASN A 119 -33.932 -1.705 -1.200 1.00 8.90 N ATOM 0 H ASN A 119 -28.973 -0.466 -0.954 1.00 6.83 H new ATOM 0 HA ASN A 119 -31.415 0.893 -1.207 1.00 7.37 H new ATOM 0 HB2 ASN A 119 -31.629 -0.634 -3.212 1.00 7.76 H new ATOM 0 HB3 ASN A 119 -31.588 -1.994 -2.108 1.00 7.76 H new ATOM 0 HD21 ASN A 119 -34.931 -1.640 -1.004 1.00 8.90 H new ATOM 0 HD22 ASN A 119 -33.391 -2.490 -0.836 1.00 8.90 H new ATOM 1851 N CYS A 120 -30.262 -1.726 0.455 1.00 7.96 N ATOM 1852 CA CYS A 120 -30.147 -2.263 1.807 1.00 8.71 C ATOM 1853 C CYS A 120 -29.130 -1.453 2.600 1.00 8.75 C ATOM 1854 O CYS A 120 -29.175 -1.408 3.831 1.00 9.54 O ATOM 1855 CB CYS A 120 -29.713 -3.732 1.795 1.00 9.25 C ATOM 1856 SG CYS A 120 -30.904 -4.882 1.078 1.00 9.45 S ATOM 0 H CYS A 120 -29.663 -2.177 -0.236 1.00 7.96 H new ATOM 0 HA CYS A 120 -31.130 -2.196 2.273 1.00 8.71 H new ATOM 0 HB2 CYS A 120 -28.777 -3.813 1.242 1.00 9.25 H new ATOM 0 HB3 CYS A 120 -29.506 -4.041 2.820 1.00 9.25 H new ATOM 1861 N GLY A 121 -28.221 -0.802 1.883 1.00 8.15 N ATOM 1862 CA GLY A 121 -27.230 0.026 2.524 1.00 8.48 C ATOM 1863 C GLY A 121 -25.838 -0.179 1.962 1.00 8.66 C ATOM 1864 O GLY A 121 -25.256 0.748 1.400 1.00 9.05 O ATOM 0 H GLY A 121 -28.157 -0.837 0.866 1.00 8.15 H new ATOM 0 HA2 GLY A 121 -27.511 1.073 2.412 1.00 8.48 H new ATOM 0 HA3 GLY A 121 -27.220 -0.189 3.593 1.00 8.48 H new ATOM 1868 N LYS A 122 -25.313 -1.399 2.079 1.00 8.64 N ATOM 1869 CA LYS A 122 -23.915 -1.661 1.725 1.00 9.14 C ATOM 1870 C LYS A 122 -23.581 -3.148 1.809 1.00 9.38 C ATOM 1871 O LYS A 122 -22.441 -3.526 2.085 1.00 9.60 O ATOM 1872 CB LYS A 122 -22.977 -0.881 2.652 1.00 10.04 C ATOM 1873 CG LYS A 122 -23.177 -1.210 4.122 1.00 10.62 C ATOM 1874 CD LYS A 122 -22.212 -0.446 5.007 1.00 11.49 C ATOM 1875 CE LYS A 122 -22.492 -0.706 6.475 1.00 12.13 C ATOM 1876 NZ LYS A 122 -23.873 -0.309 6.854 1.00 12.70 N ATOM 0 H LYS A 122 -25.827 -2.215 2.412 1.00 8.64 H new ATOM 0 HA LYS A 122 -23.775 -1.334 0.695 1.00 9.14 H new ATOM 0 HB2 LYS A 122 -21.944 -1.094 2.376 1.00 10.04 H new ATOM 0 HB3 LYS A 122 -23.133 0.187 2.501 1.00 10.04 H new ATOM 0 HG2 LYS A 122 -24.201 -0.973 4.411 1.00 10.62 H new ATOM 0 HG3 LYS A 122 -23.042 -2.281 4.276 1.00 10.62 H new ATOM 0 HD2 LYS A 122 -21.189 -0.739 4.772 1.00 11.49 H new ATOM 0 HD3 LYS A 122 -22.293 0.621 4.802 1.00 11.49 H new ATOM 0 HE2 LYS A 122 -22.346 -1.765 6.691 1.00 12.13 H new ATOM 0 HE3 LYS A 122 -21.776 -0.155 7.084 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 -23.853 0.189 7.767 1.00 12.70 H new ATOM 0 HZ2 LYS A 122 -24.266 0.321 6.125 1.00 12.70 H new ATOM 0 HZ3 LYS A 122 -24.468 -1.158 6.935 1.00 12.70 H new ATOM 1890 N GLU A 123 -24.571 -3.985 1.577 1.00 9.61 N ATOM 1891 CA GLU A 123 -24.394 -5.422 1.663 1.00 10.15 C ATOM 1892 C GLU A 123 -23.947 -5.961 0.315 1.00 10.16 C ATOM 1893 O GLU A 123 -24.084 -5.281 -0.701 1.00 9.77 O ATOM 1894 CB GLU A 123 -25.705 -6.090 2.092 1.00 10.72 C ATOM 1895 CG GLU A 123 -26.171 -5.737 3.505 1.00 11.36 C ATOM 1896 CD GLU A 123 -26.523 -4.270 3.684 1.00 12.15 C ATOM 1897 OE1 GLU A 123 -26.391 -3.758 4.816 1.00 12.53 O ATOM 1898 OE2 GLU A 123 -26.920 -3.619 2.695 1.00 12.54 O ATOM 0 H GLU A 123 -25.515 -3.692 1.325 1.00 9.61 H new ATOM 0 HA GLU A 123 -23.631 -5.646 2.408 1.00 10.15 H new ATOM 0 HB2 GLU A 123 -26.487 -5.811 1.386 1.00 10.72 H new ATOM 0 HB3 GLU A 123 -25.585 -7.171 2.023 1.00 10.72 H new ATOM 0 HG2 GLU A 123 -27.042 -6.343 3.753 1.00 11.36 H new ATOM 0 HG3 GLU A 123 -25.386 -6.002 4.214 1.00 11.36 H new ATOM 1905 N GLY A 124 -23.431 -7.183 0.304 1.00 10.81 N ATOM 1906 CA GLY A 124 -22.905 -7.766 -0.921 1.00 11.18 C ATOM 1907 C GLY A 124 -23.996 -8.318 -1.817 1.00 11.06 C ATOM 1908 O GLY A 124 -23.898 -9.443 -2.310 1.00 11.83 O ATOM 0 H GLY A 124 -23.366 -7.786 1.124 1.00 10.81 H new ATOM 0 HA2 GLY A 124 -22.340 -7.010 -1.466 1.00 11.18 H new ATOM 0 HA3 GLY A 124 -22.208 -8.565 -0.669 1.00 11.18 H new ATOM 1912 N HIS A 125 -25.032 -7.524 -2.026 1.00 10.27 N ATOM 1913 CA HIS A 125 -26.161 -7.927 -2.850 1.00 10.32 C ATOM 1914 C HIS A 125 -26.110 -7.210 -4.196 1.00 9.72 C ATOM 1915 O HIS A 125 -25.077 -6.682 -4.601 1.00 9.32 O ATOM 1916 CB HIS A 125 -27.493 -7.552 -2.185 1.00 10.21 C ATOM 1917 CG HIS A 125 -27.694 -7.998 -0.767 1.00 10.68 C ATOM 1918 ND1 HIS A 125 -28.405 -7.211 0.100 1.00 10.37 N