USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1458 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 MET CE :methyl -141:sc= 0 (180deg=-0.108) USER MOD Set 1.2: A 188 HIS : no HE2:sc= -0.132 K(o=-0.13,f=-1.2) USER MOD Set 2.1: A 123 ASN : amide:sc= -0.34 K(o=-0.31,f=-7.6!) USER MOD Set 2.2: A 199 TYR OH : rot -75:sc= 0.0347 USER MOD Set 3.1: A 113 MET CE :methyl -174:sc= -0.338 (180deg=-0.55) USER MOD Set 3.2: A 124 HIS : no HE2:sc= -0.708 X(o=-1,f=-1.4) USER MOD Set 4.1: A 106 LYS NZ :NH3+ 167:sc= -0.231 (180deg=-0.784) USER MOD Set 4.2: A 111 MET CE :methyl -123:sc= -7.97! (180deg=-10.4!) USER MOD Set 5.1: A 89 LYS NZ :NH3+ -155:sc= 0.763 (180deg=0) USER MOD Set 5.2: A 99 THR OG1 : rot 70:sc= 0.248 USER MOD Set 6.1: A 5 SER OG : rot 40:sc= 1.01 USER MOD Set 6.2: A 75 ASN : amide:sc= 0.627 K(o=1.6,f=0.34) USER MOD Single : A 0 THR OG1 : rot 180:sc=-9.01e-05 USER MOD Single : A 1 MET CE :methyl -139:sc= -1.19 (180deg=-3.81!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= -0.0366 USER MOD Single : A -5 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 15 LYS NZ :NH3+ 148:sc= 1.25 (180deg=0.907) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 154:sc= -1.74 (180deg=-1.97) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 82:sc= 0.265 USER MOD Single : A 24 MET CE :methyl 170:sc= 0 (180deg=-0.0513) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 77:sc= 0.649 USER MOD Single : A 31 MET CE :methyl 179:sc= -1.76 (180deg=-1.77) USER MOD Single : A 45 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 166:sc= -0.0353 (180deg=-0.324) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 1.25 (180deg=1.25) USER MOD Single : A 66 LYS NZ :NH3+ -149:sc= 0.542 (180deg=-2.39!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -159:sc= -0.196 (180deg=-0.833) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 142:sc= -1.15 (180deg=-4.64!) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 145:sc= 0.745 (180deg=-0.889) USER MOD Single : A 84 LYS NZ :NH3+ 156:sc= -0.253 (180deg=-1.03) USER MOD Single : A 85 GLN : amide:sc= 0.942 K(o=0.94,f=-4!) USER MOD Single : A 92 MET CE :methyl 176:sc= -3.56 (180deg=-3.72) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -109:sc= -1.23 (180deg=-3.42!) USER MOD Single : A 101 MET CE :methyl -159:sc= -0.474 (180deg=-1.77) USER MOD Single : A 105 SER OG : rot 180:sc= -0.215 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 114 THR OG1 : rot 75:sc= 0.11 USER MOD Single : A 116 CYS SG : rot -19:sc= -2.61! USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc=0.000282 USER MOD Single : A 137 LYS NZ :NH3+ 139:sc= 0.227 (180deg=-0.574) USER MOD Single : A 138 LYS NZ :NH3+ -167:sc= 1.58 (180deg=1.4) USER MOD Single : A 172 ASN : amide:sc= -0.896 K(o=-0.9,f=-3.6!) USER MOD Single : A 176 HIS : no HD1:sc= -7.66! C(o=-7.7!,f=-13!) USER MOD Single : A 179 THR OG1 : rot -154:sc= -3.98! USER MOD Single : A 183 GLN : amide:sc= -1.54 K(o=-1.5,f=-6.3!) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot -12:sc= 0.604 USER MOD Single : A 202 GLN : amide:sc= -0.155 X(o=-0.15,f=-0.29) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -28.982 -14.441 -1.759 1.00 10.08 N ATOM 2 CA GLY A -5 -30.210 -13.955 -2.430 1.00 9.65 C ATOM 3 C GLY A -5 -30.152 -12.471 -2.714 1.00 8.52 C ATOM 4 O GLY A -5 -29.654 -12.046 -3.759 1.00 8.35 O ATOM 0 H1 GLY A -5 -29.064 -15.463 -1.583 1.00 10.08 H new ATOM 0 H2 GLY A -5 -28.159 -14.259 -2.368 1.00 10.08 H new ATOM 0 H3 GLY A -5 -28.860 -13.942 -0.854 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -30.351 -14.498 -3.365 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -31.075 -14.170 -1.803 1.00 9.65 H new ATOM 10 N ILE A -4 -30.658 -11.679 -1.781 1.00 7.94 N ATOM 11 CA ILE A -4 -30.645 -10.230 -1.913 1.00 6.97 C ATOM 12 C ILE A -4 -29.699 -9.607 -0.895 1.00 6.09 C ATOM 13 O ILE A -4 -29.216 -10.287 0.013 1.00 5.96 O ATOM 14 CB ILE A -4 -32.055 -9.624 -1.723 1.00 7.12 C ATOM 15 CG1 ILE A -4 -32.641 -10.040 -0.369 1.00 7.77 C ATOM 16 CG2 ILE A -4 -32.972 -10.043 -2.864 1.00 7.21 C ATOM 17 CD1 ILE A -4 -33.999 -9.435 -0.076 1.00 8.21 C ATOM 0 H ILE A -4 -31.085 -12.018 -0.919 1.00 7.94 H new ATOM 0 HA ILE A -4 -30.302 -10.007 -2.923 1.00 6.97 H new ATOM 0 HB ILE A -4 -31.971 -8.537 -1.736 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -32.724 -11.126 -0.338 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -31.947 -9.751 0.420 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -33.960 -9.608 -2.715 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -32.560 -9.692 -3.810 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -33.053 -11.130 -2.885 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -34.347 -9.776 0.899 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -33.920 -8.348 -0.073 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -34.709 -9.745 -0.843 1.00 8.21 H new ATOM 29 N ASP A -3 -29.427 -8.324 -1.056 1.00 5.76 N ATOM 30 CA ASP A -3 -28.600 -7.594 -0.105 1.00 5.11 C ATOM 31 C ASP A -3 -29.413 -6.472 0.523 1.00 4.13 C ATOM 32 O ASP A -3 -29.805 -5.522 -0.157 1.00 4.11 O ATOM 33 CB ASP A -3 -27.342 -7.032 -0.777 1.00 5.67 C ATOM 34 CG ASP A -3 -26.321 -8.104 -1.110 1.00 6.72 C ATOM 35 OD1 ASP A -3 -25.547 -8.494 -0.210 1.00 7.33 O ATOM 36 OD2 ASP A -3 -26.278 -8.558 -2.275 1.00 7.08 O ATOM 0 H ASP A -3 -29.767 -7.763 -1.837 1.00 5.76 H new ATOM 0 HA ASP A -3 -28.277 -8.286 0.673 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -27.626 -6.512 -1.692 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -26.884 -6.293 -0.119 1.00 5.67 H new ATOM 41 N PRO A -2 -29.703 -6.589 1.827 1.00 3.75 N ATOM 42 CA PRO A -2 -30.540 -5.628 2.554 1.00 3.21 C ATOM 43 C PRO A -2 -29.876 -4.262 2.706 1.00 2.50 C ATOM 44 O PRO A -2 -28.904 -4.110 3.452 1.00 2.81 O ATOM 45 CB PRO A -2 -30.741 -6.282 3.932 1.00 3.86 C ATOM 46 CG PRO A -2 -30.292 -7.696 3.774 1.00 4.50 C ATOM 47 CD PRO A -2 -29.245 -7.677 2.702 1.00 4.43 C ATOM 0 HA PRO A -2 -31.471 -5.431 2.022 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -30.159 -5.769 4.698 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -31.786 -6.234 4.240 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -29.887 -8.084 4.709 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -31.125 -8.341 3.495 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -28.253 -7.480 3.108 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -29.190 -8.628 2.172 1.00 4.43 H new ATOM 55 N PHE A -1 -30.400 -3.273 1.991 1.00 2.13 N ATOM 56 CA PHE A -1 -29.883 -1.924 2.055 1.00 1.78 C ATOM 57 C PHE A -1 -30.994 -0.924 2.362 1.00 1.73 C ATOM 58 O PHE A -1 -31.566 -0.318 1.455 1.00 2.21 O ATOM 59 CB PHE A -1 -29.202 -1.543 0.741 1.00 2.13 C ATOM 60 CG PHE A -1 -27.959 -2.331 0.435 1.00 2.45 C ATOM 61 CD1 PHE A -1 -26.935 -2.430 1.363 1.00 2.78 C ATOM 62 CD2 PHE A -1 -27.812 -2.964 -0.788 1.00 2.89 C ATOM 63 CE1 PHE A -1 -25.789 -3.145 1.079 1.00 3.51 C ATOM 64 CE2 PHE A -1 -26.669 -3.682 -1.079 1.00 3.47 C ATOM 65 CZ PHE A -1 -25.656 -3.773 -0.144 1.00 3.78 C ATOM 0 H PHE A -1 -31.190 -3.389 1.356 1.00 2.13 H new ATOM 0 HA PHE A -1 -29.149 -1.892 2.861 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -29.913 -1.677 -0.075 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -28.948 -0.484 0.771 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -27.035 -1.941 2.321 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -28.601 -2.895 -1.523 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -24.998 -3.213 1.811 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -26.567 -4.172 -2.036 1.00 3.47 H new ATOM 0 HZ PHE A -1 -24.761 -4.334 -0.369 1.00 3.78 H new ATOM 75 N THR A 0 -31.332 -0.796 3.634 1.00 1.54 N ATOM 76 CA THR A 0 -32.232 0.257 4.087 1.00 1.59 C ATOM 77 C THR A 0 -31.406 1.436 4.592 1.00 1.40 C ATOM 78 O THR A 0 -30.252 1.600 4.187 1.00 1.49 O ATOM 79 CB THR A 0 -33.170 -0.246 5.203 1.00 1.75 C ATOM 80 OG1 THR A 0 -32.431 -1.027 6.153 1.00 1.70 O ATOM 81 CG2 THR A 0 -34.311 -1.074 4.630 1.00 2.11 C ATOM 0 H THR A 0 -30.996 -1.410 4.376 1.00 1.54 H new ATOM 0 HA THR A 0 -32.854 0.568 3.247 1.00 1.59 H new ATOM 0 HB THR A 0 -33.596 0.624 5.703 1.00 1.75 H new ATOM 0 HG1 THR A 0 -33.034 -1.341 6.859 1.00 1.70 H new ATOM 0 HG21 THR A 0 -34.956 -1.415 5.440 1.00 2.11 H new ATOM 0 HG22 THR A 0 -34.891 -0.464 3.937 1.00 2.11 H new ATOM 0 HG23 THR A 0 -33.905 -1.937 4.102 1.00 2.11 H new ATOM 89 N MET A 1 -31.970 2.254 5.476 1.00 1.38 N ATOM 90 CA MET A 1 -31.211 3.348 6.073 1.00 1.36 C ATOM 91 C MET A 1 -30.272 2.805 7.149 1.00 1.21 C ATOM 92 O MET A 1 -30.328 3.185 8.319 1.00 1.42 O ATOM 93 CB MET A 1 -32.137 4.421 6.658 1.00 1.66 C ATOM 94 CG MET A 1 -31.405 5.580 7.330 1.00 1.86 C ATOM 95 SD MET A 1 -30.649 6.740 6.163 1.00 2.09 S ATOM 96 CE MET A 1 -29.159 5.875 5.663 1.00 1.64 C ATOM 0 H MET A 1 -32.937 2.182 5.792 1.00 1.38 H new ATOM 0 HA MET A 1 -30.620 3.818 5.288 1.00 1.36 H new ATOM 0 HB2 MET A 1 -32.766 4.817 5.860 1.00 1.66 H new ATOM 0 HB3 MET A 1 -32.801 3.955 7.386 1.00 1.66 H new ATOM 0 HG2 MET A 1 -32.107 6.122 7.964 1.00 1.86 H new ATOM 0 HG3 MET A 1 -30.630 5.179 7.983 1.00 1.86 H new ATOM 0 HE1 MET A 1 -28.331 6.581 5.604 1.00 1.64 H new ATOM 0 HE2 MET A 1 -28.925 5.101 6.394 1.00 1.64 H new ATOM 0 HE3 MET A 1 -29.315 5.417 4.686 1.00 1.64 H new ATOM 106 N VAL A 2 -29.416 1.899 6.737 1.00 1.00 N ATOM 107 CA VAL A 2 -28.445 1.311 7.608 1.00 0.98 C ATOM 108 C VAL A 2 -27.395 0.640 6.736 1.00 0.79 C ATOM 109 O VAL A 2 -26.867 -0.431 7.017 1.00 0.92 O ATOM 110 CB VAL A 2 -29.121 0.347 8.610 1.00 1.21 C ATOM 111 CG1 VAL A 2 -29.437 -1.012 8.001 1.00 1.56 C ATOM 112 CG2 VAL A 2 -28.278 0.237 9.860 1.00 1.32 C ATOM 0 H VAL A 2 -29.380 1.552 5.779 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.954 2.065 8.224 1.00 0.98 H new ATOM 0 HB VAL A 2 -30.089 0.767 8.882 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -29.910 -1.646 8.751 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -30.113 -0.884 7.156 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -28.514 -1.481 7.660 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -28.758 -0.443 10.564 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -27.291 -0.146 9.601 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -28.177 1.221 10.318 1.00 1.32 H new ATOM 122 N ALA A 3 -27.087 1.349 5.673 1.00 0.66 N ATOM 123 CA ALA A 3 -26.142 0.927 4.677 1.00 0.55 C ATOM 124 C ALA A 3 -25.278 2.118 4.358 1.00 0.60 C ATOM 125 O ALA A 3 -25.703 3.259 4.543 1.00 1.10 O ATOM 126 CB ALA A 3 -26.850 0.429 3.425 1.00 0.63 C ATOM 0 H ALA A 3 -27.502 2.260 5.477 1.00 0.66 H new ATOM 0 HA ALA A 3 -25.541 0.098 5.050 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -26.110 0.116 2.688 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -27.488 -0.417 3.680 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -27.460 1.231 3.009 1.00 0.63 H new ATOM 132 N LEU A 4 -24.086 1.870 3.894 1.00 0.45 N ATOM 133 CA LEU A 4 -23.135 2.929 3.674 1.00 0.41 C ATOM 134 C LEU A 4 -22.866 3.090 2.190 1.00 0.39 C ATOM 135 O LEU A 4 -22.566 2.119 1.501 1.00 0.38 O ATOM 136 CB LEU A 4 -21.849 2.613 4.423 1.00 0.41 C ATOM 137 CG LEU A 4 -21.996 2.447 5.936 1.00 0.56 C ATOM 138 CD1 LEU A 4 -20.633 2.311 6.586 1.00 1.16 C ATOM 139 CD2 LEU A 4 -22.764 3.613 6.538 1.00 1.46 C ATOM 0 H LEU A 4 -23.746 0.938 3.659 1.00 0.45 H new ATOM 0 HA LEU A 4 -23.542 3.868 4.048 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -21.426 1.696 4.013 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -21.131 3.410 4.230 1.00 0.41 H new ATOM 0 HG LEU A 4 -22.564 1.536 6.127 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -20.754 2.194 7.663 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -20.122 1.438 6.181 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -20.042 3.204 6.382 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -22.855 3.471 7.615 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -22.230 4.542 6.338 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -23.758 3.662 6.093 1.00 1.46 H new ATOM 151 N SER A 5 -22.965 4.316 1.711 1.00 0.41 N ATOM 152 CA SER A 5 -22.785 4.593 0.299 1.00 0.42 C ATOM 153 C SER A 5 -21.340 5.001 0.056 1.00 0.37 C ATOM 154 O SER A 5 -20.943 6.134 0.349 1.00 0.42 O ATOM 155 CB SER A 5 -23.748 5.695 -0.150 1.00 0.51 C ATOM 156 OG SER A 5 -23.414 6.944 0.431 1.00 1.28 O ATOM 0 H SER A 5 -23.170 5.137 2.281 1.00 0.41 H new ATOM 0 HA SER A 5 -23.006 3.699 -0.285 1.00 0.42 H new ATOM 0 HB2 SER A 5 -23.725 5.780 -1.236 1.00 0.51 H new ATOM 0 HB3 SER A 5 -24.767 5.424 0.127 1.00 0.51 H new ATOM 0 HG SER A 5 -22.440 7.049 0.444 1.00 1.28 H new ATOM 162 N LEU A 6 -20.545 4.074 -0.439 1.00 0.31 N ATOM 163 CA LEU A 6 -19.123 4.311 -0.588 1.00 0.28 C ATOM 164 C LEU A 6 -18.752 4.413 -2.059 1.00 0.28 C ATOM 165 O LEU A 6 -19.239 3.640 -2.887 1.00 0.31 O ATOM 166 CB LEU A 6 -18.323 3.186 0.078 1.00 0.26 C ATOM 167 CG LEU A 6 -18.730 2.855 1.518 1.00 0.33 C ATOM 168 CD1 LEU A 6 -17.815 1.790 2.103 1.00 0.61 C ATOM 169 CD2 LEU A 6 -18.720 4.106 2.384 1.00 0.62 C ATOM 0 H LEU A 6 -20.858 3.152 -0.744 1.00 0.31 H new ATOM 0 HA LEU A 6 -18.879 5.254 -0.099 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -18.423 2.285 -0.526 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -17.268 3.459 0.070 1.00 0.26 H new ATOM 0 HG LEU A 6 -19.746 2.462 1.502 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -18.121 1.569 3.126 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -17.880 0.884 1.501 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -16.787 2.153 2.102 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -19.012 3.846 3.402 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -17.718 4.535 2.392 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -19.423 4.834 1.979 1.00 0.62 H new ATOM 181 N LYS A 7 -17.909 5.378 -2.388 1.00 0.29 N ATOM 182 CA LYS A 7 -17.397 5.488 -3.741 1.00 0.31 C ATOM 183 C LYS A 7 -16.175 4.612 -3.886 1.00 0.29 C ATOM 184 O LYS A 7 -15.112 4.935 -3.369 1.00 0.31 O ATOM 185 CB LYS A 7 -17.001 6.916 -4.096 1.00 0.39 C ATOM 186 CG LYS A 7 -18.111 7.937 -3.991 1.00 0.52 C ATOM 187 CD LYS A 7 -17.666 9.244 -4.617 1.00 0.63 C ATOM 188 CE LYS A 7 -17.962 9.282 -6.106 1.00 0.94 C ATOM 189 NZ LYS A 7 -17.453 10.526 -6.741 1.00 1.72 N ATOM 0 H LYS A 7 -17.568 6.090 -1.742 1.00 0.29 H new ATOM 0 HA LYS A 7 -18.195 5.174 -4.414 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -16.184 7.223 -3.443 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -16.615 6.926 -5.115 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -19.005 7.568 -4.493 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -18.375 8.095 -2.945 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -18.171 10.074 -4.124 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -16.597 9.380 -4.455 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -17.508 8.416 -6.588 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -19.038 9.208 -6.264 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -17.675 10.513 -7.757 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -17.905 11.352 -6.298 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -16.423 10.585 -6.613 1.00 1.72 H new ATOM 203 N ILE A 8 -16.316 3.515 -4.587 1.00 0.28 N ATOM 204 CA ILE A 8 -15.202 2.622 -4.797 1.00 0.28 C ATOM 205 C ILE A 8 -14.459 3.043 -6.055 1.00 0.31 C ATOM 206 O ILE A 8 -14.927 2.836 -7.174 1.00 0.34 O ATOM 207 CB ILE A 8 -15.643 1.135 -4.879 1.00 0.33 C ATOM 208 CG1 ILE A 8 -15.806 0.537 -3.473 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.641 0.309 -5.676 1.00 0.32 C ATOM 210 CD1 ILE A 8 -16.903 1.162 -2.640 1.00 0.51 C ATOM 0 H ILE A 8 -17.190 3.218 -5.022 1.00 0.28 H new ATOM 0 HA ILE A 8 -14.537 2.694 -3.936 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.605 