ATOM 1919 CD2 HIS A 125 -27.370 -9.158 -0.148 1.00 11.65 C ATOM 1920 CE1 HIS A 125 -28.520 -7.898 1.219 1.00 11.18 C ATOM 1921 NE2 HIS A 125 -27.902 -9.088 1.119 1.00 11.94 N ATOM 0 H HIS A 125 -25.115 -6.587 -1.632 1.00 10.27 H new ATOM 0 HA HIS A 125 -26.098 -9.008 -2.978 1.00 10.32 H new ATOM 0 HB2 HIS A 125 -27.594 -6.467 -2.217 1.00 10.21 H new ATOM 0 HB3 HIS A 125 -28.301 -7.965 -2.788 1.00 10.21 H new ATOM 0 HD2 HIS A 125 -26.805 -9.978 -0.567 1.00 11.65 H new ATOM 0 HE1 HIS A 125 -29.041 -7.551 2.099 1.00 11.18 H new ATOM 0 HE2 HIS A 125 -27.839 -9.803 1.844 1.00 11.94 H new ATOM 1929 N ILE A 126 -27.247 -7.203 -4.876 1.00 9.89 N ATOM 1930 CA ILE A 126 -27.454 -6.401 -6.068 1.00 9.58 C ATOM 1931 C ILE A 126 -28.838 -5.786 -5.982 1.00 9.30 C ATOM 1932 O ILE A 126 -29.838 -6.500 -5.977 1.00 9.89 O ATOM 1933 CB ILE A 126 -27.320 -7.189 -7.405 1.00 10.51 C ATOM 1934 CG1 ILE A 126 -28.251 -8.417 -7.468 1.00 11.44 C ATOM 1935 CG2 ILE A 126 -25.878 -7.592 -7.650 1.00 10.87 C ATOM 1936 CD1 ILE A 126 -27.833 -9.583 -6.598 1.00 12.22 C ATOM 0 H ILE A 126 -28.059 -7.761 -4.611 1.00 9.89 H new ATOM 0 HA ILE A 126 -26.666 -5.648 -6.091 1.00 9.58 H new ATOM 0 HB ILE A 126 -27.636 -6.515 -8.201 1.00 10.51 H new ATOM 0 HG12 ILE A 126 -29.255 -8.108 -7.177 1.00 11.44 H new ATOM 0 HG13 ILE A 126 -28.309 -8.757 -8.502 1.00 11.44 H new ATOM 0 HG21 ILE A 126 -25.808 -8.141 -8.589 1.00 10.87 H new ATOM 0 HG22 ILE A 126 -25.255 -6.699 -7.704 1.00 10.87 H new ATOM 0 HG23 ILE A 126 -25.533 -8.226 -6.833 1.00 10.87 H new ATOM 0 HD11 ILE A 126 -28.550 -10.397 -6.711 1.00 12.22 H new ATOM 0 HD12 ILE A 126 -26.844 -9.926 -6.900 1.00 12.22 H new ATOM 0 HD13 ILE A 126 -27.804 -9.267 -5.555 1.00 12.22 H new ATOM 1948 N ALA A 127 -28.892 -4.466 -5.899 1.00 8.62 N ATOM 1949 CA ALA A 127 -30.147 -3.755 -5.658 1.00 8.50 C ATOM 1950 C ALA A 127 -31.196 -4.068 -6.721 1.00 9.47 C ATOM 1951 O ALA A 127 -32.389 -3.873 -6.498 1.00 9.79 O ATOM 1952 CB ALA A 127 -29.898 -2.258 -5.586 1.00 7.91 C ATOM 0 H ALA A 127 -28.078 -3.858 -5.995 1.00 8.62 H new ATOM 0 HA ALA A 127 -30.540 -4.100 -4.702 1.00 8.50 H new ATOM 0 HB1 ALA A 127 -30.840 -1.741 -5.406 1.00 7.91 H new ATOM 0 HB2 ALA A 127 -29.205 -2.043 -4.772 1.00 7.91 H new ATOM 0 HB3 ALA A 127 -29.470 -1.915 -6.528 1.00 7.91 H new ATOM 1958 N LYS A 128 -30.745 -4.567 -7.864 1.00 10.12 N ATOM 1959 CA LYS A 128 -31.636 -4.874 -8.976 1.00 11.20 C ATOM 1960 C LYS A 128 -32.453 -6.136 -8.710 1.00 11.91 C ATOM 1961 O LYS A 128 -33.652 -6.177 -8.982 1.00 12.77 O ATOM 1962 CB LYS A 128 -30.826 -5.052 -10.258 1.00 11.83 C ATOM 1963 CG LYS A 128 -29.921 -3.875 -10.565 1.00 11.76 C ATOM 1964 CD LYS A 128 -29.173 -4.074 -11.872 1.00 12.45 C ATOM 1965 CE LYS A 128 -28.348 -2.849 -12.234 1.00 12.66 C ATOM 1966 NZ LYS A 128 -27.322 -2.540 -11.203 1.00 13.15 N ATOM 0 H LYS A 128 -29.762 -4.769 -8.046 1.00 10.12 H new ATOM 0 HA LYS A 128 -32.328 -4.039 -9.087 1.00 11.20 H new ATOM 0 HB2 LYS A 128 -30.221 -5.955 -10.174 1.00 11.83 H new ATOM 0 HB3 LYS A 128 -31.510 -5.203 -11.093 1.00 11.83 H new ATOM 0 HG2 LYS A 128 -30.515 -2.963 -10.620 1.00 11.76 H new ATOM 0 HG3 LYS A 128 -29.207 -3.742 -9.752 1.00 11.76 H new ATOM 0 HD2 LYS A 128 -28.520 -4.943 -11.790 1.00 12.45 H new ATOM 0 HD3 LYS A 128 -29.884 -4.284 -12.671 1.00 12.45 H new ATOM 0 HE2 LYS A 128 -27.858 -3.013 -13.194 1.00 12.66 H new ATOM 0 HE3 LYS A 128 -29.009 -1.991 -12.356 1.00 12.66 H new ATOM 0 HZ1 LYS A 128 -26.686 -1.797 -11.558 1.00 13.15 H new ATOM 0 HZ2 LYS A 128 -27.790 -2.210 -10.335 1.00 13.15 H new ATOM 0 HZ3 LYS A 128 -26.771 -3.397 -10.994 1.00 13.15 H new ATOM 1980 N ASN A 129 -31.802 -7.160 -8.172 1.00 11.70 N ATOM 1981 CA ASN A 129 -32.445 -8.458 -7.995 1.00 12.56 C ATOM 1982 C ASN A 129 -32.755 -8.728 -6.526 1.00 12.29 C ATOM 1983 O ASN A 129 -33.623 -9.539 -6.207 1.00 13.04 O ATOM 1984 CB ASN A 129 -31.556 -9.569 -8.566 1.00 13.04 C ATOM 1985 CG ASN A 129 -32.218 -10.936 -8.531 1.00 13.96 C ATOM 1986 OD1 ASN A 129 -32.983 -11.288 -9.427 1.00 14.48 O ATOM 1987 ND2 ASN A 129 -31.917 -11.724 -7.511 1.00 14.33 N ATOM 0 H ASN A 129 -30.834 -7.119 -7.852 1.00 11.70 H new ATOM 0 HA ASN A 129 -33.390 -8.444 -8.538 1.00 12.56 H new ATOM 0 HB2 ASN A 129 -31.294 -9.324 -9.595 1.00 13.04 H new ATOM 0 HB3 ASN A 129 -30.625 -9.608 -8.001 1.00 13.04 