1.105 -5.391 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -16.005 -0.530 -3.569 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -14.861 0.638 -2.939 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -14.975 -0.728 -5.717 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -14.565 0.706 -6.688 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -13.665 0.357 -5.194 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.942 0.675 -1.666 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -16.698 2.224 -2.507 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -17.860 1.037 -3.146 1.00 0.51 H new ATOM 222 N SER A 9 -13.326 3.688 -5.865 1.00 0.33 N ATOM 223 CA SER A 9 -12.507 4.108 -6.981 1.00 0.39 C ATOM 224 C SER A 9 -11.416 3.078 -7.212 1.00 0.37 C ATOM 225 O SER A 9 -10.785 2.612 -6.268 1.00 0.45 O ATOM 226 CB SER A 9 -11.911 5.493 -6.717 1.00 0.46 C ATOM 227 OG SER A 9 -12.928 6.430 -6.409 1.00 1.48 O ATOM 0 H SER A 9 -12.952 3.932 -4.948 1.00 0.33 H new ATOM 0 HA SER A 9 -13.121 4.181 -7.879 1.00 0.39 H new ATOM 0 HB2 SER A 9 -11.201 5.437 -5.892 1.00 0.46 H new ATOM 0 HB3 SER A 9 -11.356 5.828 -7.593 1.00 0.46 H new ATOM 0 HG SER A 9 -12.525 7.307 -6.242 1.00 1.48 H new ATOM 233 N ILE A 10 -11.235 2.683 -8.456 1.00 0.40 N ATOM 234 CA ILE A 10 -10.254 1.671 -8.800 1.00 0.42 C ATOM 235 C ILE A 10 -9.365 2.171 -9.931 1.00 0.50 C ATOM 236 O ILE A 10 -9.712 2.060 -11.109 1.00 0.53 O ATOM 237 CB ILE A 10 -10.946 0.354 -9.214 1.00 0.40 C ATOM 238 CG1 ILE A 10 -11.936 -0.078 -8.127 1.00 0.38 C ATOM 239 CG2 ILE A 10 -9.913 -0.740 -9.459 1.00 0.45 C ATOM 240 CD1 ILE A 10 -12.923 -1.130 -8.578 1.00 0.43 C ATOM 0 H ILE A 10 -11.758 3.050 -9.251 1.00 0.40 H new ATOM 0 HA ILE A 10 -9.640 1.474 -7.921 1.00 0.42 H new ATOM 0 HB ILE A 10 -11.492 0.521 -10.143 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -11.378 -0.461 -7.273 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -12.486 0.798 -7.782 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -10.420 -1.660 -9.750 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -9.237 -0.430 -10.256 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -9.342 -0.913 -8.546 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -13.589 -1.382 -7.752 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -13.509 -0.745 -9.412 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -12.384 -2.023 -8.895 1.00 0.43 H new ATOM 252 N GLY A 11 -8.236 2.757 -9.562 1.00 0.59 N ATOM 253 CA GLY A 11 -7.324 3.297 -10.546 1.00 0.68 C ATOM 254 C GLY A 11 -7.831 4.596 -11.142 1.00 0.75 C ATOM 255 O GLY A 11 -7.512 5.679 -10.654 1.00 0.96 O ATOM 0 H GLY A 11 -7.935 2.868 -8.594 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -6.351 3.466 -10.084 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -7.176 2.567 -11.342 1.00 0.68 H new ATOM 259 N ASN A 12 -8.634 4.485 -12.189 1.00 0.75 N ATOM 260 CA ASN A 12 -9.167 5.656 -12.877 1.00 0.90 C ATOM 261 C ASN A 12 -10.692 5.681 -12.808 1.00 0.84 C ATOM 262 O ASN A 12 -11.316 6.726 -12.997 1.00 1.09 O ATOM 263 CB ASN A 12 -8.714 5.667 -14.342 1.00 1.09 C ATOM 264 CG ASN A 12 -9.344 4.564 -15.163 1.00 1.77 C ATOM 265 OD1 ASN A 12 -10.434 4.715 -15.715 1.00 2.62 O ATOM 266 ND2 ASN A 12 -8.642 3.463 -15.260 1.00 2.17 N ATOM 0 H ASN A 12 -8.933 3.593 -12.584 1.00 0.75 H new ATOM 0 HA ASN A 12 -8.781 6.544 -12.377 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -8.963 6.631 -14.786 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -7.629 5.568 -14.382 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -8.994 2.681 -15.813 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -7.744 3.387 -14.783 1.00 2.17 H new ATOM 273 N VAL A 13 -11.286 4.529 -12.538 1.00 0.65 N ATOM 274 CA VAL A 13 -12.738 4.404 -12.517 1.00 0.61 C ATOM 275 C VAL A 13 -13.255 4.506 -11.081 1.00 0.53 C ATOM 276 O VAL A 13 -12.491 4.345 -10.131 1.00 0.50 O ATOM 277 CB VAL A 13 -13.181 3.061 -13.158 1.00 0.61 C ATOM 278 CG1 VAL A 13 -12.790 1.877 -12.286 1.00 0.55 C ATOM 279 CG2 VAL A 13 -14.675 3.047 -13.450 1.00 0.65 C ATOM 0 H VAL A 13 -10.785 3.665 -12.330 1.00 0.65 H new ATOM 0 HA VAL A 13 -13.164 5.219 -13.102 1.00 0.61 H new ATOM 0 HB VAL A 13 -12.655 2.968 -14.108 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -13.114 0.952 -12.762 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -11.708 1.860 -12.159 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -13.268 1.970 -11.311 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -14.949 2.092 -13.898 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -15.229 3.184 -12.521 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -14.918 3.855 -14.140 1.00 0.65 H new ATOM 289 N VAL A 14 -14.543 4.781 -10.925 1.00 0.51 N ATOM 290 CA VAL A 14 -15.155 4.852 -9.607 1.00 0.46 C ATOM 291 C VAL A 14 -16.615 4.409 -9.668 1.00 0.41 C ATOM 292 O VAL A 14 -17.408 4.903 -10.474 1.00 0.45 O ATOM 293 CB VAL A 14 -15.022 6.261 -8.964 1.00 0.53 C ATOM 294 CG1 VAL A 14 -15.391 7.356 -9.945 1.00 0.62 C ATOM 295 CG2 VAL A 14 -15.866 6.373 -7.695 1.00 0.50 C ATOM 0 H VAL A 14 -15.185 4.959 -11.698 1.00 0.51 H new ATOM 0 HA VAL A 14 -14.609 4.164 -8.962 1.00 0.46 H new ATOM 0 HB VAL A 14 -13.975 6.393 -8.690 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -15.287 8.328 -9.462 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -14.729 7.308 -10.810 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -16.423 7.221 -10.270 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -15.752 7.370 -7.269 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -16.914 6.201 -7.939 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -15.535 5.629 -6.971 1.00 0.50 H new ATOM 305 N LYS A 15 -16.950 3.467 -8.806 1.00 0.39 N ATOM 306 CA LYS A 15 -18.274 2.873 -8.766 1.00 0.41 C ATOM 307 C LYS A 15 -18.910 3.147 -7.412 1.00 0.35 C ATOM 308 O LYS A 15 -18.216 3.221 -6.403 1.00 0.31 O ATOM 309 CB LYS A 15 -18.203 1.361 -9.023 1.00 0.50 C ATOM 310 CG LYS A 15 -17.783 0.984 -10.440 1.00 0.67 C ATOM 311 CD LYS A 15 -18.726 1.581 -11.475 1.00 0.80 C ATOM 312 CE LYS A 15 -18.404 1.114 -12.888 1.00 1.02 C ATOM 313 NZ LYS A 15 -18.753 -0.316 -13.107 1.00 1.28 N ATOM 0 H LYS A 15 -16.307 3.090 -8.109 1.00 0.39 H new ATOM 0 HA LYS A 15 -18.884 3.320 -9.551 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.500 0.917 -8.318 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -19.180 0.923 -8.818 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -16.768 1.334 -10.626 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -17.769 -0.101 -10.541 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -19.752 1.307 -11.229 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -18.667 2.669 -11.432 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -18.947 1.731 -13.604 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -17.341 1.260 -13.082 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -19.040 -0.456 -14.097 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -17.926 -0.911 -12.899 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -19.538 -0.582 -12.479 1.00 1.28 H new ATOM 327 N THR A 16 -20.215 3.312 -7.388 1.00 0.38 N ATOM 328 CA THR A 16 -20.908 3.626 -6.153 1.00 0.37 C ATOM 329 C THR A 16 -21.567 2.369 -5.615 1.00 0.35 C ATOM 330 O THR A 16 -22.489 1.827 -6.226 1.00 0.39 O ATOM 331 CB THR A 16 -21.955 4.733 -6.368 1.00 0.45 C ATOM 332 OG1 THR A 16 -21.360 5.807 -7.109 1.00 0.50 O ATOM 333 CG2 THR A 16 -22.469 5.262 -5.038 1.00 0.45 C ATOM 0 H THR A 16 -20.818 3.235 -8.207 1.00 0.38 H new ATOM 0 HA THR A 16 -20.183 3.996 -5.428 1.00 0.37 H new ATOM 0 HB THR A 16 -22.796 4.314 -6.920 1.00 0.45 H new ATOM 0 HG1 THR A 16 -22.024 6.514 -7.250 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.208 6.043 -5.218 1.00 0.45 H new ATOM 0 HG22 THR A 16 -22.930 4.449 -4.477 1.00 0.45 H new ATOM 0 HG23 THR A 16 -21.638 5.673 -4.465 1.00 0.45 H new ATOM 341 N MET A 17 -21.071 1.887 -4.489 1.00 0.31 N ATOM 342 CA MET A 17 -21.526 0.626 -3.940 1.00 0.32 C ATOM 343 C MET A 17 -21.822 0.787 -2.464 1.00 0.32 C ATOM 344 O MET A 17 -21.203 1.610 -1.787 1.00 0.31 O ATOM 345 CB MET A 17 -20.479 -0.464 -4.172 1.00 0.34 C ATOM 346 CG MET A 17 -21.035 -1.695 -4.867 1.00 0.44 C ATOM 347 SD MET A 17 -21.835 -2.857 -3.738 1.00 1.04 S ATOM 348 CE MET A 17 -20.418 -3.550 -2.884 1.00 0.40 C ATOM 0 H MET A 17 -20.351 2.353 -3.937 1.00 0.31 H new ATOM 0 HA MET A 17 -22.443 0.325 -4.447 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.665 -0.054 -4.770 1.00 0.34 H new ATOM 0 HB3 MET A 17 -20.053 -0.758 -3.213 1.00 0.34 H new ATOM 0 HG2 MET A 17 -21.754 -1.382 -5.624 1.00 0.44 H new ATOM 0 HG3 MET A 17 -20.225 -2.206 -5.388 1.00 0.44 H new ATOM 0 HE1 MET A 17 -20.723 -3.901 -1.898 1.00 0.40 H new ATOM 0 HE2 MET A 17 -20.019 -4.385 -3.459 1.00 0.40 H new ATOM 0 HE3 MET A 17 -19.649 -2.785 -2.774 1.00 0.40 H new ATOM 358 N GLN A 18 -22.764 0.017 -1.966 1.00 0.36 N ATOM 359 CA GLN A 18 -23.146 0.119 -0.576 1.00 0.37 C ATOM 360 C GLN A 18 -22.726 -1.108 0.204 1.00 0.35 C ATOM 361 O GLN A 18 -22.734 -2.229 -0.309 1.00 0.38 O ATOM 362 CB GLN A 18 -24.645 0.350 -0.453 1.00 0.44 C ATOM 363 CG GLN A 18 -25.042 1.759 -0.836 1.00 0.49 C ATOM 364 CD GLN A 18 -26.490 1.868 -1.257 1.00 0.59 C ATOM 365 OE1 GLN A 18 -27.358 1.163 -0.739 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.752 2.713 -2.238 1.00 0.60 N ATOM 0 H GLN A 18 -23.277 -0.684 -2.501 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.626 0.975 -0.147 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -25.173 -0.360 -1.090 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -24.958 0.153 0.572 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -24.863 2.424 0.009 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -24.405 2.102 -1.651 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -26.003 3.278 -2.638 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.703 2.801 -2.595 1.00 0.60 H new ATOM 375 N PHE A 19 -22.347 -0.878 1.441 1.00 0.34 N ATOM 376 CA PHE A 19 -21.959 -1.928 2.354 1.00 0.33 C ATOM 377 C PHE A 19 -22.723 -1.714 3.642 1.00 0.37 C ATOM 378 O PHE A 19 -23.212 -0.616 3.890 1.00 0.40 O ATOM 379 CB PHE A 19 -20.457 -1.873 2.646 1.00 0.29 C ATOM 380 CG PHE A 19 -19.584 -2.169 1.463 1.00 0.27 C ATOM 381 CD1 PHE A 19 -19.205 -3.469 1.169 1.00 0.33 C ATOM 382 CD2 PHE A 19 -19.152 -1.146 0.641 1.00 0.30 C ATOM 383 CE1 PHE A 19 -18.409 -3.741 0.074 1.00 0.36 C ATOM 384 CE2 PHE A 19 -18.355 -1.412 -0.457 1.00 0.31 C ATOM 385 CZ PHE A 19 -17.951 -2.722 -0.715 1.00 0.31 C ATOM 0 H PHE A 19 -22.299 0.057 1.846 1.00 0.34 H new ATOM 0 HA PHE A 19 -22.182 -2.900 1.913 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -20.209 -0.882 3.026 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -20.227 -2.585 3.439 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.536 -4.278 1.803 1.00 0.33 H new ATOM 0 HD2 PHE A 19 -19.440 -0.128 0.858 1.00 0.30 H new ATOM 0 HE1 PHE A 19 -18.147 -4.762 -0.160 1.00 0.36 H new ATOM 0 HE2 PHE A 19 -18.047 -0.610 -1.111 1.00 0.31 H new ATOM 0 HZ PHE A 19 -17.279 -2.931 -1.534 1.00 0.31 H new ATOM 395 N GLU A 20 -22.848 -2.744 4.442 1.00 0.39 N ATOM 396 CA GLU A 20 -23.460 -2.595 5.747 1.00 0.43 C ATOM 397 C GLU A 20 -22.473 -1.908 6.689 1.00 0.44 C ATOM 398 O GLU A 20 -21.267 -1.921 6.438 1.00 0.47 O ATOM 399 CB GLU A 20 -23.894 -3.958 6.282 1.00 0.50 C ATOM 400 CG GLU A 20 -24.981 -4.604 5.439 1.00 0.61 C ATOM 401 CD GLU A 20 -25.433 -5.937 5.990 1.00 0.90 C ATOM 402 OE1 GLU A 20 -24.745 -6.949 5.741 1.00 1.06 O ATOM 403 OE2 GLU A 20 -26.474 -5.978 6.680 1.00 1.42 O ATOM 0 H GLU A 20 -22.538 -3.690 4.219 1.00 0.39 H new ATOM 0 HA GLU A 20 -24.353 -1.974 5.671 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -23.029 -4.620 6.320 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -24.254 -3.844 7.305 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -25.837 -3.931 5.380 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -24.613 -4.742 4.422 1.00 0.61 H new ATOM 410 N PRO A 21 -22.968 -1.281 7.767 1.00 0.50 N ATOM 411 CA PRO A 21 -22.123 -0.535 8.698 1.00 0.53 C ATOM 412 C PRO A 21 -20.963 -1.380 9.199 1.00 0.53 C ATOM 413 O PRO A 21 -19.821 -0.918 9.275 1.00 0.65 O ATOM 414 CB PRO A 21 -23.061 -0.165 9.849 1.00 0.57 C ATOM 415 CG PRO A 21 -24.442 -0.286 9.300 1.00 0.61 C ATOM 416 CD PRO A 21 -24.381 -1.260 8.157 1.00 0.62 C ATOM 0 HA PRO A 21 -21.670 0.338 8.227 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -22.918 -0.831 10.700 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -22.867 0.848 10.202 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -25.132 -0.636 10.068 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.808 0.683 8.961 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -24.724 -2.249 8.460 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -25.016 -0.942 7.330 1.00 0.62 H new ATOM 424 N SER A 22 -21.255 -2.627 9.524 1.00 0.50 N ATOM 425 CA SER A 22 -20.216 -3.555 9.896 1.00 0.61 C ATOM 426 C SER A 22 -19.436 -3.989 8.654 1.00 0.84 C ATOM 427 O SER A 22 -18.357 -3.450 8.384 1.00 1.64 O ATOM 428 CB SER A 22 -20.813 -4.766 10.616 1.00 0.68 C ATOM 429 OG SER A 22 -21.545 -4.364 11.764 1.00 1.32 O ATOM 0 H SER A 22 -22.199 -3.013 9.536 1.00 0.50 H new ATOM 0 HA SER A 22 -19.528 -3.061 10.582 1.00 0.61 H new ATOM 0 HB2 SER A 22 -21.467 -5.312 9.936 1.00 0.68 H new ATOM 0 HB3 SER A 22 -20.016 -5.449 10.909 1.00 0.68 H new ATOM 0 HG SER A 22 -21.919 -5.154 12.207 1.00 1.32 H new ATOM 435 N THR A 23 -20.050 -4.881 7.865 1.00 0.41 N ATOM 436 CA THR A 23 -19.410 -5.574 6.746 1.00 0.49 C ATOM 437 C THR A 23 -18.039 -6.161 7.099 1.00 0.63 C ATOM 438 O THR A 23 -17.905 -7.378 7.189 1.00 1.47 O ATOM 439 CB THR A 23 -19.310 -4.675 5.506 1.00 0.51 C ATOM 440 OG1 THR A 23 -20.627 -4.349 5.053 1.00 0.68 O ATOM 441 CG2 THR A 23 -18.563 -5.374 4.392 1.00 0.50 C ATOM 0 H THR A 23 -21.027 -5.145 7.992 1.00 0.41 H new ATOM 0 HA THR A 23 -20.061 -6.417 6.513 1.00 0.49 H new ATOM 0 HB THR A 23 -18.767 -3.770 5.777 1.00 0.51 H new ATOM 0 HG1 THR A 23 -20.983 -3.608 5.587 1.00 0.68 H new ATOM 0 HG21 THR A 23 -18.505 -4.717 3.524 1.00 0.50 H new ATOM 0 HG22 THR A 23 -17.556 -5.621 4.728 1.00 0.50 H new ATOM 0 HG23 THR A 23 -19.089 -6.289 4.120 1.00 0.50 H new ATOM 449 N MET A 24 -17.054 -5.282 7.305 1.00 0.54 N ATOM 450 CA MET A 24 -15.671 -5.648 7.604 1.00 0.48 C ATOM 451 C MET A 24 -14.897 -5.868 6.311 1.00 0.43 C ATOM 452 O MET A 24 -15.415 -6.439 5.357 1.00 0.47 O ATOM 453 CB MET A 24 -15.592 -6.871 8.523 1.00 0.60 C ATOM 454 CG MET A 24 -14.484 -6.789 9.549 1.00 0.57 C ATOM 455 SD MET A 24 -14.729 -7.934 10.915 1.00 0.83 S ATOM 456 CE MET A 24 -13.641 -7.203 12.128 1.00 0.71 C ATOM 0 H MET A 24 -17.202 -4.273 7.267 1.00 0.54 H new ATOM 0 HA MET A 24 -15.210 -4.822 8.145 1.00 0.48 H new ATOM 0 HB2 MET A 24 -16.545 -6.989 9.039 1.00 0.60 H new ATOM 0 HB3 MET A 24 -15.446 -7.763 7.914 1.00 0.60 H new ATOM 0 HG2 MET A 24 -13.530 -7.001 9.067 1.00 0.57 H new ATOM 0 HG3 MET A 24 -14.426 -5.772 9.937 1.00 0.57 H new ATOM 0 HE1 MET A 24 -13.802 -7.680 13.095 1.00 0.71 H new ATOM 0 HE2 MET A 24 -12.605 -7.346 11.821 1.00 0.71 H new ATOM 0 HE3 MET A 24 -13.851 -6.137 12.210 1.00 0.71 H new ATOM 466 N VAL A 25 -13.671 -5.357 6.289 1.00 0.40 N ATOM 467 CA VAL A 25 -12.815 -5.378 5.098 1.00 0.38 C ATOM 468 C VAL A 25 -12.865 -6.703 4.330 1.00 0.39 C ATOM 469 O VAL A 25 -13.104 -6.706 3.124 1.00 0.39 O ATOM 470 CB VAL A 25 -11.359 -5.044 5.466 1.00 0.41 C ATOM 471 CG1 VAL A 25 -10.405 -5.359 4.321 1.00 0.42 C ATOM 472 CG2 VAL A 25 -11.257 -3.580 5.847 1.00 0.40 C ATOM 0 H VAL A 25 -13.237 -4.913 7.098 1.00 0.40 H new ATOM 0 HA VAL A 25 -13.214 -4.612 4.433 1.00 0.38 H new ATOM 0 HB VAL A 25 -11.069 -5.665 6.314 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -9.386 -5.110 4.618 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -10.464 -6.420 4.080 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.682 -4.772 3.445 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -10.226 -3.343 6.108 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.570 -2.962 5.005 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -11.902 -3.381 6.702 1.00 0.40 H new ATOM 482 N TYR A 26 -12.642 -7.814 5.023 1.00 0.42 N ATOM 483 CA TYR A 26 -12.617 -9.119 4.362 1.00 0.45 C ATOM 484 C TYR A 26 -13.959 -9.434 3.687 1.00 0.43 C ATOM 485 O TYR A 26 -14.002 -10.086 2.644 1.00 0.42 O ATOM 486 CB TYR A 26 -12.221 -10.238 5.337 1.00 0.52 C ATOM 487 CG TYR A 26 -13.255 -10.566 6.392 1.00 0.56 C ATOM 488 CD1 TYR A 26 -14.228 -11.532 6.159 1.00 0.70 C ATOM 489 CD2 TYR A 26 -13.248 -9.926 7.622 1.00 0.58 C ATOM 490 CE1 TYR A 26 -15.165 -11.847 7.123 1.00 0.78 C ATOM 491 CE2 TYR A 26 -14.184 -10.235 8.589 1.00 0.65 C ATOM 492 CZ TYR A 26 -15.138 -11.194 8.335 1.00 0.72 C ATOM 493 OH TYR A 26 -16.068 -11.506 9.297 1.00 0.83 O ATOM 0 H TYR A 26 -12.478 -7.841 6.029 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.855 -9.069 3.584 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -12.011 -11.141 4.764 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -11.294 -9.954 5.835 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -14.251 -12.044 5.208 1.00 0.70 H new ATOM 0 HD2 TYR A 26 -12.500 -9.175 7.827 1.00 0.58 H new ATOM 0 HE1 TYR A 26 -15.914 -12.600 6.928 1.00 0.78 H new ATOM 0 HE2 TYR A 26 -14.168 -9.726 9.541 1.00 0.65 H new ATOM 0 HH TYR A 26 -15.911 -10.957 10.094 1.00 0.83 H new ATOM 503 N ASP A 27 -15.046 -8.955 4.279 1.00 0.43 N ATOM 504 CA ASP A 27 -16.380 -9.181 3.732 1.00 0.44 C ATOM 505 C ASP A 27 -16.627 -8.231 2.562 1.00 0.39 C ATOM 506 O ASP A 27 -17.222 -8.598 1.552 1.00 0.40 O ATOM 507 CB ASP A 27 -17.441 -8.980 4.816 1.00 0.50 C ATOM 508 CG ASP A 27 -18.782 -9.601 4.473 1.00 0.91 C ATOM 509 OD1 ASP A 27 -19.113 -9.682 3.269 1.00 1.48 O ATOM 510 OD2 ASP A 27 -19.530 -9.977 5.392 1.00 1.24 O ATOM 0 H ASP A 27 -15.031 -8.407 5.139 1.00 0.43 H new ATOM 0 HA ASP A 27 -16.447 -10.208 3.373 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -17.080 -9.409 5.751 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -17.577 -7.912 4.986 1.00 0.50 H new ATOM 515 N ALA A 28 -16.159 -7.001 2.699 1.00 0.37 N ATOM 516 CA ALA A 28 -16.288 -6.018 1.636 1.00 0.33 C ATOM 517 C ALA A 28 -15.570 -6.500 0.387 1.00 0.32 C ATOM 518 O ALA A 28 -16.126 -6.485 -0.711 1.00 0.31 O ATOM 519 CB ALA A 28 -15.732 -4.676 2.088 1.00 0.33 C ATOM 0 H ALA A 28 -15.686 -6.660 3.536 1.00 0.37 H new ATOM 0 HA ALA A 28 -17.345 -5.891 1.401 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -15.835 -3.949 1.282 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -16.284 -4.329 2.962 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.678 -4.786 2.344 1.00 0.33 H new ATOM 525 N CYS A 29 -14.341 -6.952 0.590 1.00 0.35 N ATOM 526 CA CYS A 29 -13.485 -7.444 -0.481 1.00 0.37 C ATOM 527 C CYS A 29 -14.141 -8.562 -1.300 1.00 0.38 C ATOM 528 O CYS A 29 -13.904 -8.670 -2.504 1.00 0.40 O ATOM 529 CB CYS A 29 -12.168 -7.931 0.119 1.00 0.45 C ATOM 530 SG CYS A 29 -11.142 -6.613 0.810 1.00 1.37 S ATOM 0 H CYS A 29 -13.905 -6.988 1.512 1.00 0.35 H new ATOM 0 HA CYS A 29 -13.307 -6.619 -1.171 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -12.384 -8.657 0.902 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -11.601 -8.453 -0.652 1.00 0.45 H new ATOM 0 HG CYS A 29 -11.625 -6.245 1.960 1.00 1.37 H new ATOM 536 N ARG A 30 -14.975 -9.380 -0.664 1.00 0.40 N ATOM 537 CA ARG A 30 -15.600 -10.488 -1.378 1.00 0.44 C ATOM 538 C ARG A 30 -16.790 -10.017 -2.206 1.00 0.42 C ATOM 539 O ARG A 30 -16.958 -10.442 -3.350 1.00 0.45 O ATOM 540 CB ARG A 30 -16.002 -11.644 -0.448 1.00 0.49 C ATOM 541 CG ARG A 30 -16.886 -11.260 0.726 1.00 0.53 C ATOM 542 CD ARG A 30 -17.455 -12.494 1.406 1.00 0.71 C ATOM 543 NE ARG A 30 -18.232 -12.159 2.597 1.00 1.12 N ATOM 544 CZ ARG A 30 -18.607 -13.048 3.517 1.00 1.68 C ATOM 545 NH1 ARG A 30 -18.288 -14.330 3.381 1.00 1.94 N ATOM 546 NH2 ARG A 30 -19.301 -12.654 4.578 1.00 2.41 N ATOM 0 H ARG A 30 -15.229 -9.301 0.321 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.843 -10.878 -2.058 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -16.520 -12.400 -1.039 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -15.095 -12.108 -0.061 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -16.309 -10.678 1.445 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -17.700 -10.623 0.380 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -18.087 -13.036 0.702 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -16.640 -13.163 1.682 1.00 0.71 H new ATOM 0 HE ARG A 30 -18.504 -11.185 2.733 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -17.753 -14.639 2.569 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -18.578 -15.005 4.088 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -19.548 -11.671 4.690 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -19.588 -13.335 5.281 1.00 2.41 H new ATOM 560 N MET A 31 -17.601 -9.127 -1.648 1.00 0.39 N ATOM 561 CA MET A 31 -18.774 -8.628 -2.353 1.00 0.40 C ATOM 562 C MET A 31 -18.392 -7.651 -3.455 1.00 0.38 C ATOM 563 O MET A 31 -18.990 -7.658 -4.527 1.00 0.44 O ATOM 564 CB MET A 31 -19.738 -7.956 -1.386 1.00 0.39 C ATOM 565 CG MET A 31 -20.175 -8.863 -0.254 1.00 0.43 C ATOM 566 SD MET A 31 -21.229 -8.016 0.931 1.00 0.45 S ATOM 567 CE MET A 31 -20.052 -6.820 1.545 1.00 0.39 C ATOM 0 H MET A 31 -17.469 -8.738 -0.714 1.00 0.39 H new ATOM 0 HA MET A 31 -19.264 -9.487 -2.811 1.00 0.40 H new ATOM 0 HB2 MET A 31 -19.264 -7.067 -0.969 1.00 0.39 H new ATOM 0 HB3 MET A 31 -20.618 -7.620 -1.935 1.00 0.39 H new ATOM 0 HG2 MET A 31 -20.709 -9.720 -0.664 1.00 0.43 H new ATOM 0 HG3 MET A 31 -19.295 -9.251 0.258 1.00 0.43 H new ATOM 0 HE1 MET A 31 -20.534 -6.183 2.287 1.00 0.39 H new ATOM 0 HE2 MET A 31 -19.211 -7.340 2.004 1.00 0.39 H new ATOM 0 HE3 MET A 31 -19.692 -6.206 0.719 1.00 0.39 H new ATOM 577 N ILE A 32 -17.398 -6.813 -3.195 1.00 0.34 N ATOM 578 CA ILE A 32 -16.971 -5.831 -4.183 1.00 0.33 C ATOM 579 C ILE A 32 -16.410 -6.536 -5.420 1.00 0.36 C ATOM 580 O ILE A 32 -16.758 -6.195 -6.544 1.00 0.40 O ATOM 581 CB ILE A 32 -15.936 -4.840 -3.594 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.651 -3.723 -4.591 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.642 -5.540 -3.204 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.675 -2.700 -4.070 1.00 0.48 C ATOM 0 H ILE A 32 -16.877 -6.792 -2.318 1.00 0.34 H new ATOM 0 HA ILE A 32 -17.844 -5.248 -4.477 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.366 -4.413 -2.688 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -15.257 -4.157 -5.510 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.586 -3.226 -4.848 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -13.943 -4.811 -2.795 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.852 -6.301 -2.453 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -14.203 -6.010 -4.084 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.514 -1.932 -4.827 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -15.077 -2.241 -3.167 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.727 -3.186 -3.839 1.00 0.48 H new ATOM 596 N ARG A 33 -15.565 -7.535 -5.185 1.00 0.36 N ATOM 597 CA ARG A 33 -15.028 -8.384 -6.245 1.00 0.41 C ATOM 598 C ARG A 33 -16.157 -9.091 -6.994 1.00 0.45 C ATOM 599 O ARG A 33 -16.045 -9.405 -8.179 1.00 0.49 O ATOM 600 CB ARG A 33 -14.089 -9.423 -5.628 1.00 0.45 C ATOM 601 CG ARG A 33 -13.276 -10.211 -6.639 1.00 1.01 C ATOM 602 CD ARG A 33 -12.596 -11.406 -5.988 1.00 0.94 C ATOM 603 NE ARG A 33 -11.854 -11.038 -4.778 1.00 0.64 N ATOM 604 CZ ARG A 33 -10.987 -11.845 -4.166 1.00 0.84 C ATOM 605 NH1 ARG A 33 -10.709 -13.039 -4.676 1.00 1.32 N ATOM 606 NH2 ARG A 33 -10.378 -11.453 -3.055 1.00 1.22 N ATOM 0 H ARG A 33 -15.232 -7.780 -4.252 1.00 0.36 H new ATOM 0 HA ARG A 33 -14.481 -7.762 -6.954 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -13.406 -8.918 -4.945 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -14.679 -10.119 -5.032 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -13.926 -10.553 -7.444 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -12.524 -9.563 -7.090 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -13.347 -12.155 -5.736 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -11.914 -11.866 -6.703 1.00 0.94 H new ATOM 0 HE ARG A 33 -12.010 -10.111 -4.382 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -11.159 -13.342 -5.539 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -10.045 -13.653 -4.204 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -10.572 -10.531 -2.665 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -9.715 -12.074 -2.590 1.00 1.22 H new ATOM 620 N GLU A 34 -17.242 -9.327 -6.277 1.00 0.46 N ATOM 621 CA GLU A 34 -18.367 -10.083 -6.806 1.00 0.51 C ATOM 622 C GLU A 34 -19.178 -9.253 -7.799 1.00 0.50 C ATOM 623 O GLU A 34 -19.295 -9.610 -8.972 1.00 0.54 O ATOM 624 CB GLU A 34 -19.256 -10.543 -5.652 1.00 0.55 C ATOM 625 CG GLU A 34 -20.492 -11.305 -6.082 1.00 0.90 C ATOM 626 CD GLU A 34 -21.332 -11.733 -4.902 1.00 1.51 C ATOM 627 OE1 GLU A 34 -21.092 -12.835 -4.367 1.00 1.50 O ATOM 628 OE2 GLU A 34 -22.233 -10.969 -4.503 1.00 2.40 O ATOM 0 H GLU A 34 -17.369 -9.003 -5.318 1.00 0.46 H new ATOM 0 HA GLU A 34 -17.980 -10.951 -7.340 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -18.668 -11.174 -4.985 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -19.564 -9.670 -5.076 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -21.090 -10.681 -6.745 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -20.195 -12.184 -6.654 1.00 0.90 H new ATOM 635 N ARG A 35 -19.725 -8.140 -7.328 1.00 0.51 N ATOM 636 CA ARG A 35 -20.598 -7.312 -8.154 1.00 0.55 C ATOM 637 C ARG A 35 -19.819 -6.346 -9.047 1.00 0.49 C ATOM 638 O ARG A 35 -20.264 -6.025 -10.147 1.00 0.54 O ATOM 639 CB ARG A 35 -21.619 -6.566 -7.288 1.00 0.72 C ATOM 640 CG ARG A 35 -21.037 -5.914 -6.047 1.00 0.77 C ATOM 641 CD ARG A 35 -21.822 -6.307 -4.802 1.00 0.79 C ATOM 642 NE ARG A 35 -23.203 -5.831 -4.842 1.00 1.02 N ATOM 643 CZ ARG A 35 -24.222 -6.434 -4.226 1.00 1.46 C ATOM 644 NH1 ARG A 35 -24.027 -7.558 -3.542 1.00 1.79 N ATOM 645 NH2 ARG A 35 -25.440 -5.912 -4.295 1.00 1.90 N ATOM 0 H ARG A 35 -19.581 -7.789 -6.381 1.00 0.51 H new ATOM 0 HA ARG A 35 -21.137 -7.985 -8.821 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -22.099 -5.798 -7.895 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -22.398 -7.265 -6.984 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -19.994 -6.210 -5.932 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -21.050 -4.830 -6.162 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -21.817 -7.392 -4.700 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -21.326 -5.902 -3.920 1.00 0.79 H new ATOM 0 HE ARG A 35 -23.401 -4.984 -5.375 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -23.093 -7.965 -3.485 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -24.811 -8.013 -3.074 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -25.597 -5.051 -4.818 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -26.219 -6.372 -3.825 1.00 1.90 H new ATOM 659 N ILE A 36 -18.669 -5.879 -8.583 1.00 0.45 N ATOM 660 CA ILE A 36 -17.860 -4.951 -9.366 1.00 0.43 C ATOM 661 C ILE A 36 -16.683 -5.677 -10.015 1.00 0.45 C ATOM 662 O ILE A 36 -15.711 -6.026 -9.345 1.00 0.44 O ATOM 663 CB ILE A 36 -17.331 -3.780 -8.506 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.492 -3.059 -7.818 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.535 -2.805 -9.365 1.00 0.44 C ATOM 666 CD1 ILE A 36 -18.057 -1.921 -6.920 1.00 0.44 C ATOM 0 H ILE A 36 -18.275 -6.124 -7.675 1.00 0.45 H new ATOM 0 HA ILE A 36 -18.507 -4.540 -10.141 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.670 -4.184 -7.740 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -19.169 -2.671 -8.579 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -19.057 -3.780 -7.227 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -16.170 -1.987 -8.744 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -15.689 -3.324 -9.815 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -17.176 -2.406 -10.151 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -18.934 -1.459 -6.468 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -17.405 -2.305 -6.136 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.518 -1.178 -7.509 1.00 0.44 H new ATOM 678 N PRO A 37 -16.753 -5.919 -11.334 1.00 0.53 N ATOM 679 CA PRO A 37 -15.688 -6.613 -12.058 1.00 0.60 C ATOM 680 C PRO A 37 -14.439 -5.750 -12.230 1.00 0.61 C ATOM 681 O PRO A 37 -13.348 -6.264 -12.477 1.00 0.71 O ATOM 682 CB PRO A 37 -16.319 -6.930 -13.412 1.00 0.73 C ATOM 683 CG PRO A 37 -17.394 -5.917 -13.591 1.00 0.76 C ATOM 684 CD PRO A 37 -17.877 -5.550 -12.214 1.00 0.60 C ATOM 0 HA PRO A 37 -15.344 -7.497 -11.522 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -15.583 -6.868 -14.213 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -16.725 -7.941 -13.430 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -17.015 -5.039 -14.115 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -18.209 -6.320 -14.192 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -18.109 -4.487 -12.142 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -18.785 -6.093 -11.951 1.00 0.60 H new ATOM 692 N GLU A 38 -14.603 -4.438 -12.086 1.00 0.57 N ATOM 693 CA GLU A 38 -13.477 -3.514 -12.176 1.00 0.61 C ATOM 694 C GLU A 38 -12.543 -3.707 -10.992 1.00 0.54 C ATOM 695 O GLU A 38 -11.353 -3.407 -11.067 1.00 0.62 O ATOM 696 CB GLU A 38 -13.949 -2.054 -12.206 1.00 0.75 C ATOM 697 CG GLU A 38 -14.724 -1.661 -13.455 1.00 0.99 C ATOM 698 CD GLU A 38 -16.077 -2.330 -13.549 1.00 1.67 C ATOM 699 OE1 GLU A 38 -16.905 -2.124 -12.640 1.00 2.46 O ATOM 700 OE2 GLU A 38 -16.315 -3.057 -14.535 1.00 2.04 O ATOM 0 H GLU A 38 -15.503 -3.992 -11.907 1.00 0.57 H new ATOM 0 HA GLU A 38 -12.951 -3.731 -13.106 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -14.576 -1.871 -11.333 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -13.079 -1.403 -12.115 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -14.859 -0.579 -13.466 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -14.136 -1.918 -14.336 1.00 0.99 H new ATOM 707 N ALA A 39 -13.098 -4.221 -9.902 1.00 0.47 N ATOM 708 CA ALA A 39 -12.352 -4.409 -8.670 1.00 0.47 C ATOM 709 C ALA A 39 -11.213 -5.400 -8.861 1.00 0.49 C ATOM 710 O ALA A 39 -10.102 -5.188 -8.393 1.00 0.55 O ATOM 711 CB ALA A 39 -13.290 -4.881 -7.569 1.00 0.47 C ATOM 0 H ALA A 39 -14.073 -4.517 -9.849 1.00 0.47 H new ATOM 0 HA ALA A 39 -11.914 -3.453 -8.383 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.727 -5.021 -6.646 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -14.068 -4.135 -7.409 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -13.748 -5.826 -7.861 1.00 0.47 H new ATOM 717 N LEU A 40 -11.496 -6.465 -9.580 1.00 0.50 N ATOM 718 CA LEU A 40 -10.552 -7.559 -9.754 1.00 0.59 C ATOM 719 C LEU A 40 -9.697 -7.380 -11.003 1.00 0.67 C ATOM 720 O LEU A 40 -9.211 -8.359 -11.572 1.00 0.99 O ATOM 721 CB LEU A 40 -11.326 -8.860 -9.852 1.00 0.65 C ATOM 722 CG LEU A 40 -12.395 -8.858 -10.935 1.00 0.62 C ATOM 723 CD1 LEU A 40 -12.010 -9.777 -12.072 1.00 1.29 C ATOM 724 CD2 LEU A 40 -13.732 -9.230 -10.339 1.00 1.19 C ATOM 0 H LEU A 40 -12.385 -6.601 -10.062 1.00 0.50 H new ATOM 0 HA LEU A 40 -9.881 -7.572 -8.895 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -10.627 -9.674 -10.046 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -11.796 -9.066 -8.890 1.00 0.65 H new ATOM 0 HG LEU A 40 -12.479 -7.854 -11.351 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -12.789 -9.759 -12.834 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -11.069 -9.442 -12.508 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -11.894 -10.793 -11.695 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -14.492 -9.226 -11.120 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -13.670 -10.225 -9.898 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -14.000 -8.508 -9.568 1.00 1.19 H new ATOM 736 N ALA A 41 -9.493 -6.134 -11.408 1.00 0.65 N ATOM 737 CA ALA A 41 -8.716 -5.823 -12.606 1.00 0.74 C ATOM 738 C ALA A 41 -7.210 -6.025 -12.381 1.00 0.81 C ATOM 739 O ALA A 41 -6.385 -5.206 -12.793 1.00 1.15 O ATOM 740 CB ALA A 41 -9.000 -4.396 -13.055 1.00 0.92 C ATOM 0 H ALA A 41 -9.857 -5.314 -10.922 1.00 0.65 H new ATOM 0 HA ALA A 41 -9.022 -6.515 -13.390 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -8.417 -4.173 -13.948 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -10.061 -4.289 -13.279 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -8.725 -3.703 -12.260 1.00 0.92 H new ATOM 746 N GLY A 42 -6.869 -7.129 -11.741 1.00 0.75 N ATOM 747 CA GLY A 42 -5.496 -7.482 -11.484 1.00 0.86 C ATOM 748 C GLY A 42 -5.449 -8.733 -10.645 1.00 0.80 C ATOM 749 O GLY A 42 -6.257 -9.635 -10.856 1.00 0.82 O ATOM 0 H GLY A 42 -7.545 -7.805 -11.386 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -4.968 -7.641 -12.424 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -4.990 -6.666 -10.968 1.00 0.86 H new ATOM 753 N PRO A 43 -4.521 -8.837 -9.698 1.00 0.83 N ATOM 754 CA PRO A 43 -4.523 -9.905 -8.719 1.00 0.82 C ATOM 755 C PRO A 43 -5.314 -9.518 -7.469 1.00 0.72 C ATOM 756 O PRO A 43 -4.842 -8.734 -6.644 1.00 0.66 O ATOM 757 CB PRO A 43 -3.038 -10.091 -8.397 1.00 0.94 C ATOM 758 CG PRO A 43 -2.321 -8.901 -8.978 1.00 1.09 C ATOM 759 CD PRO A 43 -3.367 -7.960 -9.515 1.00 0.98 C ATOM 0 HA PRO A 43 -4.998 -10.814 -9.087 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -2.879 -10.152 -7.320 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -2.661 -11.019 -8.827 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -1.717 -8.408 -8.216 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -1.642 -9.213 -9.772 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -3.580 -7.150 -8.817 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -3.055 -7.500 -10.452 1.00 0.98 H new ATOM 767 N PRO A 44 -6.538 -10.061 -7.316 1.00 0.76 N ATOM 768 CA PRO A 44 -7.439 -9.709 -6.207 1.00 0.73 C ATOM 769 C PRO A 44 -6.858 -10.034 -4.833 1.00 0.69 C ATOM 770 O PRO A 44 -7.344 -9.544 -3.812 1.00 0.74 O ATOM 771 CB PRO A 44 -8.688 -10.558 -6.470 1.00 0.93 C ATOM 772 CG PRO A 44 -8.226 -11.657 -7.364 1.00 0.99 C ATOM 773 CD PRO A 44 -7.148 -11.057 -8.214 1.00 0.89 C ATOM 0 HA PRO A 44 -7.629 -8.636 -6.180 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -9.100 -10.952 -5.541 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.474 -9.969 -6.943 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -7.846 -12.499 -6.786 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -9.045 -12.034 -7.977 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.425 -11.806 -8.538 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -7.553 -10.595 -9.114 1.00 0.89 H new ATOM 781 N ASN A 45 -5.812 -10.849 -4.816 1.00 0.72 N ATOM 782 CA ASN A 45 -5.168 -11.252 -3.572 1.00 0.77 C ATOM 783 C ASN A 45 -4.289 -10.132 -3.028 1.00 0.71 C ATOM 784 O ASN A 45 -4.015 -10.071 -1.830 1.00 0.85 O ATOM 785 CB ASN A 45 -4.329 -12.513 -3.796 1.00 0.87 C ATOM 786 CG ASN A 45 -5.169 -13.698 -4.234 1.00 1.41 C ATOM 787 OD1 ASN A 45 -6.325 -13.845 -3.827 1.00 2.21 O ATOM 788 ND2 ASN A 45 -4.597 -14.545 -5.073 1.00 1.37 N ATOM 0 H ASN A 45 -5.389 -11.246 -5.655 1.00 0.72 H new ATOM 0 HA ASN A 45 -5.946 -11.466 -2.839 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -3.569 -12.311 -4.551 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -3.804 -12.765 -2.875 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -5.114 -15.358 -5.409 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -3.639 -14.386 -5.384 1.00 1.37 H new ATOM 795 N ASP A 46 -3.871 -9.227 -3.908 1.00 0.61 N ATOM 796 CA ASP A 46 -3.015 -8.116 -3.514 1.00 0.68 C ATOM 797 C ASP A 46 -3.865 -6.881 -3.289 1.00 0.57 C ATOM 798 O ASP A 46 -3.350 -5.799 -3.035 1.00 0.61 O ATOM 799 CB ASP A 46 -1.978 -7.796 -4.595 1.00 0.83 C ATOM 800 CG ASP A 46 -1.023 -8.932 -4.900 1.00 1.22 C ATOM 801 OD1 ASP A 46 -0.515 -9.545 -3.939 1.00 1.90 O ATOM 802 OD2 ASP A 46 -0.807 -9.244 -6.091 1.00 1.38 O ATOM 0 H ASP A 46 -4.112 -9.242 -4.899 1.00 0.61 H new ATOM 0 HA ASP A 46 -2.495 -8.404 -2.600 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -2.499 -7.520 -5.511 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -1.401 -6.926 -4.282 1.00 0.83 H new ATOM 807 N PHE A 47 -5.171 -7.050 -3.391 1.00 0.53 N ATOM 808 CA PHE A 47 -6.090 -5.926 -3.367 1.00 0.47 C ATOM 809 C PHE A 47 -6.651 -5.696 -1.975 1.00 0.44 C ATOM 810 O PHE A 47 -7.226 -6.597 -1.361 1.00 0.48 O ATOM 811 CB PHE A 47 -7.225 -6.138 -4.373 1.00 0.49 C ATOM 812 CG PHE A 47 -6.798 -6.039 -5.816 1.00 0.51 C ATOM 813 CD1 PHE A 47 -5.529 -5.602 -6.155 1.00 0.79 C ATOM 814 CD2 PHE A 47 -7.673 -6.375 -6.834 1.00 0.78 C ATOM 815 CE1 PHE A 47 -5.139 -5.502 -7.476 1.00 0.85 C ATOM 816 CE2 PHE A 47 -7.290 -6.276 -8.158 1.00 0.80 C ATOM 817 CZ PHE A 47 -6.023 -5.838 -8.478 1.00 0.63 C ATOM 0 H PHE A 47 -5.621 -7.960 -3.492 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.531 -5.035 -3.652 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.667 -7.120 -4.203 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -8.005 -5.400 -4.185 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -4.833 -5.335 -5.374 1.00 0.79 H new ATOM 0 HD2 PHE A 47 -8.667 -6.719 -6.591 1.00 0.78 H new ATOM 0 HE1 PHE A 47 -4.144 -5.162 -7.723 1.00 0.85 H new ATOM 0 HE2 PHE A 47 -7.984 -6.542 -8.942 1.00 0.80 H new ATOM 0 HZ PHE A 47 -5.724 -5.758 -9.513 1.00 0.63 H new ATOM 827 N GLY A 48 -6.463 -4.484 -1.484 1.00 0.42 N ATOM 828 CA GLY A 48 -6.977 -4.106 -0.191 1.00 0.41 C ATOM 829 C GLY A 48 -7.822 -2.855 -0.264 1.00 0.35 C ATOM 830 O GLY A 48 -7.955 -2.247 -1.329 1.00 0.34 O ATOM 0 H GLY A 48 -5.954 -3.745 -1.969 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -7.573 -4.923 0.216 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.147 -3.944 0.496 1.00 0.41 H new ATOM 834 N LEU A 49 -8.378 -2.461 0.866 1.00 0.31 N ATOM 835 CA LEU A 49 -9.285 -1.327 0.913 1.00 0.28 C ATOM 836 C LEU A 49 -8.578 -0.078 1.430 1.00 0.29 C ATOM 837 O LEU A 49 -8.226 0.018 2.605 1.00 0.31 O ATOM 838 CB LEU A 49 -10.499 -1.666 1.779 1.00 0.26 C ATOM 839 CG LEU A 49 -11.301 -2.882 1.305 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.428 -3.199 2.271 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.854 -2.643 -0.091 1.00 0.25 C ATOM 0 H LEU A 49 -8.217 -2.911 1.767 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.626 -1.114 -0.100 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -10.162 -1.845 2.800 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -11.161 -0.800 1.809 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.628 -3.739 1.273 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -12.982 -4.066 1.912 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -12.013 -3.416 3.255 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -13.099 -2.343 2.341 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.421 -3.517 -0.412 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.507 -1.771 -0.079 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -11.031 -2.470 -0.784 1.00 0.25 H new ATOM 853 N PHE A 50 -8.348 0.853 0.526 1.00 0.29 N ATOM 854 CA PHE A 50 -7.747 2.133 0.869 1.00 0.30 C ATOM 855 C PHE A 50 -8.835 3.182 1.048 1.00 0.30 C ATOM 856 O PHE A 50 -9.687 3.359 0.185 1.00 0.31 O ATOM 857 CB PHE A 50 -6.753 2.565 -0.215 1.00 0.34 C ATOM 858 CG PHE A 50 -6.079 3.886 0.057 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.952 3.949 0.862 1.00 0.37 C ATOM 860 CD2 PHE A 50 -6.572 5.061 -0.492 1.00 0.36 C ATOM 861 CE1 PHE A 50 -4.328 5.156 1.113 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.952 6.271 -0.243 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.843 6.326 0.558 1.00 0.37 C ATOM 0 H PHE A 50 -8.570 0.748 -0.464 1.00 0.29 H new ATOM 0 HA PHE A 50 -7.202 2.029 1.807 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.989 1.795 -0.320 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -7.277 2.626 -1.169 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.557 3.043 1.298 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -7.450 5.030 -1.121 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -3.446 5.192 1.736 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -6.344 7.177 -0.682 1.00 0.38 H new ATOM 0 HZ PHE A 50 -4.368 7.275 0.759 1.00 0.37 H new ATOM 873 N LEU A 51 -8.805 3.875 2.166 1.00 0.30 N ATOM 874 CA LEU A 51 -9.812 4.879 2.451 1.00 0.32 C ATOM 875 C LEU A 51 -9.318 6.245 1.997 1.00 0.36 C ATOM 876 O LEU A 51 -8.317 6.753 2.507 1.00 0.38 O ATOM 877 CB LEU A 51 -10.145 4.881 3.952 1.00 0.33 C ATOM 878 CG LEU A 51 -11.405 5.657 4.372 1.00 0.35 C ATOM 879 CD1 LEU A 51 -11.148 7.156 4.425 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.562 5.349 3.430 1.00 0.41 C ATOM 0 H LEU A 51 -8.097 3.764 2.892 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.725 4.644 1.903 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -10.256 3.847 4.279 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -9.293 5.296 4.490 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.673 5.330 5.377 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -12.060 7.671 4.725 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -10.359 7.365 5.148 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -10.840 7.507 3.440 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -13.444 5.907 3.743 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -12.291 5.638 2.415 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.779 4.281 3.458 1.00 0.41 H new ATOM 892 N SER A 52 -10.011 6.822 1.025 1.00 0.42 N ATOM 893 CA SER A 52 -9.677 8.146 0.535 1.00 0.53 C ATOM 894 C SER A 52 -10.250 9.202 1.474 1.00 0.61 C ATOM 895 O SER A 52 -11.424 9.568 1.388 1.00 0.93 O ATOM 896 CB SER A 52 -10.208 8.335 -0.889 1.00 0.67 C ATOM 897 OG SER A 52 -9.704 7.328 -1.755 1.00 1.28 O ATOM 0 H SER A 52 -10.810 6.390 0.561 1.00 0.42 H new ATOM 0 HA SER A 52 -8.593 8.256 0.508 1.00 0.53 H new ATOM 0 HB2 SER A 52 -11.298 8.303 -0.883 1.00 0.67 H new ATOM 0 HB3 SER A 52 -9.920 9.318 -1.261 1.00 0.67 H new ATOM 0 HG SER A 52 -10.057 7.467 -2.659 1.00 1.28 H new ATOM 903 N ASP A 53 -9.412 9.658 2.391 1.00 0.74 N ATOM 904 CA ASP A 53 -9.815 10.613 3.413 1.00 0.90 C ATOM 905 C ASP A 53 -9.904 12.018 2.827 1.00 1.04 C ATOM 906 O ASP A 53 -10.944 12.676 2.915 1.00 1.28 O ATOM 907 CB ASP A 53 -8.806 10.582 4.566 1.00 0.89 C ATOM 908 CG ASP A 53 -9.203 11.468 5.728 1.00 1.18 C ATOM 909 OD1 ASP A 53 -9.900 10.976 6.641 1.00 1.42 O ATOM 910 OD2 ASP A 53 -8.805 12.650 5.747 1.00 1.24 O ATOM 0 H ASP A 53 -8.433 9.377 2.449 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.801 10.338 3.788 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.699 9.556 4.919 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.830 10.895 4.195 1.00 0.89 H new ATOM 915 N ASP A 54 -8.812 12.446 2.200 1.00 0.93 N ATOM 916 CA ASP A 54 -8.701 13.784 1.616 1.00 1.10 C ATOM 917 C ASP A 54 -7.330 13.956 0.980 1.00 1.02 C ATOM 918 O ASP A 54 -7.205 14.193 -0.219 1.00 1.22 O ATOM 919 CB ASP A 54 -8.906 14.869 2.680 1.00 1.26 C ATOM 920 CG ASP A 54 -8.545 16.253 2.174 1.00 1.47 C ATOM 921 OD1 ASP A 54 -9.255 16.773 1.285 1.00 1.73 O ATOM 922 OD2 ASP A 54 -7.549 16.830 2.669 1.00 1.45 O ATOM 0 H ASP A 54 -7.975 11.875 2.081 1.00 0.93 H new ATOM 0 HA ASP A 54 -9.478 13.889 0.859 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -9.947 14.864 3.004 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -8.299 14.635 3.555 1.00 1.26 H new ATOM 927 N ASP A 55 -6.310 13.822 1.804 1.00 0.87 N ATOM 928 CA ASP A 55 -4.930 13.934 1.361 1.00 0.94 C ATOM 929 C ASP A 55 -4.328 12.539 1.278 1.00 0.87 C ATOM 930 O ASP A 55 -4.654 11.685 2.103 1.00 0.71 O ATOM 931 CB ASP A 55 -4.144 14.807 2.350 1.00 0.99 C ATOM 932 CG ASP A 55 -2.677 14.958 2.002 1.00 1.39 C ATOM 933 OD1 ASP A 55 -1.908 14.001 2.222 1.00 1.79 O ATOM 934 OD2 ASP A 55 -2.289 16.027 1.489 1.00 1.58 O ATOM 0 H ASP A 55 -6.412 13.632 2.801 1.00 0.87 H new ATOM 0 HA ASP A 55 -4.884 14.402 0.378 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -4.602 15.795 2.390 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -4.228 14.376 3.347 1.00 0.99 H new ATOM 939 N PRO A 56 -3.476 12.272 0.276 1.00 1.06 N ATOM 940 CA PRO A 56 -2.822 10.969 0.100 1.00 1.08 C ATOM 941 C PRO A 56 -2.215 10.414 1.394 1.00 0.98 C ATOM 942 O PRO A 56 -2.200 9.205 1.605 1.00 0.97 O ATOM 943 CB PRO A 56 -1.716 11.243 -0.934 1.00 1.35 C ATOM 944 CG PRO A 56 -1.719 12.722 -1.158 1.00 1.48 C ATOM 945 CD PRO A 56 -3.092 13.203 -0.789 1.00 1.33 C ATOM 0 HA PRO A 56 -3.542 10.213 -0.214 1.00 1.08 H new ATOM 0 HB2 PRO A 56 -0.747 10.906 -0.567 1.00 1.35 H new ATOM 0 HB3 PRO A 56 -1.909 10.707 -1.863 1.00 1.35 H new ATOM 0 HG2 PRO A 56 -0.959 13.209 -0.547 1.00 1.48 H new ATOM 0 HG3 PRO A 56 -1.491 12.958 -2.197 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -3.081 14.236 -0.441 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -3.779 13.159 -1.634 1.00 1.33 H new ATOM 953 N LYS A 57 -1.735 11.299 2.263 1.00 0.99 N ATOM 954 CA LYS A 57 -1.117 10.877 3.514 1.00 1.02 C ATOM 955 C LYS A 57 -2.159 10.686 4.613 1.00 0.82 C ATOM 956 O LYS A 57 -1.949 9.908 5.542 1.00 0.87 O ATOM 957 CB LYS A 57 -0.072 11.891 3.963 1.00 1.25 C ATOM 958 CG LYS A 57 1.057 12.072 2.977 1.00 1.51 C ATOM 959 CD LYS A 57 2.062 13.064 3.508 1.00 1.62 C ATOM 960 CE LYS A 57 3.217 13.249 2.552 1.00 2.08 C ATOM 961 NZ LYS A 57 2.760 13.639 1.190 1.00 2.93 N ATOM 0 H LYS A 57 -1.762 12.309 2.124 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.631 9.918 3.333 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -0.558 12.853 4.127 1.00 1.25 H new ATOM 0 HB3 LYS A 57 0.341 11.575 4.921 1.00 1.25 H new ATOM 0 HG2 LYS A 57 1.544 11.115 2.792 1.00 1.51 H new ATOM 0 HG3 LYS A 57 0.663 12.419 2.022 1.00 1.51 H new ATOM 0 HD2 LYS A 57 1.573 14.023 3.679 1.00 1.62 H new ATOM 0 HD3 LYS A 57 2.438 12.722 4.472 1.00 1.62 H new ATOM 0 HE2 LYS A 57 3.890 14.013 2.941 1.00 2.08 H new ATOM 0 HE3 LYS A 57 3.788 12.323 2.491 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 3.571 13.983 0.637 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 2.342 12.814 0.715 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 2.047 14.393 1.265 1.00 2.93 H new ATOM 975 N LYS A 58 -3.278 11.401 4.511 1.00 0.69 N ATOM 976 CA LYS A 58 -4.375 11.240 5.462 1.00 0.65 C ATOM 977 C LYS A 58 -5.075 9.911 5.225 1.00 0.56 C ATOM 978 O LYS A 58 -5.628 9.310 6.152 1.00 0.63 O ATOM 979 CB LYS A 58 -5.393 12.367 5.314 1.00 0.73 C ATOM 980 CG LYS A 58 -4.840 13.752 5.592 1.00 0.94 C ATOM 981 CD LYS A 58 -5.882 14.807 5.276 1.00 1.24 C ATOM 982 CE LYS A 58 -5.350 16.213 5.482 1.00 1.55 C ATOM 983 NZ LYS A 58 -6.371 17.241 5.141 1.00 2.16 N ATOM 0 H LYS A 58 -3.448 12.094 3.783 1.00 0.69 H new ATOM 0 HA LYS A 58 -3.956 11.268 6.468 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.795 12.346 4.301 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -6.226 12.179 5.991 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -4.540 13.828 6.637 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -3.947 13.922 4.991 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -6.212 14.692 4.244 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -6.756 