H new ATOM 0 HD21 ASN A 129 -32.324 -12.657 -7.450 1.00 14.33 H new ATOM 0 HD22 ASN A 129 -31.278 -11.398 -6.786 1.00 14.33 H new ATOM 1994 N CYS A 130 -32.048 -8.037 -5.640 1.00 11.34 N ATOM 1995 CA CYS A 130 -32.219 -8.216 -4.203 1.00 11.22 C ATOM 1996 C CYS A 130 -33.662 -7.948 -3.782 1.00 11.41 C ATOM 1997 O CYS A 130 -34.208 -6.872 -4.053 1.00 10.94 O ATOM 1998 CB CYS A 130 -31.275 -7.283 -3.436 1.00 10.26 C ATOM 1999 SG CYS A 130 -31.446 -7.390 -1.644 1.00 10.18 S ATOM 0 H CYS A 130 -31.346 -7.342 -5.894 1.00 11.34 H new ATOM 0 HA CYS A 130 -31.977 -9.252 -3.964 1.00 11.22 H new ATOM 0 HB2 CYS A 130 -30.246 -7.518 -3.708 1.00 10.26 H new ATOM 0 HB3 CYS A 130 -31.461 -6.256 -3.749 1.00 10.26 H new ATOM 2004 N ARG A 131 -34.277 -8.928 -3.131 1.00 12.28 N ATOM 2005 CA ARG A 131 -35.632 -8.764 -2.630 1.00 12.72 C ATOM 2006 C ARG A 131 -35.627 -7.940 -1.345 1.00 12.49 C ATOM 2007 O ARG A 131 -35.326 -8.438 -0.257 1.00 12.99 O ATOM 2008 CB ARG A 131 -36.309 -10.125 -2.406 1.00 13.93 C ATOM 2009 CG ARG A 131 -35.523 -11.083 -1.524 1.00 14.54 C ATOM 2010 CD ARG A 131 -36.328 -12.329 -1.197 1.00 15.39 C ATOM 2011 NE ARG A 131 -37.530 -12.017 -0.421 1.00 15.94 N ATOM 2012 CZ ARG A 131 -38.419 -12.926 -0.020 1.00 16.74 C ATOM 2013 NH1 ARG A 131 -38.245 -14.209 -0.315 1.00 17.08 N ATOM 2014 NH2 ARG A 131 -39.481 -12.553 0.682 1.00 17.31 N ATOM 0 H ARG A 131 -33.860 -9.839 -2.939 1.00 12.28 H new ATOM 0 HA ARG A 131 -36.210 -8.227 -3.382 1.00 12.72 H new ATOM 0 HB2 ARG A 131 -37.289 -9.960 -1.958 1.00 13.93 H new ATOM 0 HB3 ARG A 131 -36.477 -10.597 -3.374 1.00 13.93 H new ATOM 0 HG2 ARG A 131 -34.599 -11.368 -2.028 1.00 14.54 H new ATOM 0 HG3 ARG A 131 -35.240 -10.579 -0.600 1.00 14.54 H new ATOM 0 HD2 ARG A 131 -36.613 -12.829 -2.122 1.00 15.39 H new ATOM 0 HD3 ARG A 131 -35.705 -13.026 -0.636 1.00 15.39 H new ATOM 0 HE ARG A 131 -37.698 -11.042 -0.171 1.00 15.94 H new ATOM 0 HH11 ARG A 131 -37.428 -14.503 -0.851 1.00 17.08 H new ATOM 0 HH12 ARG A 131 -38.928 -14.901 -0.006 1.00 17.08 H new ATOM 0 HH21 ARG A 131 -39.618 -11.570 0.916 1.00 17.31 H new ATOM 0 HH22 ARG A 131 -40.160 -13.250 0.988 1.00 17.31 H new ATOM 2028 N ALA A 132 -35.941 -6.665 -1.491 1.00 11.89 N ATOM 2029 CA ALA A 132 -36.010 -5.739 -0.374 1.00 11.80 C ATOM 2030 C ALA A 132 -36.706 -4.469 -0.831 1.00 11.49 C ATOM 2031 O ALA A 132 -36.467 -4.017 -1.952 1.00 10.98 O ATOM 2032 CB ALA A 132 -34.613 -5.420 0.150 1.00 11.27 C ATOM 0 H ALA A 132 -36.157 -6.240 -2.393 1.00 11.89 H new ATOM 0 HA ALA A 132 -36.575 -6.195 0.439 1.00 11.80 H new ATOM 0 HB1 ALA A 132 -34.688 -4.725 0.986 1.00 11.27 H new ATOM 0 HB2 ALA A 132 -34.131 -6.339 0.484 1.00 11.27 H new ATOM 0 HB3 ALA A 132 -34.020 -4.968 -0.645 1.00 11.27 H new ATOM 2038 N PRO A 133 -37.585 -3.900 0.016 1.00 11.98 N ATOM 2039 CA PRO A 133 -38.326 -2.673 -0.299 1.00 11.96 C ATOM 2040 C PRO A 133 -37.434 -1.599 -0.902 1.00 11.21 C ATOM 2041 O PRO A 133 -36.624 -0.978 -0.206 1.00 11.39 O ATOM 2042 CB PRO A 133 -38.858 -2.228 1.061 1.00 12.84 C ATOM 2043 CG PRO A 133 -39.025 -3.494 1.822 1.00 13.32 C ATOM 2044 CD PRO A 133 -37.925 -4.413 1.356 1.00 12.82 C ATOM 0 HA PRO A 133 -39.105 -2.842 -1.042 1.00 11.96 H new ATOM 0 HB2 PRO A 133 -38.162 -1.553 1.559 1.00 12.84 H new ATOM 0 HB3 PRO A 133 -39.804 -1.695 0.963 1.00 12.84 H new ATOM 0 HG2 PRO A 133 -38.955 -3.315 2.895 1.00 13.32 H new ATOM 0 HG3 PRO A 133 -40.005 -3.934 1.636 1.00 13.32 H new ATOM 0 HD2 PRO A 133 -37.066 -4.382 2.026 1.00 12.82 H new ATOM 0 HD3 PRO A 133 -38.260 -5.450 1.315 1.00 12.82 H new ATOM 2052 N ARG A 134 -37.575 -1.403 -2.203 1.00 10.58 N ATOM 2053 CA ARG A 134 -36.730 -0.481 -2.932 1.00 10.01 C ATOM 2054 C ARG A 134 -37.165 0.954 -2.691 1.00 9.69 C ATOM 2055 O ARG A 134 -38.307 1.333 -2.963 1.00 10.21 O ATOM 2056 CB ARG A 134 -36.741 -0.821 -4.421 1.00 10.03 C ATOM 2057 CG ARG A 134 -35.875 0.091 -5.270 1.00 10.19 C ATOM 2058 CD ARG A 134 -35.804 -0.397 -6.708 1.00 10.81 C ATOM 2059 NE ARG A 134 -35.123 -1.689 -6.816 1.00 11.15 N ATOM 2060 CZ ARG A 134 -35.421 -2.617 -7.724 1.00 11.83 C ATOM 2061 NH1 ARG A 134 -36.394 -2.411 -8.600 1.00 12.25 N ATOM 2062 NH2 ARG A 134 -34.738 -3.752 -7.761 1.00 12.30 N ATOM 0 H ARG A 134 -38.273 -1.876 -2.776 1.00 10.58 H new ATOM 0 HA ARG A 134 -35.708 -0.580 -2.568 1.00 10.01 H new ATOM 0 HB2 