14.654 5.909 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -5.041 16.337 6.520 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -4.464 16.361 4.865 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -5.973 18.190 5.294 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -6.648 17.138 4.144 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -7.207 17.115 5.747 1.00 2.16 H new ATOM 997 N GLY A 59 -5.051 9.474 3.969 1.00 0.54 N ATOM 998 CA GLY A 59 -5.653 8.211 3.592 1.00 0.59 C ATOM 999 C GLY A 59 -5.053 7.050 4.353 1.00 0.54 C ATOM 1000 O GLY A 59 -3.906 7.122 4.800 1.00 0.58 O ATOM 0 H GLY A 59 -4.618 9.982 3.197 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.726 8.251 3.778 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -5.520 8.051 2.522 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.809 5.976 4.490 1.00 0.49 N ATOM 1005 CA ILE A 60 -5.394 4.859 5.325 1.00 0.47 C ATOM 1006 C ILE A 60 -5.734 3.532 4.668 1.00 0.42 C ATOM 1007 O ILE A 60 -6.644 3.453 3.840 1.00 0.41 O ATOM 1008 CB ILE A 60 -6.062 4.905 6.719 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -7.587 4.980 6.580 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -5.536 6.081 7.525 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -8.326 4.938 7.900 1.00 0.65 C ATOM 0 H ILE A 60 -6.713 5.852 4.035 1.00 0.49 H new ATOM 0 HA ILE A 60 -4.314 4.946 5.445 1.00 0.47 H new ATOM 0 HB ILE A 60 -5.812 3.988 7.253 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -7.850 5.900 6.057 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -7.927 4.152 5.958 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -6.018 6.097 8.503 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -4.458 5.981 7.653 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -5.754 7.010 6.998 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -9.399 4.996 7.718 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -8.095 4.007 8.417 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -8.017 5.782 8.517 1.00 0.65 H new ATOM 1023 N TRP A 61 -5.001 2.495 5.039 1.00 0.42 N ATOM 1024 CA TRP A 61 -5.299 1.155 4.570 1.00 0.40 C ATOM 1025 C TRP A 61 -6.155 0.432 5.594 1.00 0.40 C ATOM 1026 O TRP A 61 -5.775 0.294 6.761 1.00 0.48 O ATOM 1027 CB TRP A 61 -4.021 0.364 4.297 1.00 0.44 C ATOM 1028 CG TRP A 61 -3.295 0.814 3.070 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -2.254 1.687 3.010 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.557 0.407 1.726 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.843 1.848 1.713 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.629 1.073 0.903 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.484 -0.455 1.137 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.602 0.901 -0.475 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.456 -0.625 -0.232 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.521 0.051 -1.024 1.00 0.48 C ATOM 0 H TRP A 61 -4.196 2.557 5.663 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.847 1.236 3.631 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -3.357 0.453 5.157 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -4.271 -0.692 4.196 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.814 2.183 3.863 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -1.078 2.446 1.402 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -5.209 -0.979 1.742 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.882 1.420 -1.090 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -5.167 -1.290 -0.700 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.526 -0.102 -2.093 1.00 0.48 H new ATOM 1047 N LEU A 62 -7.311 -0.015 5.152 1.00 0.36 N ATOM 1048 CA LEU A 62 -8.264 -0.674 6.019 1.00 0.37 C ATOM 1049 C LEU A 62 -7.867 -2.127 6.243 1.00 0.42 C ATOM 1050 O LEU A 62 -7.857 -2.929 5.306 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.656 -0.601 5.394 1.00 0.33 C ATOM 1052 CG LEU A 62 -10.131 0.809 5.030 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.465 0.752 4.314 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -10.237 1.675 6.270 1.00 0.35 C ATOM 0 H LEU A 62 -7.616 0.068 4.182 1.00 0.36 H new ATOM 0 HA LEU A 62 -8.273 -0.168 6.985 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.666 -1.215 4.493 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -10.372 -1.041 6.088 1.00 0.33 H new ATOM 0 HG LEU A 62 -9.395 1.254 4.360 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.787 1.763 4.063 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -11.363 0.166 3.400 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -12.206 0.286 4.963 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.576 2.672 5.989 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.951 1.231 6.964 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -9.261 1.745 6.749 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.516 -2.459 7.473 1.00 0.48 N ATOM 1067 CA GLU A 63 -7.143 -3.822 7.822 1.00 0.55 C ATOM 1068 C GLU A 63 -8.373 -4.717 7.931 1.00 0.52 C ATOM 1069 O GLU A 63 -9.480 -4.239 8.175 1.00 0.48 O ATOM 1070 CB GLU A 63 -6.366 -3.815 9.138 1.00 0.65 C ATOM 1071 CG GLU A 63 -7.135 -3.194 10.292 1.00 0.68 C ATOM 1072 CD GLU A 63 -6.224 -2.611 11.346 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -5.657 -1.524 11.119 1.00 1.30 O ATOM 1074 OE2 GLU A 63 -6.060 -3.253 12.405 1.00 1.42 O ATOM 0 H GLU A 63 -7.481 -1.801 8.252 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.511 -4.226 7.032 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -6.099 -4.839 9.399 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -5.433 -3.269 8.997 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -7.790 -2.411 9.909 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -7.775 -3.950 10.747 1.00 0.68 H new ATOM 1081 N ALA A 64 -8.172 -6.013 7.753 1.00 0.58 N ATOM 1082 CA ALA A 64 -9.268 -6.973 7.795 1.00 0.58 C ATOM 1083 C ALA A 64 -9.895 -7.038 9.182 1.00 0.60 C ATOM 1084 O ALA A 64 -11.093 -7.284 9.319 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.781 -8.350 7.368 1.00 0.64 C ATOM 0 H ALA A 64 -7.257 -6.427 7.577 1.00 0.58 H new ATOM 0 HA ALA A 64 -10.035 -6.637 7.097 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.610 -9.057 7.404 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.392 -8.299 6.351 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -7.992 -8.682 8.042 1.00 0.64 H new ATOM 1091 N GLY A 65 -9.085 -6.781 10.199 1.00 0.64 N ATOM 1092 CA GLY A 65 -9.536 -6.908 11.570 1.00 0.70 C ATOM 1093 C GLY A 65 -10.278 -5.689 12.095 1.00 0.70 C ATOM 1094 O GLY A 65 -10.134 -5.338 13.267 1.00 0.84 O ATOM 0 H GLY A 65 -8.115 -6.484 10.097 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -10.188 -7.778 11.648 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -8.673 -7.098 12.209 1.00 0.70 H new ATOM 1098 N LYS A 66 -11.052 -5.027 11.240 1.00 0.60 N ATOM 1099 CA LYS A 66 -11.960 -3.982 11.700 1.00 0.61 C ATOM 1100 C LYS A 66 -13.090 -3.770 10.696 1.00 0.54 C ATOM 1101 O LYS A 66 -12.946 -4.051 9.498 1.00 0.47 O ATOM 1102 CB LYS A 66 -11.223 -2.657 11.972 1.00 0.66 C ATOM 1103 CG LYS A 66 -11.373 -1.606 10.881 1.00 0.60 C ATOM 1104 CD LYS A 66 -10.568 -1.932 9.640 1.00 0.56 C ATOM 1105 CE LYS A 66 -11.047 -1.121 8.449 1.00 0.61 C ATOM 1106 NZ LYS A 66 -12.447 -1.448 8.088 1.00 1.29 N ATOM 0 H LYS A 66 -11.069 -5.194 10.234 1.00 0.60 H new ATOM 0 HA LYS A 66 -12.388 -4.317 12.645 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -11.589 -2.240 12.911 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -10.163 -2.869 12.109 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -12.425 -1.515 10.613 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -11.058 -0.638 11.269 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -9.513 -1.727 9.823 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -10.652 -2.996 9.417 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -10.969 -0.058 8.678 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -10.397 -1.311 7.595 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -12.578 -1.328 7.063 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -12.652 -2.433 8.351 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -13.094 -0.812 8.597 1.00 1.29 H new ATOM 1120 N ALA A 67 -14.203 -3.246 11.184 1.00 0.57 N ATOM 1121 CA ALA A 67 -15.368 -3.007 10.354 1.00 0.52 C ATOM 1122 C ALA A 67 -15.242 -1.656 9.661 1.00 0.47 C ATOM 1123 O ALA A 67 -14.316 -0.896 9.947 1.00 0.47 O ATOM 1124 CB ALA A 67 -16.629 -3.083 11.199 1.00 0.59 C ATOM 0 H ALA A 67 -14.322 -2.977 12.161 1.00 0.57 H new ATOM 0 HA ALA A 67 -15.432 -3.776 9.584 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -17.500 -2.903 10.569 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -16.706 -4.072 11.650 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -16.587 -2.329 11.985 1.00 0.59 H new ATOM 1130 N LEU A 68 -16.140 -1.358 8.740 1.00 0.45 N ATOM 1131 CA LEU A 68 -16.025 -0.134 7.953 1.00 0.40 C ATOM 1132 C LEU A 68 -16.430 1.087 8.777 1.00 0.43 C ATOM 1133 O LEU A 68 -15.621 1.986 9.010 1.00 0.44 O ATOM 1134 CB LEU A 68 -16.873 -0.229 6.689 1.00 0.37 C ATOM 1135 CG LEU A 68 -16.527 -1.394 5.760 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -17.467 -1.425 4.569 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -15.086 -1.289 5.293 1.00 0.37 C ATOM 0 H LEU A 68 -16.950 -1.936 8.517 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.981 -0.016 7.663 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.920 -0.315 6.979 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -16.772 0.702 6.132 1.00 0.37 H new ATOM 0 HG LEU A 68 -16.646 -2.324 6.317 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -17.205 -2.261 3.920 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -18.493 -1.545 4.918 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -17.380 -0.492 4.012 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.856 -2.125 4.633 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.946 -0.352 4.754 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -14.421 -1.314 6.156 1.00 0.37 H new ATOM 1149 N ASP A 69 -17.664 1.076 9.257 1.00 0.47 N ATOM 1150 CA ASP A 69 -18.230 2.199 10.013 1.00 0.52 C ATOM 1151 C ASP A 69 -17.581 2.311 11.392 1.00 0.58 C ATOM 1152 O ASP A 69 -17.816 3.267 12.130 1.00 0.65 O ATOM 1153 CB ASP A 69 -19.753 2.031 10.142 1.00 0.58 C ATOM 1154 CG ASP A 69 -20.424 3.129 10.951 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -20.546 4.263 10.436 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -20.818 2.873 12.107 1.00 1.16 O ATOM 0 H ASP A 69 -18.306 0.293 9.137 1.00 0.47 H new ATOM 0 HA ASP A 69 -18.023 3.122 9.471 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -20.192 2.007 9.145 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.965 1.068 10.607 1.00 0.58 H new ATOM 1161 N TYR A 70 -16.761 1.320 11.734 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.951 1.379 12.936 1.00 0.65 C ATOM 1163 C TYR A 70 -15.034 2.604 12.877 1.00 0.62 C ATOM 1164 O TYR A 70 -14.770 3.255 13.890 1.00 0.67 O ATOM 1165 CB TYR A 70 -15.156 0.072 13.080 1.00 0.69 C ATOM 1166 CG TYR A 70 -13.930 0.177 13.950 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -14.024 0.131 15.333 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -12.678 0.321 13.379 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -12.897 0.225 16.123 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -11.545 0.415 14.159 1.00 1.05 C ATOM 1171 CZ TYR A 70 -11.659 0.367 15.530 1.00 1.22 C ATOM 1172 OH TYR A 70 -10.529 0.462 16.312 1.00 1.45 O ATOM 0 H TYR A 70 -16.644 0.466 11.189 1.00 0.59 H new ATOM 0 HA TYR A 70 -16.586 1.483 13.816 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -15.813 -0.694 13.491 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -14.854 -0.266 12.089 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -14.993 0.020 15.798 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -12.587 0.360 12.304 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -12.983 0.188 17.199 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -10.575 0.526 13.698 1.00 1.05 H new ATOM 0 HH TYR A 70 -9.741 0.556 15.738 1.00 1.45 H new ATOM 1182 N TYR A 71 -14.553 2.907 11.677 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.833 4.150 11.424 1.00 0.58 C ATOM 1184 C TYR A 71 -14.813 5.308 11.231 1.00 0.60 C ATOM 1185 O TYR A 71 -15.921 5.300 11.763 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.937 4.010 10.193 1.00 0.56 C ATOM 1187 CG TYR A 71 -11.600 3.374 10.484 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -10.540 4.125 10.964 1.00 0.58 C ATOM 1189 CD2 TYR A 71 -11.402 2.014 10.283 1.00 0.62 C ATOM 1190 CE1 TYR A 71 -9.318 3.537 11.234 1.00 0.63 C ATOM 1191 CE2 TYR A 71 -10.184 1.421 10.550 1.00 0.66 C ATOM 1192 CZ TYR A 71 -9.129 2.216 11.016 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.927 1.605 11.296 1.00 0.72 O ATOM 0 H TYR A 71 -14.649 2.305 10.859 1.00 0.57 H new ATOM 0 HA TYR A 71 -13.206 4.363 12.290 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -13.457 3.415 9.442 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -12.773 4.997 9.760 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -10.670 5.184 11.130 1.00 0.58 H new ATOM 0 HD2 TYR A 71 -12.216 1.409 9.911 1.00 0.62 H new ATOM 0 HE1 TYR A 71 -8.508 4.137 11.622 1.00 0.63 H new ATOM 0 HE2 TYR A 71 -10.047 0.360 10.402 1.00 0.66 H new ATOM 0 HH TYR A 71 -7.985 0.652 11.074 1.00 0.72 H new ATOM 1203 N MET A 72 -14.401 6.303 10.460 1.00 0.60 N ATOM 1204 CA MET A 72 -15.247 7.460 10.195 1.00 0.69 C ATOM 1205 C MET A 72 -16.066 7.268 8.922 1.00 0.63 C ATOM 1206 O MET A 72 -16.774 8.179 8.495 1.00 0.75 O ATOM 1207 CB MET A 72 -14.394 8.723 10.062 1.00 0.83 C ATOM 1208 CG MET A 72 -13.628 9.090 11.321 1.00 1.02 C ATOM 1209 SD MET A 72 -12.618 10.571 11.111 1.00 1.73 S ATOM 1210 CE MET A 72 -11.524 10.050 9.789 1.00 2.38 C ATOM 0 H MET A 72 -13.488 6.334 10.007 1.00 0.60 H new ATOM 0 HA MET A 72 -15.931 7.567 11.037 1.00 0.69 H new ATOM 0 HB2 MET A 72 -13.685 8.585 9.246 1.00 0.83 H new ATOM 0 HB3 MET A 72 -15.039 9.557 9.786 1.00 0.83 H new ATOM 0 HG2 MET A 72 -14.333 9.248 12.138 1.00 1.02 H new ATOM 0 HG3 MET A 72 -12.988 8.256 11.609 1.00 1.02 H new ATOM 0 HE1 MET A 72 -10.628 10.671 9.792 1.00 2.38 H new ATOM 0 HE2 MET A 72 -11.243 9.008 9.939 1.00 2.38 H new ATOM 0 HE3 MET A 72 -12.035 10.154 8.832 1.00 2.38 H new ATOM 1220 N LEU A 73 -15.987 6.079 8.329 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.617 5.844 7.033 1.00 0.54 C ATOM 1222 C LEU A 73 -18.110 5.730 7.173 1.00 0.50 C ATOM 1223 O LEU A 73 -18.623 5.199 8.160 1.00 0.60 O ATOM 1224 CB LEU A 73 -16.108 4.579 6.333 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.798 3.982 6.840 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -14.446 2.760 6.014 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.677 4.997 6.783 1.00 0.88 C ATOM 0 H LEU A 73 -15.499 5.273 8.719 1.00 0.56 H new ATOM 0 HA LEU A 73 -16.350 6.706 6.422 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -16.881 3.815 6.412 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -15.989 4.804 5.273 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.929 3.690 7.882 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.510 2.333 6.376 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -15.241 2.019 6.103 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -14.333 3.048 4.969 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.756 4.543 7.150 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -13.535 5.324 5.753 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -13.932 5.855 7.405 1.00 0.88 H new ATOM 1239 N ARG A 74 -18.787 6.226 6.164 1.00 0.48 N ATOM 1240 CA ARG A 74 -20.227 6.211 6.112 1.00 