ARG A 134 -36.403 -1.849 -4.551 1.00 10.03 H new ATOM 0 HB3 ARG A 134 -37.767 -0.774 -4.786 1.00 10.03 H new ATOM 0 HG2 ARG A 134 -36.278 1.104 -5.247 1.00 10.19 H new ATOM 0 HG3 ARG A 134 -34.871 0.138 -4.849 1.00 10.19 H new ATOM 0 HD2 ARG A 134 -36.813 -0.484 -7.111 1.00 10.81 H new ATOM 0 HD3 ARG A 134 -35.280 0.341 -7.316 1.00 10.81 H new ATOM 0 HE ARG A 134 -34.373 -1.891 -6.154 1.00 11.15 H new ATOM 0 HH11 ARG A 134 -36.920 -1.537 -8.582 1.00 12.25 H new ATOM 0 HH12 ARG A 134 -36.617 -3.126 -9.292 1.00 12.25 H new ATOM 0 HH21 ARG A 134 -33.984 -3.915 -7.094 1.00 12.30 H new ATOM 0 HH22 ARG A 134 -34.967 -4.462 -8.456 1.00 12.30 H new ATOM 2076 N LYS A 135 -36.241 1.737 -2.162 1.00 9.06 N ATOM 2077 CA LYS A 135 -36.503 3.119 -1.820 1.00 9.00 C ATOM 2078 C LYS A 135 -36.764 3.947 -3.060 1.00 9.08 C ATOM 2079 O LYS A 135 -36.349 3.593 -4.165 1.00 9.30 O ATOM 2080 CB LYS A 135 -35.323 3.711 -1.054 1.00 8.75 C ATOM 2081 CG LYS A 135 -35.734 4.433 0.217 1.00 8.95 C ATOM 2082 CD LYS A 135 -36.480 3.512 1.172 1.00 9.28 C ATOM 2083 CE LYS A 135 -35.549 2.546 1.885 1.00 9.72 C ATOM 2084 NZ LYS A 135 -34.626 3.246 2.815 1.00 10.11 N ATOM 0 H LYS A 135 -35.290 1.430 -1.959 1.00 9.06 H new ATOM 0 HA LYS A 135 -37.392 3.142 -1.190 1.00 9.00 H new ATOM 0 HB2 LYS A 135 -34.626 2.912 -0.801 1.00 8.75 H new ATOM 0 HB3 LYS A 135 -34.790 4.406 -1.702 1.00 8.75 H new ATOM 0 HG2 LYS A 135 -34.848 4.830 0.712 1.00 8.95 H new ATOM 0 HG3 LYS A 135 -36.366 5.284 -0.036 1.00 8.95 H new ATOM 0 HD2 LYS A 135 -37.013 4.112 1.910 1.00 9.28 H new ATOM 0 HD3 LYS A 135 -37.230 2.948 0.618 1.00 9.28 H new ATOM 0 HE2 LYS A 135 -36.139 1.817 2.440 1.00 9.72 H new ATOM 0 HE3 LYS A 135 -34.969 1.991 1.148 1.00 9.72 H new ATOM 0 HZ1 LYS A 135 -34.218 2.559 3.481 1.00 10.11 H new ATOM 0 HZ2 LYS A 135 -33.863 3.698 2.272 1.00 10.11 H new ATOM 0 HZ3 LYS A 135 -35.151 3.972 3.344 1.00 10.11 H new ATOM 2098 N LYS A 136 -37.440 5.058 -2.863 1.00 9.17 N ATOM 2099 CA LYS A 136 -37.793 5.933 -3.952 1.00 9.54 C ATOM 2100 C LYS A 136 -36.890 7.152 -3.922 1.00 9.54 C ATOM 2101 O LYS A 136 -37.302 8.239 -3.526 1.00 9.99 O ATOM 2102 CB LYS A 136 -39.271 6.341 -3.873 1.00 10.03 C ATOM 2103 CG LYS A 136 -40.252 5.172 -3.977 1.00 10.42 C ATOM 2104 CD LYS A 136 -40.373 4.408 -2.664 1.00 10.60 C ATOM 2105 CE LYS A 136 -41.353 3.246 -2.770 1.00 11.32 C ATOM 2106 NZ LYS A 136 -40.861 2.179 -3.682 1.00 11.69 N ATOM 0 H LYS A 136 -37.758 5.376 -1.947 1.00 9.17 H new ATOM 0 HA LYS A 136 -37.653 5.406 -4.896 1.00 9.54 H new ATOM 0 HB2 LYS A 136 -39.442 6.862 -2.931 1.00 10.03 H new ATOM 0 HB3 LYS A 136 -39.483 7.051 -4.673 1.00 10.03 H new ATOM 0 HG2 LYS A 136 -41.233 5.547 -4.270 1.00 10.42 H new ATOM 0 HG3 LYS A 136 -39.923 4.492 -4.763 1.00 10.42 H new ATOM 0 HD2 LYS A 136 -39.393 4.031 -2.372 1.00 10.60 H new ATOM 0 HD3 LYS A 136 -40.700 5.088 -1.877 1.00 10.60 H new ATOM 0 HE2 LYS A 136 -41.523 2.825 -1.779 1.00 11.32 H new ATOM 0 HE3 LYS A 136 -42.314 3.615 -3.129 1.00 11.32 H new ATOM 0 HZ1 LYS A 136 -41.535 1.387 -3.685 1.00 11.69 H new ATOM 0 HZ2 LYS A 136 -40.771 2.560 -4.645 1.00 11.69 H new ATOM 0 HZ3 LYS A 136 -39.933 1.843 -3.355 1.00 11.69 H new ATOM 2120 N GLY A 137 -35.659 6.952 -4.361 1.00 9.28 N ATOM 2121 CA GLY A 137 -34.686 8.022 -4.376 1.00 9.53 C ATOM 2122 C GLY A 137 -33.561 7.813 -3.380 1.00 9.53 C ATOM 2123 O GLY A 137 -32.747 6.903 -3.558 1.00 9.44 O ATOM 0 H GLY A 137 -35.313 6.058 -4.711 1.00 9.28 H new ATOM 0 HA2 GLY A 137 -34.266 8.109 -5.378 1.00 9.53 H new ATOM 0 HA3 GLY A 137 -35.187 8.965 -4.157 1.00 9.53 H new ATOM 2127 N CYS A 138 -33.502 8.633 -2.341 1.00 9.89 N ATOM 2128 CA CYS A 138 -32.373 8.604 -1.420 1.00 10.22 C ATOM 2129 C CYS A 138 -32.517 7.487 -0.394 1.00 9.92 C ATOM 2130 O CYS A 138 -33.622 7.058 -0.073 1.00 9.94 O ATOM 2131 CB CYS A 138 -32.224 9.956 -0.722 1.00 11.12 C ATOM 2132 SG CYS A 138 -31.625 11.274 -1.805 1.00 12.01 S ATOM 0 H CYS A 138 -34.218 9.323 -2.114 1.00 9.89 H new ATOM 0 HA CYS A 138 -31.473 8.404 -2.001 1.00 10.22 H new ATOM 0 HB2 CYS A 138 -33.189 10.249 -0.308 1.00 11.12 H new ATOM 0 HB3 CYS A 138 -31.537 9.847 0.117 1.00 11.12 H new ATOM 2137 N TRP A 139 -31.380 7.005 0.092 1.00 9.89 N ATOM 2138 CA TRP A 139 -31.359 5.948 1.097 1.00 9.90 C ATOM 2139 C TRP A 139 -30.820 6.469 2.426 1.00 10.86 C ATOM 2140 O TRP A 139 -31.113 5.922 3.488 1.00 11.32 O ATOM 2141 CB TRP A 139 -30.485 4.783 0.623 1.00 9.65 C ATOM 2142 CG TRP A 139 -30.822 4.301 -0.752 1.00 9.03 C ATOM 2143 CD1 TRP A 139 -31.824 3.444 -1.100 1.00 8.51 C ATOM 2144 CD2 TRP A 139 -30.147 4.646 -1.966 1.00 9.20 C ATOM 2145 NE1 TRP A 139 -31.818 3.241 -2.458 1.00 8.35 N ATOM 2146 CE2 TRP A 139 -30.798 3.968 -3.011 1.00 8.78 C ATOM 2147 CE3 TRP A 139 -29.057 5.464 -2.269 1.00 9.91 C ATOM 2148 CZ2 TRP A 139 -30.393 4.084 -4.338 1.00 9.11 C ATOM 2149 CZ3 TRP A 139 -28.657 5.579 -3.584 1.00 10.19 C ATOM 2150 CH2 TRP A 139 -29.324 4.893 -4.607 1.00 9.81 C ATOM 0 H TRP A 139 -30.457 7.330 -0.194 1.00 9.89 H new ATOM 0 HA TRP A 139 -32.383 5.604 1.241 1.00 9.90 H new ATOM 0 HB2 TRP A 139 -29.440 5.092 0.644 1.00 9.65 H new ATOM 0 HB3 TRP A 139 -30.587 3.955 1.324 1.00 9.65 H new ATOM 0 HD1 TRP A 139 -32.520 2.991 -0.409 1.00 8.51 H new ATOM 0 HE1 TRP A 139 -32.468 2.645 -2.971 1.00 8.35 H new ATOM 0 HE3 TRP A 139 -28.536 5.997 -1.488 1.00 9.91 H new ATOM 0 HZ2 TRP A 139 -30.905 3.554 -5.127 1.00 9.11 H new ATOM 0 HZ3 TRP A 139 -27.815 6.209 -3.829 1.00 10.19 H new ATOM 0 HH2 TRP A 139 -28.988 5.005 -5.627 1.00 9.81 H new ATOM 2161 N LYS A 140 -30.025 7.527 2.359 1.00 11.35 N ATOM 2162 CA LYS A 140 -29.355 8.060 3.537 1.00 12.41 C ATOM 2163 C LYS A 140 -30.162 9.194 4.149 1.00 12.91 C ATOM 2164 O LYS A 140 -30.504 9.164 5.329 1.00 13.52 O ATOM 2165 CB LYS A 140 -27.955 8.543 3.140 1.00 13.04 C ATOM 2166 CG LYS A 140 -27.048 8.942 4.301 1.00 14.05 C ATOM 2167 CD LYS A 140 -27.295 10.374 4.759 1.00 14.34 C ATOM 2168 CE LYS A 140 -26.277 10.819 5.799 1.00 15.50 C ATOM 2169 NZ LYS A 140 -26.334 10.000 7.037 1.00 16.11 N ATOM 0 H LYS A 140 -29.827 8.036 1.497 1.00 11.35 H new ATOM 0 HA LYS A 140 -29.267 7.275 4.288 1.00 12.41 H new ATOM 0 HB2 LYS A 140 -27.464 7.753 2.572 1.00 13.04 H new ATOM 0 HB3 LYS A 140 -28.060 9.398 2.472 1.00 13.04 H new ATOM 0 HG2 LYS A 140 -27.211 8.262 5.137 1.00 14.05 H new ATOM 0 HG3 LYS A 140 -26.006 8.833 4.000 1.00 14.05 H new ATOM 0 HD2 LYS A 140 -27.252 11.043 3.899 1.00 14.34 H new ATOM 0 HD3 LYS A 140 -28.299 10.454 5.176 1.00 14.34 H new ATOM 0 HE2 LYS A 140 -25.276 10.758 5.372 1.00 15.50 H new ATOM 0 HE3 LYS A 140 -26.453 11.865 6.051 1.00 15.50 H new ATOM 0 HZ1 LYS A 140 -25.670 10.385 7.739 1.00 16.11 H new ATOM 0 HZ2 LYS A 140 -27.299 10.023 7.425 1.00 16.11 H new ATOM 0 HZ3 LYS A 140 -26.073 9.018 6.816 1.00 16.11 H new ATOM 2183 N CYS A 141 -30.466 10.192 3.337 1.00 12.82 N ATOM 2184 CA CYS A 141 -31.183 11.367 3.805 1.00 13.44 C ATOM 2185 C CYS A 141 -32.657 11.054 4.045 1.00 13.01 C ATOM 2186 O CYS A 141 -33.389 11.857 4.627 1.00 13.56 O ATOM 2187 CB CYS A 141 -31.034 12.482 2.778 1.00 13.82 C ATOM 2188 SG CYS A 141 -29.887 12.073 1.440 1.00 13.97 S ATOM 0 H CYS A 141 -30.226 10.212 2.346 1.00 12.82 H new ATOM 0 HA CYS A 141 -30.758 11.686 4.756 1.00 13.44 H new ATOM 0 HB2 CYS A 141 -32.012 12.708 2.353 1.00 13.82 H new ATOM 0 HB3 CYS A 141 -30.688 13.386 3.280 1.00 13.82 H new ATOM 2193 N GLY A 142 -33.086 9.880 3.613 1.00 12.16 N ATOM 2194 CA GLY A 142 -34.476 9.509 3.762 1.00 11.86 C ATOM 2195 C GLY A 142 -34.949 8.617 2.646 1.00 11.95 C ATOM 2196 O GLY A 142 -34.552 7.454 2.566 1.00 12.26 O ATOM 0 H GLY A 142 -32.498 9.178 3.163 1.00 12.16 H new ATOM 0 HA2 GLY A 142 -34.614 8.999 4.716 1.00 11.86 H new ATOM 0 HA3 GLY A 142 -35.090 10.409 3.790 1.00 11.86 H new ATOM 2200 N LYS A 143 -35.800 9.165 1.788 1.00 11.90 N ATOM 2201 CA LYS A 143 -36.280 8.450 0.621 1.00 12.23 C ATOM 2202 C LYS A 143 -36.721 9.413 -0.483 1.00 11.90 C ATOM 2203 O LYS A 143 -36.015 9.568 -1.474 1.00 11.44 O ATOM 2204 CB LYS A 143 -37.388 7.442 0.990 1.00 13.11 C ATOM 2205 CG LYS A 143 -38.468 7.958 1.936 1.00 13.82 C ATOM 2206 CD LYS A 143 -39.265 6.799 2.523 1.00 14.46 C ATOM 2207 CE LYS A 143 -40.362 7.269 3.469 1.00 15.30 C ATOM 2208 NZ LYS A 143 -41.486 7.926 2.752 1.00 15.88 N ATOM 0 H LYS A 143 -36.172 10.110 1.883 1.00 11.90 H new ATOM 0 HA LYS A 143 -35.446 7.871 0.223 1.00 12.23 H new ATOM 0 HB2 LYS A 143 -37.867 7.106 0.071 1.00 13.11 H new ATOM 0 HB3 LYS A 143 -36.921 6.568 1.444 1.00 13.11 H new ATOM 0 HG2 LYS A 143 -38.010 8.535 2.739 1.00 13.82 H new ATOM 0 HG3 LYS A 143 -39.137 8.632 1.400 1.00 13.82 H new ATOM 0 HD2 LYS A 143 -39.710 