0.52 C ATOM 1241 C ARG A 74 -20.688 6.705 4.750 1.00 0.46 C ATOM 1242 O ARG A 74 -19.906 6.739 3.798 1.00 0.45 O ATOM 1243 CB ARG A 74 -20.802 7.075 7.240 1.00 0.65 C ATOM 1244 CG ARG A 74 -20.282 8.486 7.275 1.00 1.17 C ATOM 1245 CD ARG A 74 -20.793 9.187 8.509 1.00 1.64 C ATOM 1246 NE ARG A 74 -20.166 8.666 9.725 1.00 2.05 N ATOM 1247 CZ ARG A 74 -20.191 9.282 10.907 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -20.818 10.445 11.050 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -19.586 8.728 11.949 1.00 3.29 N ATOM 0 H ARG A 74 -18.348 6.655 5.349 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.590 5.193 6.252 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -21.887 7.104 7.141 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -20.582 6.597 8.194 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -19.192 8.482 7.273 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -20.601 9.023 6.382 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -20.597 10.256 8.428 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -21.874 9.065 8.576 1.00 1.64 H new ATOM 0 HE ARG A 74 -19.678 7.773 9.664 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -21.286 10.874 10.251 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -20.832 10.909 11.958 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -19.105 7.835 11.844 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -19.602 9.195 12.856 1.00 3.29 H new ATOM 1263 N ASN A 75 -21.948 7.073 4.661 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.532 7.541 3.408 1.00 0.47 C ATOM 1265 C ASN A 75 -21.806 8.775 2.886 1.00 0.48 C ATOM 1266 O ASN A 75 -21.981 9.878 3.404 1.00 0.56 O ATOM 1267 CB ASN A 75 -24.023 7.842 3.593 1.00 0.52 C ATOM 1268 CG ASN A 75 -24.874 6.592 3.502 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -25.408 6.266 2.443 1.00 0.72 O ATOM 1270 ND2 ASN A 75 -24.995 5.874 4.601 1.00 0.51 N ATOM 0 H ASN A 75 -22.599 7.059 5.446 1.00 0.49 H new ATOM 0 HA ASN A 75 -22.420 6.747 2.670 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -24.179 8.316 4.562 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -24.345 8.555 2.834 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -25.546 5.016 4.591 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -24.537 6.177 5.461 1.00 0.51 H new ATOM 1277 N GLY A 76 -20.954 8.575 1.888 1.00 0.45 N ATOM 1278 CA GLY A 76 -20.291 9.691 1.248 1.00 0.51 C ATOM 1279 C GLY A 76 -18.787 9.521 1.158 1.00 0.47 C ATOM 1280 O GLY A 76 -18.126 10.231 0.396 1.00 0.55 O ATOM 0 H GLY A 76 -20.711 7.659 1.511 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -20.696 9.819 0.244 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -20.515 10.604 1.801 1.00 0.51 H new ATOM 1284 N ASP A 77 -18.238 8.588 1.928 1.00 0.42 N ATOM 1285 CA ASP A 77 -16.795 8.380 1.948 1.00 0.42 C ATOM 1286 C ASP A 77 -16.337 7.580 0.738 1.00 0.38 C ATOM 1287 O ASP A 77 -16.980 6.608 0.334 1.00 0.40 O ATOM 1288 CB ASP A 77 -16.364 7.676 3.235 1.00 0.44 C ATOM 1289 CG ASP A 77 -16.560 8.546 4.457 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -17.675 8.548 5.011 1.00 1.00 O ATOM 1291 OD2 ASP A 77 -15.602 9.237 4.863 1.00 1.05 O ATOM 0 H ASP A 77 -18.766 7.968 2.542 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.322 9.361 1.910 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -16.935 6.755 3.352 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -15.314 7.393 3.158 1.00 0.44 H new ATOM 1296 N THR A 78 -15.234 8.011 0.153 1.00 0.36 N ATOM 1297 CA THR A 78 -14.647 7.329 -0.984 1.00 0.35 C ATOM 1298 C THR A 78 -13.700 6.231 -0.500 1.00 0.31 C ATOM 1299 O THR A 78 -12.832 6.479 0.338 1.00 0.34 O ATOM 1300 CB THR A 78 -13.869 8.328 -1.863 1.00 0.42 C ATOM 1301 OG1 THR A 78 -14.628 9.537 -2.004 1.00 0.50 O ATOM 1302 CG2 THR A 78 -13.587 7.749 -3.242 1.00 0.42 C ATOM 0 H THR A 78 -14.722 8.841 0.452 1.00 0.36 H new ATOM 0 HA THR A 78 -15.448 6.884 -1.574 1.00 0.35 H new ATOM 0 HB THR A 78 -12.917 8.536 -1.376 1.00 0.42 H new ATOM 0 HG1 THR A 78 -14.131 10.172 -2.562 1.00 0.50 H new ATOM 0 HG21 THR A 78 -13.037 8.478 -3.837 1.00 0.42 H new ATOM 0 HG22 THR A 78 -12.993 6.841 -3.141 1.00 0.42 H new ATOM 0 HG23 THR A 78 -14.529 7.513 -3.737 1.00 0.42 H new ATOM 1310 N MET A 79 -13.860 5.027 -1.028 1.00 0.27 N ATOM 1311 CA MET A 79 -13.028 3.910 -0.625 1.00 0.27 C ATOM 1312 C MET A 79 -12.436 3.249 -1.858 1.00 0.28 C ATOM 1313 O MET A 79 -13.147 2.669 -2.675 1.00 0.27 O ATOM 1314 CB MET A 79 -13.826 2.892 0.191 1.00 0.23 C ATOM 1315 CG MET A 79 -12.943 1.928 0.969 1.00 0.27 C ATOM 1316 SD MET A 79 -13.886 0.696 1.887 1.00 0.65 S ATOM 1317 CE MET A 79 -14.506 -0.315 0.550 1.00 0.24 C ATOM 0 H MET A 79 -14.559 4.801 -1.736 1.00 0.27 H new ATOM 0 HA MET A 79 -12.224 4.286 0.008 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.476 3.422 0.887 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.472 2.324 -0.479 1.00 0.23 H new ATOM 0 HG2 MET A 79 -12.270 1.421 0.277 1.00 0.27 H new ATOM 0 HG3 MET A 79 -12.321 2.493 1.663 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.495 -1.363 0.851 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.527 -0.017 0.311 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.875 -0.183 -0.329 1.00 0.24 H new ATOM 1327 N GLU A 80 -11.136 3.357 -1.986 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.434 2.874 -3.156 1.00 0.35 C ATOM 1329 C GLU A 80 -10.135 1.383 -3.009 1.00 0.33 C ATOM 1330 O GLU A 80 -9.535 0.965 -2.016 1.00 0.33 O ATOM 1331 CB GLU A 80 -9.134 3.676 -3.296 1.00 0.40 C ATOM 1332 CG GLU A 80 -8.533 3.671 -4.690 1.00 0.53 C ATOM 1333 CD GLU A 80 -7.480 4.744 -4.867 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -7.851 5.933 -4.944 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -6.278 4.413 -4.937 1.00 1.04 O ATOM 0 H GLU A 80 -10.532 3.782 -1.283 1.00 0.32 H new ATOM 0 HA GLU A 80 -11.046 3.005 -4.048 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -9.326 4.708 -3.002 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.399 3.276 -2.597 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -8.090 2.695 -4.889 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -9.325 3.818 -5.425 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.543 0.573 -3.984 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.203 -0.841 -3.983 1.00 0.33 C ATOM 1344 C TYR A 81 -8.996 -1.031 -4.873 1.00 0.36 C ATOM 1345 O TYR A 81 -9.105 -1.070 -6.099 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.377 -1.697 -4.478 1.00 0.33 C ATOM 1347 CG TYR A 81 -11.139 -3.197 -4.387 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -11.257 -3.868 -3.176 1.00 0.34 C ATOM 1349 CD2 TYR A 81 -10.802 -3.942 -5.513 1.00 0.37 C ATOM 1350 CE1 TYR A 81 -11.045 -5.232 -3.088 1.00 0.36 C ATOM 1351 CE2 TYR A 81 -10.589 -5.307 -5.431 1.00 0.39 C ATOM 1352 CZ TYR A 81 -10.712 -5.946 -4.217 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.497 -7.305 -4.135 1.00 0.42 O ATOM 0 H TYR A 81 -11.107 0.873 -4.779 1.00 0.33 H new ATOM 0 HA TYR A 81 -9.980 -1.163 -2.966 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.265 -1.446 -3.898 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.590 -1.437 -5.515 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -11.519 -3.314 -2.287 1.00 0.34 H new ATOM 0 HD2 TYR A 81 -10.705 -3.446 -6.468 1.00 0.37 H new ATOM 0 HE1 TYR A 81 -11.140 -5.735 -2.137 1.00 0.36 H new ATOM 0 HE2 TYR A 81 -10.327 -5.869 -6.315 1.00 0.39 H new ATOM 0 HH TYR A 81 -10.272 -7.655 -5.022 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.848 -1.109 -4.249 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.596 -1.069 -4.981 1.00 0.39 C ATOM 1365 C ARG A 82 -5.628 -2.115 -4.476 1.00 0.40 C ATOM 1366 O ARG A 82 -5.883 -2.783 -3.478 1.00 0.42 O ATOM 1367 CB ARG A 82 -5.968 0.316 -4.880 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.785 0.790 -3.450 1.00 0.44 C ATOM 1369 CD ARG A 82 -4.997 2.083 -3.392 1.00 0.56 C ATOM 1370 NE ARG A 82 -3.630 1.913 -3.884 1.00 0.65 N ATOM 1371 CZ ARG A 82 -2.989 2.829 -4.602 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -3.620 3.933 -4.979 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -1.728 2.628 -4.970 1.00 1.03 N ATOM 0 H ARG A 82 -7.748 -1.200 -3.238 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.815 -1.288 -6.026 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -4.999 0.305 -5.378 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.593 1.031 -5.415 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.760 0.936 -2.986 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.269 0.022 -2.874 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -5.504 2.844 -3.985 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -4.970 2.446 -2.364 1.00 0.56 H new ATOM 0 HE ARG A 82 -3.143 1.044 -3.664 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -4.595 4.077 -4.718 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -3.130 4.638 -5.530 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -1.249 1.768 -4.701 1.00 1.03 H new ATOM 0 HH22 ARG A 82 -1.239 3.333 -5.521 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.508 -2.235 -5.159 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.460 -3.129 -4.729 1.00 0.45 C ATOM 1389 C LYS A 83 -2.753 -2.536 -3.520 1.00 0.42 C ATOM 1390 O LYS A 83 -2.396 -1.357 -3.521 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.485 -3.392 -5.883 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.349 -4.338 -5.536 1.00 0.60 C ATOM 1393 CD LYS A 83 -0.930 -5.175 -6.734 1.00 0.70 C ATOM 1394 CE LYS A 83 0.307 -5.998 -6.420 1.00 1.25 C ATOM 1395 NZ LYS A 83 0.572 -7.044 -7.445 1.00 1.74 N ATOM 0 H LYS A 83 -4.303 -1.722 -6.016 1.00 0.43 H new ATOM 0 HA LYS A 83 -3.888 -4.088 -4.437 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.040 -3.803 -6.726 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -2.064 -2.442 -6.211 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -0.495 -3.765 -5.176 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -1.658 -4.995 -4.723 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -1.747 -5.836 -7.023 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -0.731 -4.524 -7.585 1.00 0.70 H new ATOM 0 HE2 LYS A 83 1.171 -5.337 -6.349 1.00 1.25 H new ATOM 0 HE3 LYS A 83 0.187 -6.471 -5.446 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 1.598 -7.161 -7.564 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 0.154 -7.945 -7.137 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 0.149 -6.758 -8.351 1.00 1.74 H new ATOM 1409 N LYS A 84 -2.598 -3.355 -2.480 1.00 0.44 N ATOM 1410 CA LYS A 84 -1.921 -2.956 -1.249 1.00 0.46 C ATOM 1411 C LYS A 84 -0.553 -2.392 -1.560 1.00 0.46 C ATOM 1412 O LYS A 84 -0.049 -1.507 -0.875 1.00 0.52 O ATOM 1413 CB LYS A 84 -1.721 -4.163 -0.331 1.00 0.54 C ATOM 1414 CG LYS A 84 -2.991 -4.811 0.185 1.00 0.55 C ATOM 1415 CD LYS A 84 -3.665 -3.963 1.242 1.00 0.66 C ATOM 1416 CE LYS A 84 -4.512 -4.821 2.167 1.00 0.67 C ATOM 1417 NZ LYS A 84 -3.694 -5.845 2.875 1.00 1.32 N ATOM 0 H LYS A 84 -2.940 -4.316 -2.469 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.543 -2.206 -0.761 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -1.144 -4.915 -0.869 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.120 -3.851 0.523 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -3.679 -4.973 -0.644 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -2.756 -5.791 0.600 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -2.911 -3.431 1.822 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -4.291 -3.209 0.764 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -5.010 -4.185 2.898 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -5.293 -5.315 1.590 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -4.173 -6.125 3.755 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -3.577 -6.679 2.264 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -2.760 -5.448 3.101 1.00 1.32 H new ATOM 1431 N GLN A 85 0.033 -2.923 -2.610 1.00 0.44 N ATOM 1432 CA GLN A 85 1.405 -2.654 -2.947 1.00 0.47 C ATOM 1433 C GLN A 85 1.498 -1.586 -4.015 1.00 0.52 C ATOM 1434 O GLN A 85 0.585 -1.414 -4.823 1.00 0.83 O ATOM 1435 CB GLN A 85 2.068 -3.939 -3.442 1.00 0.53 C ATOM 1436 CG GLN A 85 1.280 -5.198 -3.115 1.00 0.50 C ATOM 1437 CD GLN A 85 2.117 -6.452 -3.211 1.00 0.64 C ATOM 1438 OE1 GLN A 85 2.267 -7.036 -4.282 1.00 1.10 O ATOM 1439 NE2 GLN A 85 2.628 -6.901 -2.080 1.00 0.72 N ATOM 0 H GLN A 85 -0.436 -3.558 -3.256 1.00 0.44 H new ATOM 0 HA GLN A 85 1.919 -2.293 -2.056 1.00 0.47 H new ATOM 0 HB2 GLN A 85 2.203 -3.875 -4.522 1.00 0.53 H new ATOM 0 HB3 GLN A 85 3.062 -4.018 -3.001 1.00 0.53 H new ATOM 0 HG2 GLN A 85 0.872 -5.115 -2.108 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.433 -5.279 -3.796 1.00 0.50 H new ATOM 0 HE21 GLN A 85 2.479 -6.385 -1.213 1.00 0.72 H new ATOM 0 HE22 GLN A 85 3.172 -7.764 -2.073 1.00 0.72 H new ATOM 1448 N ARG A 86 2.605 -0.879 -4.009 1.00 0.50 N ATOM 1449 CA ARG A 86 2.888 0.109 -5.030 1.00 0.52 C ATOM 1450 C ARG A 86 4.285 -0.131 -5.591 1.00 0.50 C ATOM 1451 O ARG A 86 5.141 -0.692 -4.902 1.00 0.53 O ATOM 1452 CB ARG A 86 2.724 1.540 -4.484 1.00 0.67 C ATOM 1453 CG ARG A 86 3.067 1.723 -3.008 1.00 0.85 C ATOM 1454 CD ARG A 86 4.536 1.466 -2.711 1.00 0.98 C ATOM 1455 NE ARG A 86 5.420 2.151 -3.650 1.00 1.13 N ATOM 1456 CZ ARG A 86 5.771 3.431 -3.566 1.00 1.24 C ATOM 1457 NH1 ARG A 86 5.300 4.201 -2.587 1.00 1.62 N ATOM 1458 NH2 ARG A 86 6.592 3.942 -4.475 1.00 1.85 N ATOM 0 H ARG A 86 3.333 -0.970 -3.300 1.00 0.50 H new ATOM 0 HA ARG A 86 2.167 0.004 -5.841 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.354 2.209 -5.071 1.00 0.67 H new ATOM 0 HB3 ARG A 86 1.692 1.854 -4.641 1.00 0.67 H new ATOM 0 HG2 ARG A 86 2.811 2.738 -2.703 1.00 0.85 H new ATOM 0 HG3 ARG A 86 2.456 1.046 -2.411 1.00 0.85 H new ATOM 0 HD2 ARG A 86 4.762 1.795 -1.697 1.00 0.98 H new ATOM 0 HD3 ARG A 86 4.730 0.394 -2.749 1.00 0.98 H new ATOM 0 HE ARG A 86 5.796 1.608 -4.427 1.00 1.13 H new ATOM 0 HH11 ARG A 86 4.664 3.810 -1.892 1.00 1.62 H new ATOM 0 HH12 ARG A 86 5.576 5.181 -2.532 1.00 1.62 H new ATOM 0 HH21 ARG A 86 6.948 3.354 -5.229 1.00 1.85 H new ATOM 0 HH22 ARG A 86 6.867 4.923 -4.420 1.00 1.85 H new ATOM 1472 N PRO A 87 4.535 0.268 -6.845 1.00 0.52 N ATOM 1473 CA PRO A 87 5.807 0.001 -7.517 1.00 0.52 C ATOM 1474 C PRO A 87 6.979 0.701 -6.842 1.00 0.53 C ATOM 1475 O PRO A 87 6.997 1.927 -6.697 1.00 0.62 O ATOM 1476 CB PRO A 87 5.604 0.554 -8.934 1.00 0.57 C ATOM 1477 CG PRO A 87 4.131 0.696 -9.094 1.00 0.86 C ATOM 1478 CD PRO A 87 3.596 0.984 -7.722 1.00 0.60 C ATOM 0 HA PRO A 87 6.053 -1.061 -7.495 1.00 0.52 H new ATOM 0 HB2 PRO A 87 6.107 1.513 -9.058 1.00 0.57 H new ATOM 0 HB3 PRO A 87 6.017 -0.122 -9.683 1.00 0.57 H new ATOM 0 HG2 PRO A 87 3.889 1.503 -9.785 1.00 0.86 H new ATOM 0 HG3 PRO A 87 3.692 -0.215 -9.501 1.00 0.86 H new ATOM 0 HD2 PRO A 87 3.581 2.053 -7.511 1.00 0.60 H new ATOM 0 HD3 PRO A 87 2.575 0.621 -7.602 1.00 0.60 H new ATOM 1486 N LEU A 88 7.922 -0.091 -6.369 1.00 0.50 N ATOM 1487 CA LEU A 88 9.161 0.445 -5.838 1.00 0.53 C ATOM 1488 C LEU A 88 10.299 0.271 -6.832 1.00 0.44 C ATOM 1489 O LEU A 88 10.548 -0.833 -7.316 1.00 0.42 O ATOM 1490 CB LEU A 88 9.527 -0.177 -4.494 1.00 0.63 C ATOM 1491 CG LEU A 88 8.921 0.531 -3.284 1.00 0.88 C ATOM 1492 CD1 LEU A 88 7.700 -0.211 -2.774 1.00 1.19 C ATOM 1493 CD2 LEU A 88 9.962 0.690 -2.193 1.00 1.51 C ATOM 0 H LEU A 88 7.854 -1.108 -6.341 1.00 0.50 H new ATOM 0 HA LEU A 88 9.001 1.510 -5.672 1.00 0.53 H new ATOM 0 HB2 LEU A 88 9.204 -1.218 -4.490 1.00 0.63 H new ATOM 0 HB3 LEU A 88 10.612 -0.179 -4.392 1.00 0.63 H new ATOM 0 HG LEU A 88 8.595 1.524 -3.593 1.00 0.88 H new ATOM 0 HD11 LEU A 88 7.288 0.315 -1.912 1.00 1.19 H new ATOM 0 HD12 LEU A 88 6.949 -0.260 -3.562 1.00 1.19 H new ATOM 0 HD13 LEU A 88 7.985 -1.221 -2.481 1.00 1.19 H new ATOM 0 HD21 LEU A 88 9.517 1.196 -1.336 1.00 1.51 H new ATOM 0 HD22 LEU A 88 10.322 -0.292 -1.887 1.00 1.51 H new ATOM 0 HD23 LEU A 88 10.797 1.281 -2.570 1.00 1.51 H new ATOM 1505 N LYS A 89 10.972 1.366 -7.134 1.00 0.44 N ATOM 1506 CA LYS A 89 12.161 1.332 -7.970 1.00 0.42 C ATOM 1507 C LYS A 89 13.367 1.070 -7.084 1.00 0.39 C ATOM 1508 O LYS A 89 13.759 1.931 -6.313 1.00 0.42 O ATOM 1509 CB LYS A 89 12.333 2.669 -8.697 1.00 0.51 C ATOM 1510 CG LYS A 89 11.132 3.074 -9.540 1.00 0.69 C ATOM 1511 CD LYS A 89 10.936 2.149 -10.729 1.00 0.93 C ATOM 1512 CE LYS A 89 12.048 2.308 -11.751 1.00 1.49 C ATOM 1513 NZ LYS A 89 11.876 1.392 -12.907 1.00 2.11 N ATOM 0 H LYS A 89 10.714 2.298 -6.810 1.00 0.44 H new ATOM 0 HA LYS A 89 12.065 0.543 -8.715 1.00 0.42 H new ATOM 0 HB2 LYS A 89 12.527 3.449 -7.961 1.00 0.51 H new ATOM 0 HB3 LYS A 89 13.212 2.611 -9.339 1.00 0.51 H new ATOM 0 HG2 LYS A 89 10.235 3.065 -8.921 1.00 0.69 H new ATOM 0 HG3 LYS A 89 11.265 4.096 -9.894 1.00 0.69 H new ATOM 0 HD2 LYS A 89 10.903 1.115 -10.385 1.00 0.93 H new ATOM 0 HD3 LYS A 89 9.976 2.359 -11.200 1.00 0.93 H new ATOM 0 HE2 LYS A 89 12.070 3.339 -12.105 1.00 1.49 H new ATOM 0 HE3 LYS A 89 13.009 2.114 -11.274 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 12.801 1.210 -13.346 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 11.465 0.494 -12.580 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 11.241 1.829 -13.605 1.00 2.11 H new ATOM 1527 N ILE A 90 13.958 -0.104 -7.191 1.00 0.36 N ATOM 1528 CA ILE A 90 14.990 -0.511 -6.245 1.00 0.33 C ATOM 1529 C ILE A 90 16.268 -0.894 -6.973 1.00 0.35 C ATOM 1530 O ILE A 90 16.231 -1.671 -7.926 1.00 0.36 O ATOM 1531 CB ILE A 90 14.519 -1.710 -5.385 1.00 0.32 C ATOM 1532 CG1 ILE A 90 13.247 -1.358 -4.605 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.619 -2.154 -4.429 1.00 0.33 C ATOM 1534 CD1 ILE A 90 13.434 -0.242 -3.597 1.00 0.36 C ATOM 0 H ILE A 90 13.747 -0.791 -7.915 1.00 0.36 H new ATOM 0 HA ILE A 90 15.185 0.340 -5.593 1.00 0.33 H new ATOM 0 HB ILE A 90 14.291 -2.536 -6.059 1.00 0.32 H new ATOM 0 HG12 ILE A 90 12.468 -1.070 -5.311 1.00 0.35 H new ATOM 0 HG13 ILE A 90 12.893 -2.248 -4.085 1.00 0.35 H new ATOM 0 HG21 ILE A 90 15.266 -2.997 -3.835 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.498 -2.455 -5.000 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.881 -1.328 -3.767 1.00 0.33 H new ATOM 0 HD11 ILE A 90 12.490 -0.051 -3.086 1.00 0.36 H new ATOM 0 HD12 ILE A 90 14.189 -0.534 -2.867 1.00 0.36 H new ATOM 0 HD13 ILE A 90 13.757 0.663 -4.112 1.00 0.36 H new ATOM 1546 N ARG A 91 17.400 -0.354 -6.533 1.00 0.38 N ATOM 1547 CA ARG A 91 18.687 -0.724 -7.095 1.00 0.43 C ATOM 1548 C ARG A 91 19.442 -1.596 -6.097 1.00 0.42 C ATOM 1549 O ARG A 91 19.671 -1.194 -4.954 1.00 0.44 O ATOM 1550 CB ARG A 91 19.507 0.523 -7.430 1.00 0.52 C ATOM 1551 CG ARG A 91 20.801 0.226 -8.170 1.00 0.57 C ATOM 1552 CD ARG A 91 21.591 1.499 -8.442 1.00 0.74 C ATOM 1553 NE ARG A 91 20.897 2.394 -9.367 1.00 0.72 N ATOM 1554 CZ ARG A 91 20.837 3.718 -9.225 1.00 1.09 C ATOM 1555 NH1 ARG A 91 21.423 4.311 -8.190 1.00 1.82 N ATOM 1556 NH2 ARG A 91 20.186 4.446 -10.120 1.00 1.12 N ATOM 0 H ARG A 91 17.449 0.341 -5.788 1.00 0.38 H new ATOM 0 HA ARG A 91 18.525 -1.283 -8.017 1.00 0.43 H new ATOM 0 HB2 ARG A 91 18.899 1.194 -8.036 1.00 0.52 H new ATOM 0 HB3 ARG A 91 19.741 1.052 -6.506 1.00 0.52 H new ATOM 0 HG2 ARG A 91 21.408 -0.462 -7.582 1.00 0.57 H new ATOM 0 HG3 ARG A 91 20.576 -0.273 -9.113 1.00 0.57 H new ATOM 0 HD2 ARG A 91 21.772 2.020 -7.502 1.00 0.74 H new ATOM 0 HD3 ARG A 91 22.566 1.238 -8.854 1.00 0.74 H new ATOM 0 HE ARG A 91 20.429 1.979 -10.172 1.00 0.72 H new ATOM 0 HH11 ARG A 91 21.923 3.752 -7.498 1.00 1.82 H new ATOM 0 HH12 ARG A 91 21.373 5.325 -8.088 1.00 1.82 H new ATOM 0 HH21 ARG A 91 19.733 3.993 -10.914 1.00 1.12 H new ATOM 0 HH22 ARG A 91 20.138 5.459 -10.015 1.00 1.12 H new ATOM 1570 N MET A 92 19.817 -2.787 -6.532 1.00 0.42 N ATOM 1571 CA MET A 92 20.494 -3.756 -5.680 1.00 0.44 C ATOM 1572 C MET A 92 21.985 -3.469 -5.596 1.00 0.48 C ATOM 1573 O MET A 92 22.497 -2.617 -6.324 1.00 0.51 O ATOM 1574 CB MET A 92 20.264 -5.164 -6.228 1.00 0.46 C ATOM 1575 CG MET A 92 19.144 -5.925 -5.539 1.00 0.57 C ATOM 1576 SD MET A 92 17.689 -4.920 -5.195 1.00 1.04 S ATOM 1577 CE MET A 92 17.092 -4.624 -6.853 1.00 0.34 C ATOM 0 H MET A 92 19.662 -3.112 -7.486 1.00 0.42 H new ATOM 0 HA MET A 92 20.080 -3.680 -4.674 1.00 0.44 H new ATOM 0 HB2 MET A 92 20.040 -5.095 -7.293 1.00 0.46 H new ATOM 0 HB3 MET A 92 21.188 -5.734 -6.133 1.00 0.46 H new ATOM 0 HG2 MET A 92 18.852 -6.769 -6.164 1.00 0.57 H new ATOM 0 HG3 MET A 92 19.520 -6.337 -4.602 1.00 0.57 H new ATOM 0 HE1 MET A 92 16.152 -4.073 -6.808 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.828 -4.041 -7.406 1.00 0.34 H new ATOM 0 HE3 MET A 92 16.930 -5.577 -7.357 1.00 0.34 H new ATOM 1587 N LEU A 93 22.673 -4.225 -4.737 1.00 0.49 N ATOM 1588 CA LEU A 93 24.079 -3.973 -4.401 1.00 0.55 C ATOM 1589 C LEU A 93 24.959 -3.996 -5.642 1.00 0.61 C ATOM 1590 O LEU A 93 25.872 -3.184 -5.786 1.00 0.69 O ATOM 1591 CB LEU A 93 24.608 -5.018 -3.401 1.00 0.57 C ATOM 1592 CG LEU A 93 23.878 -5.122 -2.053 1.00 0.57 C ATOM 1593 CD1 LEU A 93 23.540 -3.744 -1.505 1.00 0.68 C ATOM 1594 CD2 LEU A 93 22.629 -5.989 -2.166 1.00 0.79 C ATOM 0 H LEU A 93 22.272 -5.029 -4.254 1.00 0.49 H new ATOM 0 HA LEU A 93 24.121 -2.982 -3.948 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.573 -5.996 -3.882 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.657 -4.797 -3.203 1.00 0.57 H new ATOM 0 HG LEU A 93 24.554 -5.605 -1.348 1.00 0.57 H new ATOM 0 HD11 LEU A 93 23.024 -3.849 -0.551 1.00 0.68 H new ATOM 0 HD12 LEU A 93 24.458 -3.175 -1.361 1.00 0.68 H new ATOM 0 HD13 LEU A 93 22.895 -3.220 -2.211 1.00 0.68 H new ATOM 0 HD21 LEU A 93 22.135 -6.043 -1.196 1.00 0.79 H new ATOM 0 HD22 LEU A 93 21.948 -5.552 -2.896 1.00 0.79 H new ATOM 0 HD23 LEU A 93 22.910 -6.992 -2.486 1.00 0.79 H new ATOM 1606 N ASP A 94 24.676 -4.935 -6.538 1.00 0.61 N ATOM 1607 CA ASP A 94 25.449 -5.090 -7.765 1.00 0.69 C ATOM 1608 C ASP A 94 25.197 -3.921 -8.713 1.00 0.66 C ATOM 1609 O ASP A 94 25.916 -3.728 -9.693 1.00 0.70 O ATOM 1610 CB ASP A 94 25.088 -6.413 -8.447 1.00 0.76 C ATOM 1611 CG ASP A 94 26.009 -6.752 -9.602 1.00 1.47 C ATOM 1612 OD1 ASP A 94 27.177 -7.116 -9.348 1.00 2.26 O ATOM 1613 OD2 ASP A 94 25.571 -6.661 -10.769 1.00 1.93 O ATOM 0 H ASP A 94 23.913 -5.604 -6.437 1.00 0.61 H new ATOM 0 HA ASP A 94 26.508 -5.100 -7.509 1.00 0.69 H new ATOM 0 HB2 ASP A 94 25.125 -7.217 -7.712 1.00 0.76 H new ATOM 0 HB3 ASP A 94 24.062 -6.360 -8.811 1.00 0.76 H new ATOM 1618 N GLY A 95 24.177 -3.136 -8.402 1.00 0.61 N ATOM 1619 CA GLY A 95 23.828 -2.004 -9.229 1.00 0.61 C ATOM 1620 C GLY A 95 22.680 -2.335 -10.147 1.00 0.58 C ATOM 1621 O GLY A 95 22.415 -1.625 -11.116 1.00 0.64 O ATOM 0 H GLY A 95 23.581 -3.266 -7.584 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.560 -1.157 -8.597 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.693 -1.700 -9.819 1.00 0.61 H new ATOM 1625 N THR A 96 21.997 -3.424 -9.840 1.00 0.54 N ATOM 1626 CA THR A 96 20.904 -3.902 -10.668 1.00 0.54 C ATOM 1627 C THR A 96 19.582 -3.363 -10.153 1.00 0.47 C ATOM 1628 O THR A 96 19.267 -3.510 -8.978 1.00 0.47 O ATOM 1629 CB THR A 96 20.869 -5.442 -10.669 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.175 -5.947 -10.969 1.00 0.81 O ATOM 1631 CG2 THR A 96 19.867 -5.973 -11.684 1.00 0.61 C ATOM 0 H THR A 96 22.182 -3.997 -9.017 1.00 0.54 H new ATOM 0 HA THR A 96 21.062 -3.548 -11.687 1.00 0.54 H new ATOM 0 HB THR A 96 20.557 -5.779 -9.680 1.00 0.62 H new ATOM 0 HG1 THR A 96 22.155 -6.927 -10.968 1.00 0.81 H new ATOM 0 HG21 THR A 96 19.867 -7.063 -11.659 1.00 0.61 H new ATOM 0 HG22 THR A 96 18.871 -5.604 -11.439 1.00 0.61 H new ATOM 0 HG23 THR A 96 20.145 -5.633 -12.682 1.00 0.61 H new ATOM 1639 N VAL A 97 18.809 -2.747 -11.024 1.00 0.45 N ATOM 1640 CA VAL A 97 17.570 -2.121 -10.606 1.00 0.41 C ATOM 1641 C VAL A 97 16.362 -2.944 -11.053 1.00 0.38 C ATOM 1642 O VAL A 97 16.303 -3.429 -12.184 1.00 0.41 O ATOM 1643 CB VAL A 97 17.465 -0.661 -11.120 1.00 0.50 C ATOM 1644 CG1 VAL A 97 17.629 -0.595 -12.628 1.00 1.07 C ATOM 1645 CG2 VAL A 97 16.150 -0.019 -10.698 1.00 1.11 C ATOM 0 H VAL A 97 19.014 -2.666 -12.020 1.00 0.45 H new ATOM 0 HA VAL A 97 17.574 -2.086 -9.517 1.00 0.41 H new ATOM 0 HB VAL A 97 18.279 -0.097 -10.664 1.00 0.50 H new ATOM 0 HG11 VAL A 97 17.550 0.441 -12.958 1.00 1.07 H new ATOM 0 HG12 VAL A 97 18.606 -0.991 -12.905 1.00 1.07 H new ATOM 0 HG13 VAL A 97 16.848 -1.188 -13.105 1.00 1.07 H new ATOM 0 HG21 VAL A 97 16.107 1.003 -11.074 1.00 1.11 H new ATOM 0 HG22 VAL A 97 15.318 -0.591 -11.108 1.00 1.11 H new ATOM 0 HG23 VAL A 97 16.083 -0.009 -9.610 1.00 1.11 H new ATOM 1655 N LYS A 98 15.411 -3.096 -10.147 1.00 0.35 N ATOM 1656 CA LYS A 98 14.178 -3.806 -10.447 1.00 0.35 C ATOM 1657 C LYS A 98 13.004 -3.050 -9.856 1.00 0.36 C ATOM 1658 O LYS A 98 13.172 -2.258 -8.927 1.00 0.37 O ATOM 1659 CB LYS A 98 14.192 -5.250 -9.915 1.00 0.38 C ATOM 1660 CG LYS A 98 13.987 -5.376 -8.409 1.00 0.41 C ATOM 1661 CD LYS A 98 13.631 -6.805 -8.002 1.00 0.43 C ATOM 1662 CE LYS A 98 12.222 -7.185 -8.434 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.162 -7.698 -9.830 1.00 0.94 N ATOM 0 H LYS A 98 15.469 -2.736 -9.194 1.00 0.35 H new ATOM 0 HA LYS A 98 14.083 -3.862 -11.531 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.412 -5.818 -10.423 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.144 -5.711 -10.178 1.00 0.38 H new ATOM 0 HG2 LYS A 98 14.895 -5.066 -7.892 1.00 0.41 H new ATOM 0 HG3 LYS A 98 13.193 -4.700 -8.092 1.00 0.41 H new ATOM 0 HD2 LYS A 98 14.346 -7.498 -8.446 1.00 0.43 H new ATOM 0 HD3 LYS A 98 13.719 -6.907 -6.920 1.00 0.43 H new ATOM 0 HE2 LYS A 98 11.832 -7.944 -7.756 1.00 0.43 H new ATOM 0 HE3 LYS A 98 11.573 -6.314 -8.344 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 11.695 -6.995 -10.438 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 13.127 -7.871 -10.178 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 11.622 -8.587 -9.850 1.00 0.94 H new ATOM 1677 N THR A 99 11.825 -3.270 -10.403 1.00 0.40 N ATOM 1678 CA THR A 99 10.621 -2.690 -9.854 1.00 0.44 C ATOM 1679 C THR A 99 9.731 -3.796 -9.310 1.00 0.47 C ATOM 1680 O THR A 99 9.302 -4.680 -10.053 1.00 0.58 O ATOM 1681 CB THR A 99 9.858 -1.884 -10.916 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.740 -0.929 -11.523 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.671 -1.168 -10.294 1.00 0.57 C ATOM 0 H THR A 99 11.678 -3.849 -11.230 1.00 0.40 H new ATOM 0 HA THR A 99 10.901 -2.009 -9.050 1.00 0.44 H new ATOM 0 HB THR A 99 9.487 -2.571 -11.677 1.00 0.48 H new ATOM 0 HG1 THR A 99 11.398 -1.398 -12.078 1.00 0.50 H new ATOM 0 HG21 THR A 99 8.144 -0.603 -11.062 1.00 0.57 H new ATOM 0 HG22 THR A 99 7.994 -1.900 -9.854 1.00 0.57 H new ATOM 0 HG23 THR A 99 9.022 -0.487 -9.519 1.00 0.57 H new ATOM 1691 N ILE A 100 9.477 -3.762 -8.015 1.00 0.42 N ATOM 1692 CA ILE A 100 8.712 -4.806 -7.363 1.00 0.44 C ATOM 1693 C ILE A 100 7.546 -4.179 -6.601 1.00 0.45 C ATOM 1694 O ILE A 100 7.649 -3.045 -6.120 1.00 0.45 O ATOM 1695 CB ILE A 100 9.624 -5.645 -6.422 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.918 -6.919 -5.928 1.00 0.61 C ATOM 1697 CG2 ILE A 100 10.116 -4.809 -5.244 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.184 -6.772 -4.611 1.00 0.50 C ATOM 0 H ILE A 100 9.792 -3.018 -7.392 1.00 0.42 H new ATOM 0 HA ILE A 100 8.309 -5.486 -8.114 1.00 0.44 H new ATOM 0 HB ILE A 100 10.490 -5.955 -7.007 1.00 0.48 H new ATOM 0 HG12 ILE A 100 8.207 -7.241 -6.689 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.659 -7.712 -5.828 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.751 -5.421 -4.603 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.688 -3.958 -5.615 1.00 0.48 H new ATOM 0 HG23 ILE A 100 9.261 -4.450 -4.671 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.719 -7.721 -4.346 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.889 -6.483 -3.832 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.415 -6.005 -4.707 1.00 0.50 H new ATOM 1710 N MET A 101 6.433 -4.891 -6.526 1.00 0.47 N ATOM 1711 CA MET A 101 5.257 -4.377 -5.843 1.00 0.50 C ATOM 1712 C MET A 101 5.277 -4.785 -4.379 1.00 0.50 C ATOM 1713 O MET A 101 5.164 -5.961 -4.042 1.00 0.52 O ATOM 1714 CB MET A 101 3.989 -4.928 -6.502 1.00 0.56 C ATOM 1715 CG MET A 101 3.899 -4.661 -7.997 1.00 0.64 C ATOM 1716 SD MET A 101 3.761 -2.909 -8.384 1.00 0.98 S ATOM 1717 CE MET A 101 2.283 -2.492 -7.464 1.00 0.59 C ATOM 0 H MET A 101 6.319 -5.822 -6.927 1.00 0.47 H new ATOM 0 HA MET A 101 5.263 -3.289 -5.913 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.943 -6.004 -6.333 1.00 0.56 H new ATOM 0 HB3 MET A 101 3.119 -4.490 -6.013 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.782 -5.069 -8.488 1.00 0.64 H new ATOM 0 HG3 MET A 101 3.036 -5.188 -8.404 1.00 0.64 H new ATOM 0 HE1 MET A 101 1.846 -1.580 -7.871 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.563 -3.306 -7.544 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.539 -2.336 -6.416 1.00 0.59 H new ATOM 1727 N VAL A 102 5.432 -3.791 -3.518 1.00 0.50 N ATOM 1728 CA VAL A 102 5.444 -4.018 -2.080 1.00 0.53 C ATOM 1729 C VAL A 102 4.399 -3.152 -1.393 1.00 0.49 C ATOM 1730 O VAL A 102 4.222 -1.984 -1.749 1.00 0.50 O ATOM 1731 CB VAL A 102 6.824 -3.733 -1.455 1.00 0.61 C ATOM 1732 CG1 VAL A 102 7.168 -4.807 -0.441 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.905 -3.625 -2.520 1.00 0.90 C ATOM 0 H VAL A 102 5.552 -2.816 -3.791 1.00 0.50 H new ATOM 0 HA VAL A 102 5.212 -5.072 -1.929 1.00 0.53 H new ATOM 0 HB VAL A 102 6.775 -2.771 -0.944 1.00 0.61 H new ATOM 0 HG11 VAL A 102 8.145 -4.597 -0.005 1.00 0.73 H new ATOM 0 HG12 VAL A 102 6.414 -4.819 0.346 1.00 0.73 H new ATOM 0 HG13 VAL A 102 7.193 -5.779 -0.934 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.865 -3.424 -2.045 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.964 -4.561 -3.075 1.00 0.90 H new ATOM 0 HG23 VAL A 102 7.662 -2.812 -3.204 1.00 0.90 H new ATOM 1743 N ASP A 103 3.706 -3.743 -0.425 1.00 0.48 N ATOM 1744 CA ASP A 103 2.586 -3.101 0.269 1.00 0.47 C ATOM 1745 C ASP A 103 2.953 -1.718 0.809 1.00 0.46 C ATOM 1746 O ASP A 103 4.004 -1.539 1.423 1.00 0.51 O ATOM 1747 CB ASP A 103 2.112 -3.982 1.430 1.00 0.51 C ATOM 1748 CG ASP A 103 1.706 -5.376 1.000 1.00 1.22 C ATOM 1749 OD1 ASP A 103 2.549 -6.104 0.440 1.00 1.96 O ATOM 1750 OD2 ASP A 103 0.536 -5.745 1.213 1.00 1.56 O ATOM 0 H ASP A 103 3.904 -4.688 -0.095 1.00 0.48 H new ATOM 0 HA ASP A 103 1.788 -2.976 -0.463 1.00 0.47 H new ATOM 0 HB2 ASP A 103 2.909 -4.056 2.170 1.00 0.51 H new ATOM 0 HB3 ASP A 103 1.266 -3.500 1.920 1.00 0.51 H new ATOM 1755 N ASP A 104 2.078 -0.750 0.574 1.00 0.46 N ATOM 1756 CA ASP A 104 2.237 0.596 1.128 1.00 0.47 C ATOM 1757 C ASP A 104 1.744 0.611 2.569 1.00 0.46 C ATOM 1758 O ASP A 104 2.107 1.475 3.368 1.00 0.54 O ATOM 1759 CB ASP A 104 1.441 1.613 0.300 1.00 0.54 C ATOM 1760 CG ASP A 104 1.454 3.010 0.904 1.00 0.66 C ATOM 1761 OD1 ASP A 104 2.480 3.722 0.751 1.00 1.08 O ATOM 1762 OD2 ASP A 104 0.448 3.391 1.538 1.00 0.64 O ATOM 0 H ASP A 104 1.244 -0.869 -0.000 1.00 0.46 H new ATOM 0 HA ASP A 104 3.292 0.869 1.097 1.00 0.47 H new ATOM 0 HB2 ASP A 104 1.853 1.655 -0.708 1.00 0.54 H new ATOM 0 HB3 ASP A 104 0.410 1.272 0.209 1.00 0.54 H new ATOM 1767 N SER A 105 0.937 -0.388 2.895 1.00 0.43 N ATOM 1768 CA SER A 105 0.275 -0.463 4.184 1.00 0.49 C ATOM 1769 C SER A 105 1.242 -0.844 5.299 1.00 0.57 C ATOM 1770 O SER A 105 0.956 -0.636 6.479 1.00 0.96 O ATOM 1771 CB SER A 105 -0.856 -1.481 4.092 1.00 0.52 C ATOM 1772 OG SER A 105 -0.465 -2.593 3.302 1.00 1.27 O ATOM 0 H