6.221 1.713 1.00 14.46 H new ATOM 0 HD3 LYS A 143 -38.590 6.131 3.058 1.00 14.46 H new ATOM 0 HE2 LYS A 143 -40.742 6.417 4.032 1.00 15.30 H new ATOM 0 HE3 LYS A 143 -39.940 7.966 4.193 1.00 15.30 H new ATOM 0 HZ1 LYS A 143 -42.258 8.121 3.421 1.00 15.88 H new ATOM 0 HZ2 LYS A 143 -41.156 8.819 2.334 1.00 15.88 H new ATOM 0 HZ3 LYS A 143 -41.832 7.298 1.999 1.00 15.88 H new ATOM 2222 N GLU A 144 -37.846 10.101 -0.301 1.00 12.31 N ATOM 2223 CA GLU A 144 -38.398 10.929 -1.374 1.00 12.29 C ATOM 2224 C GLU A 144 -38.061 12.405 -1.179 1.00 12.31 C ATOM 2225 O GLU A 144 -38.466 13.251 -1.982 1.00 12.33 O ATOM 2226 CB GLU A 144 -39.919 10.756 -1.482 1.00 13.02 C ATOM 2227 CG GLU A 144 -40.720 11.539 -0.450 1.00 13.41 C ATOM 2228 CD GLU A 144 -40.528 11.031 0.958 1.00 13.89 C ATOM 2229 OE1 GLU A 144 -41.260 10.112 1.360 1.00 14.11 O ATOM 2230 OE2 GLU A 144 -39.647 11.551 1.673 1.00 14.20 O ATOM 0 H GLU A 144 -38.387 10.104 0.564 1.00 12.31 H new ATOM 0 HA GLU A 144 -37.937 10.591 -2.302 1.00 12.29 H new ATOM 0 HB2 GLU A 144 -40.237 11.063 -2.479 1.00 13.02 H new ATOM 0 HB3 GLU A 144 -40.159 9.697 -1.383 1.00 13.02 H new ATOM 0 HG2 GLU A 144 -40.430 12.589 -0.494 1.00 13.41 H new ATOM 0 HG3 GLU A 144 -41.778 11.490 -0.707 1.00 13.41 H new ATOM 2237 N GLY A 145 -37.337 12.713 -0.109 1.00 12.50 N ATOM 2238 CA GLY A 145 -36.930 14.084 0.140 1.00 12.76 C ATOM 2239 C GLY A 145 -36.117 14.630 -1.012 1.00 12.89 C ATOM 2240 O GLY A 145 -36.247 15.796 -1.387 1.00 13.35 O ATOM 0 H GLY A 145 -37.025 12.039 0.590 1.00 12.50 H new ATOM 0 HA2 GLY A 145 -37.812 14.706 0.293 1.00 12.76 H new ATOM 0 HA3 GLY A 145 -36.343 14.131 1.057 1.00 12.76 H new ATOM 2244 N HIS A 146 -35.285 13.770 -1.575 1.00 12.67 N ATOM 2245 CA HIS A 146 -34.526 14.093 -2.769 1.00 12.99 C ATOM 2246 C HIS A 146 -34.718 12.966 -3.774 1.00 12.58 C ATOM 2247 O HIS A 146 -35.035 11.842 -3.391 1.00 11.92 O ATOM 2248 CB HIS A 146 -33.027 14.232 -2.467 1.00 13.11 C ATOM 2249 CG HIS A 146 -32.691 14.969 -1.202 1.00 13.73 C ATOM 2250 ND1 HIS A 146 -32.076 14.326 -0.157 1.00 13.78 N ATOM 2251 CD2 HIS A 146 -32.860 16.274 -0.882 1.00 14.46 C ATOM 2252 CE1 HIS A 146 -31.879 15.246 0.771 1.00 14.54 C ATOM 2253 NE2 HIS A 146 -32.341 16.443 0.377 1.00 14.96 N ATOM 0 H HIS A 146 -35.118 12.830 -1.217 1.00 12.67 H new ATOM 0 HA HIS A 146 -34.883 15.045 -3.161 1.00 12.99 H new ATOM 0 HB2 HIS A 146 -32.590 13.235 -2.414 1.00 13.11 H new ATOM 0 HB3 HIS A 146 -32.551 14.744 -3.303 1.00 13.11 H new ATOM 0 HD2 HIS A 146 -33.315 17.035 -1.499 1.00 14.46 H new ATOM 0 HE1 HIS A 146 -31.407 15.059 1.724 1.00 14.54 H new ATOM 0 HE2 HIS A 146 -32.312 17.312 0.911 1.00 14.96 H new ATOM 2261 N GLN A 147 -34.516 13.257 -5.048 1.00 13.15 N ATOM 2262 CA GLN A 147 -34.627 12.234 -6.084 1.00 13.06 C ATOM 2263 C GLN A 147 -33.310 11.477 -6.246 1.00 12.82 C ATOM 2264 O GLN A 147 -33.108 10.781 -7.240 1.00 13.08 O ATOM 2265 CB GLN A 147 -35.041 12.862 -7.418 1.00 14.01 C ATOM 2266 CG GLN A 147 -36.433 13.479 -7.399 1.00 14.38 C ATOM 2267 CD GLN A 147 -37.544 12.449 -7.249 1.00 14.79 C ATOM 2268 OE1 GLN A 147 -37.355 11.388 -6.652 1.00 14.85 O ATOM 2269 NE2 GLN A 147 -38.712 12.757 -7.790 1.00 15.24 N ATOM 0 H GLN A 147 -34.275 14.186 -5.392 1.00 13.15 H new ATOM 0 HA GLN A 147 -35.396 11.526 -5.776 1.00 13.06 H new ATOM 0 HB2 GLN A 147 -34.316 13.630 -7.688 1.00 14.01 H new ATOM 0 HB3 GLN A 147 -35.002 12.100 -8.196 1.00 14.01 H new ATOM 0 HG2 GLN A 147 -36.495 14.193 -6.578 1.00 14.38 H new ATOM 0 HG3 GLN A 147 -36.588 14.039 -8.321 1.00 14.38 H new ATOM 0 HE21 GLN A 147 -38.830 13.646 -8.277 1.00 15.24 H new ATOM 0 HE22 GLN A 147 -39.494 12.106 -7.720 1.00 15.24 H new ATOM 2278 N MET A 148 -32.429 11.630 -5.252 1.00 12.52 N ATOM 2279 CA MET A 148 -31.100 11.003 -5.229 1.00 12.47 C ATOM 2280 C MET A 148 -30.179 11.594 -6.301 1.00 13.37 C ATOM 2281 O MET A 148 -29.090 12.071 -5.992 1.00 13.85 O ATOM 2282 CB MET A 148 -31.202 9.473 -5.361 1.00 11.69 C ATOM 2283 CG MET A 148 -29.875 8.738 -5.196 1.00 11.72 C ATOM 2284 SD MET A 148 -28.809 8.840 -6.651 1.00 11.68 S ATOM 2285 CE MET A 148 -27.315 8.077 -6.024 1.00 11.96 C ATOM 0 H MET A 148 -32.620 12.201 -4.428 1.00 12.52 H new ATOM 0 HA MET A 148 -30.653 11.223 -4.259 1.00 12.47 H new ATOM 0 HB2 MET A 148 -31.905 9.102 -4.615 1.00 11.69 H new ATOM 0 HB3 MET A 148 -31.618 9.231 -6.339 1.00 11.69 H new ATOM 0 HG2 MET A 148 -29.345 9.150 -4.337 1.00 11.72 H new ATOM 0 HG3 MET A 148 -30.075 7.690 -4.974 1.00 11.72 H new ATOM 0 HE1 MET A 148 -26.514 8.191 -6.755 1.00 11.96 H new ATOM 0 HE2 MET A 148 -27.025 8.558 -5.090 1.00 11.96 H new ATOM 0 HE3 MET A 148 -27.495 7.017 -5.845 1.00 11.96 H new ATOM 2295 N LYS A 149 -30.625 11.576 -7.550 1.00 13.75 N ATOM 2296 CA LYS A 149 -29.843 12.107 -8.664 1.00 14.74 C ATOM 2297 C LYS A 149 -29.554 13.588 -8.459 1.00 15.59 C ATOM 2298 O LYS A 149 -28.440 14.060 -8.690 1.00 16.38 O ATOM 2299 CB LYS A 149 -30.600 11.903 -9.978 1.00 15.07 C ATOM 2300 CG LYS A 149 -31.052 10.469 -10.202 1.00 14.89 C ATOM 2301 CD LYS A 149 -29.878 9.507 -10.177 1.00 14.96 C ATOM 2302 CE LYS A 149 -30.326 8.075 -10.412 1.00 15.59 C ATOM 2303 NZ LYS A 149 -29.180 7.126 -10.419 1.00 15.96 N ATOM 0 H LYS A 149 -31.532 11.196 -7.821 1.00 13.75 H new ATOM 0 HA LYS A 149 -28.895 11.570 -8.707 1.00 14.74 H new ATOM 0 HB2 LYS A 149 -31.472 12.557 -9.991 1.00 15.07 H new ATOM 0 HB3 LYS A 149 -29.961 12.208 -10.807 1.00 15.07 H new ATOM 0 HG2 LYS A 149 -31.771 10.188 -9.432 1.00 14.89 H new ATOM 0 HG3 LYS A 149 -31.566 10.393 -11.160 1.00 14.89 H new ATOM 0 HD2 LYS A 149 -29.156 9.793 -10.941 1.00 14.96 H new ATOM 0 HD3 LYS A 149 -29.369 9.577 -9.215 1.00 14.96 H new ATOM 0 HE2 LYS A 149 -31.033 7.784 -9.635 1.00 15.59 H new ATOM 0 HE3 LYS A 149 -30.855 8.012 -11.363 1.00 15.59 H new ATOM 0 HZ1 LYS A 149 -29.530 6.160 -10.582 1.00 15.96 H new ATOM 0 HZ2 LYS A 149 -28.518 7.387 -11.177 1.00 15.96 H new ATOM 0 HZ3 LYS A 149 -28.690 7.166 -9.502 1.00 15.96 H new ATOM 2317 N ASP A 150 -30.566 14.311 -8.005 1.00 15.52 N ATOM 2318 CA ASP A 150 -30.438 15.742 -7.742 1.00 16.41 C ATOM 2319 C ASP A 150 -30.035 16.000 -6.292 1.00 16.34 C ATOM 2320 O ASP A 150 -30.208 17.106 -5.773 1.00 17.13 O ATOM 2321 CB ASP A 150 -31.751 16.470 -8.051 1.00 16.67 C ATOM 2322 CG ASP A 150 -32.062 16.527 -9.533 1.00 17.24 C ATOM 2323 OD1 ASP A 150 -32.785 15.637 -10.030 1.00 17.41 O ATOM 2324 OD2 ASP A 150 -31.594 17.470 -10.207 1.00 17.63 O ATOM 0 H ASP A 150 -31.492 13.930 -7.809 1.00 15.52 H new ATOM 0 HA ASP A 150 -29.656 16.128 -8.395 1.00 16.41 H new ATOM 0 HB2 ASP A 150 -32.569 15.969 -7.533 1.00 16.67 H new ATOM 0 HB3 ASP A 150 -31.699 17.485 -7.657 1.00 16.67 H new ATOM 2329 N CYS A 151 -29.499 14.980 -5.639 1.00 15.51 N ATOM 2330 CA CYS A 151 -29.056 15.111 -4.262 1.00 15.54 C ATOM 2331 C CYS A 151 -27.565 15.420 -4.228 1.00 15.97 C ATOM 2332 O CYS A 151 -26.732 14.558 -4.517 1.00 15.64 O ATOM 2333 CB CYS A 151 -29.353 13.832 -3.477 1.00 14.63 C ATOM 2334 SG CYS A 151 -28.973 13.933 -1.715 1.00 14.46 S ATOM 0 H CYS A 151 -29.361 14.053 -6.042 1.00 15.51 H new ATOM 0 HA CYS A 151 -29.600 15.931 -3.794 1.00 15.54 H new ATOM 0 HB2 CYS A 151 -30.408 13.584 -3.595 1.00 14.63 H new ATOM 0 HB3 CYS A 151 -28.782 13.012 -3.913 1.00 14.63 H new ATOM 2339 N THR A 152 -27.237 16.656 -3.899 1.00 16.85 N ATOM 2340 CA THR A 152 -25.854 17.080 -3.832 1.00 17.48 C ATOM 2341 C THR A 152 -25.407 17.205 -2.383 1.00 17.79 C ATOM 2342 O THR A 152 -25.926 18.035 -1.634 1.00 18.21 O ATOM 2343 CB THR A 152 -25.655 18.425 -4.555 1.00 18.43 C ATOM 2344 OG1 THR A 152 -26.179 18.334 -5.887 1.00 18.64 O ATOM 2345 CG2 THR A 152 -24.182 18.805 -4.611 1.00 18.95 C ATOM 0 H THR A 152 -27.914 17.385 -3.674 1.00 16.85 H new ATOM 0 HA THR A 152 -25.247 16.324 -4.330 1.00 17.48 H new ATOM 0 HB THR A 152 -26.186 19.197 -3.998 1.00 18.43 H new ATOM 0 HG1 THR A 152 -26.054 19.190 -6.347 1.00 18.64 H new ATOM 0 HG21 THR A 152 -24.072 19.759 -5.127 1.00 18.95 H new ATOM 0 HG22 THR A 152 -23.790 18.893 -3.598 1.00 18.95 H new ATOM 0 HG23 THR A 152 -23.628 18.036 -5.149 1.00 18.95 H new ATOM 2353 N GLU A 153 -24.459 16.368 -1.991 1.00 17.71 N ATOM 2354 CA GLU A 153 -23.926 16.399 -0.640 1.00 18.13 C ATOM 2355 C GLU A 153 -22.712 17.318 -0.595 1.00 19.12 C ATOM 2356 O GLU A 153 -21.652 16.986 -1.124 1.00 19.35 O ATOM 2357 CB GLU A 153 -23.542 14.985 -0.197 1.00 17.70 C ATOM 2358 CG GLU A 153 -24.709 14.009 -0.196 1.00 17.60 C ATOM 2359 CD GLU A 153 -24.274 12.577 0.038 1.00 17.59 C ATOM 2360 OE1 GLU A 153 -23.931 12.232 1.189 1.00 17.64 O ATOM 2361 OE2 GLU A 153 -24.276 11.784 -0.928 1.00 17.65 O ATOM 0 H GLU A 153 -24.042 15.657 -2.592 1.00 17.71 H new ATOM 0 HA GLU A 153 -24.686 16.780 0.042 1.00 18.13 H new ATOM 0 HB2 GLU A 153 -22.762 14.605 -0.858 1.00 17.70 H new ATOM 0 HB3 GLU A 153 -23.116 15.030 0.805 1.00 17.70 H new ATOM 0 HG2 GLU A 153 -25.419 14.300 0.578 1.00 17.60 H new ATOM 0 HG3 GLU A 153 -25.232 14.074 -1.150 1.00 17.60 H new ATOM 2368 N ARG A 154 -22.871 18.475 0.028 1.00 19.80 N ATOM 2369 CA ARG A 154 -21.811 19.470 0.055 1.00 20.84 C ATOM 2370 C ARG A 154 -21.906 20.319 1.314 1.00 21.28 C ATOM 2371 O ARG A 154 -22.984 20.792 1.674 1.00 21.68 O ATOM 2372 CB ARG A 154 -21.898 20.352 -1.193 1.00 21.38 C ATOM 2373 CG ARG A 154 -20.844 21.445 -1.257 1.00 21.89 C ATOM 2374 CD ARG A 154 -20.855 22.134 -2.607 1.00 22.33 C ATOM 2375 NE ARG A 154 -20.551 21.202 -3.690 1.00 22.67 N ATOM 2376 CZ ARG A 154 -21.200 21.171 -4.853 1.00 23.08 C ATOM 2377 NH1 ARG A 154 -22.175 22.039 -5.101 1.00 23.21 N ATOM 2378 NH2 ARG A 154 -20.867 20.275 -5.772 1.00 23.48 N ATOM 0 H ARG A 154 -23.722 18.748 0.521 1.00 19.80 H new ATOM 0 HA ARG A 154 -20.848 18.959 0.062 1.00 20.84 H new ATOM 0 HB2 ARG A 154 -21.806 19.721 -2.077 1.00 21.38 H new ATOM 0 HB3 ARG A 154 -22.885 20.812 -1.231 1.00 21.38 H new ATOM 0 HG2 ARG A 154 -21.026 22.177 -0.470 1.00 21.89 H new ATOM 0 HG3 ARG A 154 -19.859 21.016 -1.072 1.00 21.89 H new ATOM 0 HD2 ARG A 154 -21.833 22.585 -2.778 1.00 22.33 H new ATOM 0 HD3 ARG A 154 -20.126 22.944 -2.608 1.00 22.33 H new ATOM 0 HE ARG A 154 -19.794 20.533 -3.547 1.00 22.67 H new ATOM 0 HH11 ARG A 154 -22.430 22.734 -4.399 1.00 23.21 H new ATOM 0 HH12 ARG A 154 -22.668 22.011 -5.993 1.00 23.21 H new ATOM 0 HH21 ARG A 154 -20.115 19.611 -5.588 1.00 23.48 H new ATOM 0 HH22 ARG A 154 -21.363 20.250 -6.663 1.00 23.48 H new ATOM 2392 N GLN A 155 -20.775 20.524 1.972 1.00 21.32 N ATOM 2393 CA GLN A 155 -20.740 21.276 3.220 1.00 21.85 C ATOM 2394 C GLN A 155 -20.572 22.772 2.956 1.00 22.14 C ATOM 2395 O GLN A 155 -19.869 23.469 3.687 1.00 22.34 O ATOM 2396 CB GLN A 155 -19.606 20.771 4.113 1.00 21.93 C ATOM 2397 CG GLN A 155 -19.694 19.290 4.454 1.00 22.12 C ATOM 2398 CD GLN A 155 -21.017 18.908 5.087 1.00 22.30 C ATOM 2399 OE1 GLN A 155 -21.183 18.992 6.305 1.00 22.37 O ATOM 2400 NE2 GLN A 155 -21.960 18.466 4.269 1.00 22.51 N ATOM 0 H GLN A 155 -19.866 20.180 1.662 1.00 21.32 H new ATOM 0 HA GLN A 155 -21.691 21.124 3.731 1.00 21.85 H new ATOM 0 HB2 GLN A 155 -18.655 20.962 3.617 1.00 21.93 H new ATOM 0 HB3 GLN A 155 -19.604 21.346 5.039 1.00 21.93 H new ATOM 0 HG2 GLN A 155 -19.549 18.704 3.546 1.00 22.12 H new ATOM 0 HG3 GLN A 155 -18.883 19.030 5.134 1.00 22.12 H new ATOM 0 HE21 GLN A 155 -21.781 18.412 3.266 1.00 22.51 H new ATOM 0 HE22 GLN A 155 -22.865 18.179 4.642 1.00 22.51 H new ATOM 2409 N ALA A 156 -21.225 23.261 1.909 1.00 22.27 N ATOM 2410 CA ALA A 156 -21.165 24.673 1.556 1.00 22.67 C ATOM 2411 C ALA A 156 -22.369 25.412 2.120 1.00 23.02 C ATOM 2412 O ALA A 156 -22.519 26.621 1.942 1.00 23.30 O ATOM 2413 CB ALA A 156 -21.099 24.844 0.046 1.00 22.74 C ATOM 0 H ALA A 156 -21.805 22.697 1.287 1.00 22.27 H new ATOM 0 HA ALA A 156 -20.261 25.098 1.991 1.00 22.67 H new ATOM 0 HB1 ALA A 156 -21.055 25.905 -0.198 1.00 22.74 H new ATOM 0 HB2 ALA A 156 -20.209 24.346 -0.338 1.00 22.74 H new ATOM 0 HB3 ALA A 156 -21.986 24.404 -0.409 1.00 22.74 H new ATOM 2419 N ASN A 157 -23.231 24.672 2.795 1.00 23.11 N ATOM 2420 CA ASN A 157 -24.414 25.248 3.403 1.00 23.57 C ATOM 2421 C ASN A 157 -24.176 25.449 4.890 1.00 23.76 C ATOM 2422 O ASN A 157 -23.744 26.552 5.280 1.00 23.91 O ATOM 2423 CB ASN A 157 -25.631 24.347 3.176 1.00 23.80 C ATOM 2424 CG ASN A 157 -25.961 24.167 1.706 1.00 23.98 C ATOM 2425 OD1 ASN A 157 -25.464 23.249 1.050 1.00 23.92 O ATOM 2426 ND2 ASN A 157 -26.796 25.043 1.177 1.00 24.30 N ATOM 2427 OXT ASN A 157 -24.387 24.495 5.663 1.00 23.85 O ATOM 0 H ASN A 157 -23.132 23.667 2.935 1.00 23.11 H new ATOM 0 HA ASN A 157 -24.615 26.213 2.938 1.00 23.57 H new ATOM 0 HB2 ASN A 157 -25.444 23.371 3.624 1.00 23.80 H new ATOM 0 HB3 ASN A 157 -26.494 24.773 3.688 1.00 23.80 H new ATOM 0 HD21 ASN A 157 -27.051 24.974 0.192 1.00 24.30 H new ATOM 0 HD22 ASN A 157 -27.186 25.789 1.754 1.00 24.30 H new TER 2434 ASN A 157 HETATM 2435 ZN ZN A 201 -29.883 -6.062 -0.606 1.00 9.38 ZN HETATM 2436 ZN ZN A 202 -30.680 12.943 -0.535 1.00 13.43 ZN