SER A 105 0.724 -1.167 2.272 1.00 0.43 H new ATOM 0 HA SER A 105 -0.122 0.522 4.431 1.00 0.49 H new ATOM 0 HB2 SER A 105 -1.132 -1.817 5.091 1.00 0.52 H new ATOM 0 HB3 SER A 105 -1.739 -1.013 3.658 1.00 0.52 H new ATOM 0 HG SER A 105 -1.202 -3.237 3.255 1.00 1.27 H new ATOM 1778 N LYS A 106 2.388 -1.388 4.919 1.00 0.45 N ATOM 1779 CA LYS A 106 3.355 -1.868 5.884 1.00 0.49 C ATOM 1780 C LYS A 106 4.698 -1.163 5.692 1.00 0.52 C ATOM 1781 O LYS A 106 4.934 -0.522 4.664 1.00 0.65 O ATOM 1782 CB LYS A 106 3.492 -3.387 5.751 1.00 0.58 C ATOM 1783 CG LYS A 106 3.980 -3.832 4.387 1.00 0.69 C ATOM 1784 CD LYS A 106 5.482 -3.981 4.370 1.00 0.58 C ATOM 1785 CE LYS A 106 6.009 -4.154 2.967 1.00 1.00 C ATOM 1786 NZ LYS A 106 6.067 -2.860 2.248 1.00 2.02 N ATOM 0 H LYS A 106 2.668 -1.507 3.945 1.00 0.45 H new ATOM 0 HA LYS A 106 3.011 -1.639 6.893 1.00 0.49 H new ATOM 0 HB2 LYS A 106 4.183 -3.750 6.512 1.00 0.58 H new ATOM 0 HB3 LYS A 106 2.526 -3.850 5.952 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.514 -4.781 4.122 1.00 0.69 H new ATOM 0 HG3 LYS A 106 3.675 -3.106 3.633 1.00 0.69 H new ATOM 0 HD2 LYS A 106 5.940 -3.103 4.825 1.00 0.58 H new ATOM 0 HD3 LYS A 106 5.769 -4.841 4.975 1.00 0.58 H new ATOM 0 HE2 LYS A 106 7.004 -4.597 3.003 1.00 1.00 H new ATOM 0 HE3 LYS A 106 5.371 -4.848 2.420 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 6.630 -2.970 1.380 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 5.104 -2.557 2.000 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 6.508 -2.143 2.859 1.00 2.02 H new ATOM 1800 N THR A 107 5.578 -1.312 6.671 1.00 0.53 N ATOM 1801 CA THR A 107 6.830 -0.567 6.712 1.00 0.57 C ATOM 1802 C THR A 107 7.921 -1.191 5.819 1.00 0.52 C ATOM 1803 O THR A 107 7.626 -1.947 4.890 1.00 0.54 O ATOM 1804 CB THR A 107 7.311 -0.442 8.172 1.00 0.69 C ATOM 1805 OG1 THR A 107 7.425 -1.735 8.766 1.00 0.76 O ATOM 1806 CG2 THR A 107 6.332 0.385 8.981 1.00 0.74 C ATOM 0 H THR A 107 5.447 -1.949 7.456 1.00 0.53 H new ATOM 0 HA THR A 107 6.639 0.427 6.308 1.00 0.57 H new ATOM 0 HB THR A 107 8.285 0.047 8.168 1.00 0.69 H new ATOM 0 HG1 THR A 107 7.733 -1.644 9.692 1.00 0.76 H new ATOM 0 HG21 THR A 107 6.685 0.464 10.009 1.00 0.74 H new ATOM 0 HG22 THR A 107 6.252 1.382 8.547 1.00 0.74 H new ATOM 0 HG23 THR A 107 5.354 -0.095 8.970 1.00 0.74 H new ATOM 1814 N VAL A 108 9.180 -0.851 6.084 1.00 0.49 N ATOM 1815 CA VAL A 108 10.275 -1.203 5.180 1.00 0.47 C ATOM 1816 C VAL A 108 10.854 -2.592 5.451 1.00 0.42 C ATOM 1817 O VAL A 108 11.246 -3.286 4.522 1.00 0.44 O ATOM 1818 CB VAL A 108 11.415 -0.172 5.259 1.00 0.55 C ATOM 1819 CG1 VAL A 108 12.359 -0.309 4.077 1.00 0.61 C ATOM 1820 CG2 VAL A 108 10.862 1.241 5.352 1.00 0.60 C ATOM 0 H VAL A 108 9.468 -0.334 6.915 1.00 0.49 H new ATOM 0 HA VAL A 108 9.838 -1.205 4.182 1.00 0.47 H new ATOM 0 HB VAL A 108 11.985 -0.372 6.166 1.00 0.55 H new ATOM 0 HG11 VAL A 108 13.154 0.432 4.159 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.793 -1.309 4.072 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.808 -0.148 3.151 1.00 0.61 H new ATOM 0 HG21 VAL A 108 11.687 1.952 5.407 1.00 0.60 H new ATOM 0 HG22 VAL A 108 10.257 1.454 4.470 1.00 0.60 H new ATOM 0 HG23 VAL A 108 10.245 1.332 6.246 1.00 0.60 H new ATOM 1830 N THR A 109 10.962 -2.968 6.717 1.00 0.43 N ATOM 1831 CA THR A 109 11.492 -4.281 7.099 1.00 0.43 C ATOM 1832 C THR A 109 10.836 -5.426 6.317 1.00 0.44 C ATOM 1833 O THR A 109 11.526 -6.225 5.673 1.00 0.45 O ATOM 1834 CB THR A 109 11.299 -4.506 8.605 1.00 0.51 C ATOM 1835 OG1 THR A 109 11.778 -3.356 9.311 1.00 0.56 O ATOM 1836 CG2 THR A 109 12.042 -5.748 9.074 1.00 0.56 C ATOM 0 H THR A 109 10.689 -2.382 7.506 1.00 0.43 H new ATOM 0 HA THR A 109 12.554 -4.284 6.854 1.00 0.43 H new ATOM 0 HB THR A 109 10.238 -4.655 8.806 1.00 0.51 H new ATOM 0 HG1 THR A 109 11.657 -3.490 10.274 1.00 0.56 H new ATOM 0 HG21 THR A 109 11.887 -5.882 10.145 1.00 0.56 H new ATOM 0 HG22 THR A 109 11.665 -6.621 8.541 1.00 0.56 H new ATOM 0 HG23 THR A 109 13.107 -5.632 8.873 1.00 0.56 H new ATOM 1844 N ASP A 110 9.513 -5.492 6.369 1.00 0.47 N ATOM 1845 CA ASP A 110 8.751 -6.502 5.640 1.00 0.51 C ATOM 1846 C ASP A 110 8.983 -6.353 4.140 1.00 0.49 C ATOM 1847 O ASP A 110 9.091 -7.335 3.407 1.00 0.54 O ATOM 1848 CB ASP A 110 7.259 -6.357 5.960 1.00 0.57 C ATOM 1849 CG ASP A 110 6.419 -7.460 5.351 1.00 0.65 C ATOM 1850 OD1 ASP A 110 6.327 -8.547 5.957 1.00 0.76 O ATOM 1851 OD2 ASP A 110 5.834 -7.240 4.271 1.00 0.70 O ATOM 0 H ASP A 110 8.937 -4.851 6.915 1.00 0.47 H new ATOM 0 HA ASP A 110 9.086 -7.492 5.949 1.00 0.51 H new ATOM 0 HB2 ASP A 110 7.122 -6.357 7.041 1.00 0.57 H new ATOM 0 HB3 ASP A 110 6.905 -5.393 5.594 1.00 0.57 H new ATOM 1856 N MET A 111 9.093 -5.104 3.706 1.00 0.46 N ATOM 1857 CA MET A 111 9.337 -4.777 2.308 1.00 0.46 C ATOM 1858 C MET A 111 10.654 -5.357 1.827 1.00 0.40 C ATOM 1859 O MET A 111 10.712 -6.023 0.797 1.00 0.43 O ATOM 1860 CB MET A 111 9.376 -3.264 2.136 1.00 0.51 C ATOM 1861 CG MET A 111 9.752 -2.808 0.738 1.00 0.50 C ATOM 1862 SD MET A 111 10.386 -1.125 0.732 1.00 0.75 S ATOM 1863 CE MET A 111 9.187 -0.328 1.786 1.00 0.67 C ATOM 0 H MET A 111 9.015 -4.289 4.314 1.00 0.46 H new ATOM 0 HA MET A 111 8.528 -5.208 1.718 1.00 0.46 H new ATOM 0 HB2 MET A 111 8.398 -2.855 2.389 1.00 0.51 H new ATOM 0 HB3 MET A 111 10.089 -2.847 2.847 1.00 0.51 H new ATOM 0 HG2 MET A 111 10.504 -3.481 0.326 1.00 0.50 H new ATOM 0 HG3 MET A 111 8.879 -2.870 0.088 1.00 0.50 H new ATOM 0 HE1 MET A 111 8.726 0.502 1.250 1.00 0.67 H new ATOM 0 HE2 MET A 111 8.419 -1.047 2.072 1.00 0.67 H new ATOM 0 HE3 MET A 111 9.683 0.049 2.681 1.00 0.67 H new ATOM 1873 N LEU A 112 11.709 -5.091 2.580 1.00 0.36 N ATOM 1874 CA LEU A 112 13.046 -5.519 2.208 1.00 0.34 C ATOM 1875 C LEU A 112 13.115 -7.036 2.167 1.00 0.37 C ATOM 1876 O LEU A 112 13.784 -7.611 1.313 1.00 0.42 O ATOM 1877 CB LEU A 112 14.070 -4.974 3.198 1.00 0.35 C ATOM 1878 CG LEU A 112 15.418 -4.596 2.589 1.00 0.38 C ATOM 1879 CD1 LEU A 112 15.267 -3.389 1.678 1.00 0.39 C ATOM 1880 CD2 LEU A 112 16.425 -4.307 3.679 1.00 0.46 C ATOM 0 H LEU A 112 11.663 -4.576 3.459 1.00 0.36 H new ATOM 0 HA LEU A 112 13.276 -5.128 1.217 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.649 -4.095 3.686 1.00 0.35 H new ATOM 0 HB3 LEU A 112 14.236 -5.721 3.975 1.00 0.35 H new ATOM 0 HG LEU A 112 15.778 -5.437 1.996 1.00 0.38 H new ATOM 0 HD11 LEU A 112 16.236 -3.132 1.251 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.568 -3.624 0.875 1.00 0.39 H new ATOM 0 HD13 LEU A 112 14.888 -2.544 2.253 1.00 0.39 H new ATOM 0 HD21 LEU A 112 17.381 -4.039 3.229 1.00 0.46 H new ATOM 0 HD22 LEU A 112 16.069 -3.480 4.294 1.00 0.46 H new ATOM 0 HD23 LEU A 112 16.552 -5.193 4.301 1.00 0.46 H new ATOM 1892 N MET A 113 12.401 -7.668 3.092 1.00 0.39 N ATOM 1893 CA MET A 113 12.278 -9.120 3.119 1.00 0.46 C ATOM 1894 C MET A 113 11.712 -9.610 1.789 1.00 0.49 C ATOM 1895 O MET A 113 12.224 -10.550 1.182 1.00 0.56 O ATOM 1896 CB MET A 113 11.359 -9.537 4.272 1.00 0.55 C ATOM 1897 CG MET A 113 11.237 -11.041 4.455 1.00 0.61 C ATOM 1898 SD MET A 113 9.978 -11.494 5.666 1.00 0.98 S ATOM 1899 CE MET A 113 10.539 -10.589 7.107 1.00 1.34 C ATOM 0 H MET A 113 11.895 -7.192 3.839 1.00 0.39 H new ATOM 0 HA MET A 113 13.260 -9.567 3.271 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.733 -9.098 5.197 1.00 0.55 H new ATOM 0 HB3 MET A 113 10.366 -9.121 4.100 1.00 0.55 H new ATOM 0 HG2 MET A 113 10.996 -11.501 3.497 1.00 0.61 H new ATOM 0 HG3 MET A 113 12.200 -11.444 4.769 1.00 0.61 H new ATOM 0 HE1 MET A 113 9.922 -10.854 7.966 1.00 1.34 H new ATOM 0 HE2 MET A 113 11.578 -10.844 7.315 1.00 1.34 H new ATOM 0 HE3 MET A 113 10.458 -9.518 6.918 1.00 1.34 H new ATOM 1909 N THR A 114 10.673 -8.926 1.340 1.00 0.47 N ATOM 1910 CA THR A 114 10.033 -9.222 0.071 1.00 0.50 C ATOM 1911 C THR A 114 10.971 -8.953 -1.111 1.00 0.46 C ATOM 1912 O THR A 114 11.045 -9.756 -2.044 1.00 0.49 O ATOM 1913 CB THR A 114 8.745 -8.387 -0.082 1.00 0.54 C ATOM 1914 OG1 THR A 114 7.787 -8.788 0.908 1.00 0.62 O ATOM 1915 CG2 THR A 114 8.142 -8.532 -1.473 1.00 0.60 C ATOM 0 H THR A 114 10.249 -8.149 1.847 1.00 0.47 H new ATOM 0 HA THR A 114 9.782 -10.283 0.067 1.00 0.50 H new ATOM 0 HB THR A 114 9.007 -7.338 0.060 1.00 0.54 H new ATOM 0 HG1 THR A 114 8.050 -8.430 1.782 1.00 0.62 H new ATOM 0 HG21 THR A 114 7.236 -7.929 -1.542 1.00 0.60 H new ATOM 0 HG22 THR A 114 8.861 -8.193 -2.219 1.00 0.60 H new ATOM 0 HG23 THR A 114 7.896 -9.578 -1.656 1.00 0.60 H new ATOM 1923 N ILE A 115 11.718 -7.853 -1.055 1.00 0.43 N ATOM 1924 CA ILE A 115 12.553 -7.438 -2.178 1.00 0.41 C ATOM 1925 C ILE A 115 13.778 -8.336 -2.315 1.00 0.42 C ATOM 1926 O ILE A 115 14.103 -8.789 -3.413 1.00 0.43 O ATOM 1927 CB ILE A 115 13.018 -5.971 -2.038 1.00 0.40 C ATOM 1928 CG1 ILE A 115 11.811 -5.032 -1.960 1.00 0.42 C ATOM 1929 CG2 ILE A 115 13.920 -5.579 -3.204 1.00 0.42 C ATOM 1930 CD1 ILE A 115 12.184 -3.579 -1.752 1.00 0.44 C ATOM 0 H ILE A 115 11.762 -7.234 -0.245 1.00 0.43 H new ATOM 0 HA ILE A 115 11.935 -7.526 -3.072 1.00 0.41 H new ATOM 0 HB ILE A 115 13.590 -5.880 -1.114 1.00 0.40 H new ATOM 0 HG12 ILE A 115 11.232 -5.122 -2.879 1.00 0.42 H new ATOM 0 HG13 ILE A 115 11.164 -5.353 -1.143 1.00 0.42 H new ATOM 0 HG21 ILE A 115 14.237 -4.543 -3.087 1.00 0.42 H new ATOM 0 HG22 ILE A 115 14.797 -6.227 -3.220 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.372 -5.687 -4.140 1.00 0.42 H new ATOM 0 HD11 ILE A 115 11.279 -2.974 -1.707 1.00 0.44 H new ATOM 0 HD12 ILE A 115 12.737 -3.475 -0.818 1.00 0.44 H new ATOM 0 HD13 ILE A 115 12.805 -3.241 -2.581 1.00 0.44 H new ATOM 1942 N CYS A 116 14.443 -8.608 -1.198 1.00 0.43 N ATOM 1943 CA CYS A 116 15.641 -9.439 -1.214 1.00 0.47 C ATOM 1944 C CYS A 116 15.301 -10.847 -1.692 1.00 0.50 C ATOM 1945 O CYS A 116 16.119 -11.519 -2.322 1.00 0.53 O ATOM 1946 CB CYS A 116 16.288 -9.490 0.174 1.00 0.51 C ATOM 1947 SG CYS A 116 15.275 -10.274 1.452 1.00 1.56 S ATOM 0 H CYS A 116 14.175 -8.267 -0.275 1.00 0.43 H new ATOM 0 HA CYS A 116 16.356 -8.995 -1.907 1.00 0.47 H new ATOM 0 HB2 CYS A 116 17.234 -10.026 0.099 1.00 0.51 H new ATOM 0 HB3 CYS A 116 16.522 -8.473 0.488 1.00 0.51 H new ATOM 0 HG CYS A 116 14.033 -10.295 1.069 1.00 1.56 H new ATOM 1953 N ALA A 117 14.073 -11.269 -1.411 1.00 0.50 N ATOM 1954 CA ALA A 117 13.591 -12.579 -1.819 1.00 0.54 C ATOM 1955 C ALA A 117 13.338 -12.626 -3.321 1.00 0.54 C ATOM 1956 O ALA A 117 13.376 -13.696 -3.929 1.00 0.58 O ATOM 1957 CB ALA A 117 12.324 -12.931 -1.059 1.00 0.57 C ATOM 0 H ALA A 117 13.389 -10.714 -0.897 1.00 0.50 H new ATOM 0 HA ALA A 117 14.361 -13.314 -1.583 1.00 0.54 H new ATOM 0 HB1 ALA A 117 11.973 -13.914 -1.373 1.00 0.57 H new ATOM 0 HB2 ALA A 117 12.533 -12.945 0.011 1.00 0.57 H new ATOM 0 HB3 ALA A 117 11.555 -12.187 -1.268 1.00 0.57 H new ATOM 1963 N ARG A 118 13.070 -11.463 -3.914 1.00 0.50 N ATOM 1964 CA ARG A 118 12.865 -11.376 -5.356 1.00 0.51 C ATOM 1965 C ARG A 118 14.165 -11.677 -6.077 1.00 0.52 C ATOM 1966 O ARG A 118 14.188 -12.403 -7.068 1.00 0.55 O ATOM 1967 CB ARG A 118 12.360 -9.989 -5.775 1.00 0.49 C ATOM 1968 CG ARG A 118 11.079 -9.550 -5.083 1.00 0.49 C ATOM 1969 CD ARG A 118 9.922 -10.488 -5.357 1.00 0.58 C ATOM 1970 NE ARG A 118 9.898 -11.638 -4.454 1.00 0.84 N ATOM 1971 CZ ARG A 118 9.708 -12.896 -4.853 1.00 1.16 C ATOM 1972 NH1 ARG A 118 9.615 -13.182 -6.147 1.00 1.23 N ATOM 1973 NH2 ARG A 118 9.615 -13.870 -3.959 1.00 1.75 N ATOM 0 H ARG A 118 12.990 -10.574 -3.420 1.00 0.50 H new ATOM 0 HA ARG A 118 12.106 -12.109 -5.628 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.139 -9.255 -5.570 1.00 0.49 H new ATOM 0 HB3 ARG A 118 12.196 -9.986 -6.853 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.251 -9.495 -4.008 1.00 0.49 H new ATOM 0 HG3 ARG A 118 10.816 -8.546 -5.416 1.00 0.49 H new ATOM 0 HD2 ARG A 118 8.985 -9.939 -5.263 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.983 -10.841 -6.386 1.00 0.58 H new ATOM 0 HE ARG A 118 10.035 -11.467 -3.458 1.00 0.84 H new ATOM 0 HH11 ARG A 118 9.689 -12.438 -6.840 1.00 1.23 H new ATOM 0 HH12 ARG A 118 9.470 -14.146 -6.447 1.00 1.23 H new ATOM 0 HH21 ARG A 118 9.689 -13.658 -2.964 1.00 1.75 H new ATOM 0 HH22 ARG A 118 9.470 -14.832 -4.266 1.00 1.75 H new ATOM 1987 N ILE A 119 15.251 -11.119 -5.562 1.00 0.52 N ATOM 1988 CA ILE A 119 16.560 -11.302 -6.164 1.00 0.54 C ATOM 1989 C ILE A 119 17.083 -12.695 -5.855 1.00 0.58 C ATOM 1990 O ILE A 119 17.538 -13.419 -6.742 1.00 0.66 O ATOM 1991 CB ILE A 119 17.583 -10.275 -5.628 1.00 0.51 C ATOM 1992 CG1 ILE A 119 16.909 -8.941 -5.297 1.00 0.49 C ATOM 1993 CG2 ILE A 119 18.690 -10.064 -6.650 1.00 0.56 C ATOM 1994 CD1 ILE A 119 16.320 -8.234 -6.496 1.00 0.69 C ATOM 0 H ILE A 119 15.249 -10.534 -4.726 1.00 0.52 H new ATOM 0 HA ILE A 119 16.443 -11.162 -7.239 1.00 0.54 H new ATOM 0 HB ILE A 119 18.013 -10.671 -4.708 1.00 0.51 H new ATOM 0 HG12 ILE A 119 16.118 -9.117 -4.567 1.00 0.49 H new ATOM 0 HG13 ILE A 119 17.639 -8.285 -4.824 1.00 0.49 H new ATOM 0 HG21 ILE A 119 19.407 -9.339 -6.265 1.00 0.56 H new ATOM 0 HG22 ILE A 119 19.197 -11.011 -6.838 1.00 0.56 H new ATOM 0 HG23 ILE A 119 18.261 -9.691 -7.580 1.00 0.56 H new ATOM 0 HD11 ILE A 119 15.862 -7.298 -6.177 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.109 -8.024 -7.218 1.00 0.69 H new ATOM 0 HD13 ILE A 119 15.564 -8.869 -6.958 1.00 0.69 H new ATOM 2006 N GLY A 120 16.978 -13.072 -4.590 1.00 0.57 N ATOM 2007 CA GLY A 120 17.541 -14.324 -4.136 1.00 0.62 C ATOM 2008 C GLY A 120 18.572 -14.110 -3.050 1.00 0.64 C ATOM 2009 O GLY A 120 19.437 -14.958 -2.821 1.00 0.70 O ATOM 0 H GLY A 120 16.509 -12.528 -3.866 1.00 0.57 H new ATOM 0 HA2 GLY A 120 16.745 -14.967 -3.761 1.00 0.62 H new ATOM 0 HA3 GLY A 120 18.000 -14.843 -4.977 1.00 0.62 H new ATOM 2013 N ILE A 121 18.474 -12.971 -2.377 1.00 0.66 N ATOM 2014 CA ILE A 121 19.409 -12.612 -1.321 1.00 0.71 C ATOM 2015 C ILE A 121 19.010 -13.279 -0.006 1.00 0.82 C ATOM 2016 O ILE A 121 19.865 -13.761 0.738 1.00 1.54 O ATOM 2017 CB ILE A 121 19.458 -11.080 -1.117 1.00 0.63 C ATOM 2018 CG1 ILE A 121 19.830 -10.366 -2.422 1.00 0.59 C ATOM 2019 CG2 ILE A 121 20.442 -10.718 -0.014 1.00 0.67 C ATOM 2020 CD1 ILE A 121 19.820 -8.853 -2.315 1.00 0.56 C ATOM 0 H ILE A 121 17.749 -12.274 -2.547 1.00 0.66 H new ATOM 0 HA ILE A 121 20.397 -12.960 -1.624 1.00 0.71 H new ATOM 0 HB ILE A 121 18.464 -10.747 -0.818 1.00 0.63 H new ATOM 0 HG12 ILE A 121 20.822 -10.693 -2.734 1.00 0.59 H new ATOM 0 HG13 ILE A 121 19.134 -10.671 -3.203 1.00 0.59 H new ATOM 0 HG21 ILE A 121 20.462 -9.636 0.115 1.00 0.67 H new ATOM 0 HG22 ILE A 121 20.132 -11.189 0.919 1.00 0.67 H new ATOM 0 HG23 ILE A 121 21.437 -11.070 -0.285 1.00 0.67 H new ATOM 0 HD11 ILE A 121 20.093 -8.418 -3.277 1.00 0.56 H new ATOM 0 HD12 ILE A 121 18.823 -8.515 -2.034 1.00 0.56 H new ATOM 0 HD13 ILE A 121 20.537 -8.537 -1.557 1.00 0.56 H new ATOM 2032 N THR A 122 17.700 -13.310 0.255 1.00 0.96 N ATOM 2033 CA THR A 122 17.138 -13.865 1.493 1.00 1.00 C ATOM 2034 C THR A 122 17.405 -12.949 2.692 1.00 0.90 C ATOM 2035 O THR A 122 16.486 -12.592 3.431 1.00 1.04 O ATOM 2036 CB THR A 122 17.690 -15.276 1.790 1.00 1.18 C ATOM 2037 OG1 THR A 122 17.581 -16.099 0.620 1.00 1.55 O ATOM 2038 CG2 THR A 122 16.935 -15.929 2.940 1.00 1.65 C ATOM 0 H THR A 122 16.995 -12.950 -0.388 1.00 0.96 H new ATOM 0 HA THR A 122 16.062 -13.938 1.338 1.00 1.00 H new ATOM 0 HB THR A 122 18.737 -15.176 2.075 1.00 1.18 H new ATOM 0 HG1 THR A 122 17.934 -16.992 0.814 1.00 1.55 H new ATOM 0 HG21 THR A 122 17.345 -16.922 3.127 1.00 1.65 H new ATOM 0 HG22 THR A 122 17.039 -15.318 3.837 1.00 1.65 H new ATOM 0 HG23 THR A 122 15.880 -16.015 2.680 1.00 1.65 H new ATOM 2046 N ASN A 123 18.661 -12.576 2.872 1.00 0.91 N ATOM 2047 CA ASN A 123 19.066 -11.705 3.965 1.00 0.87 C ATOM 2048 C ASN A 123 18.589 -10.283 3.703 1.00 0.77 C ATOM 2049 O ASN A 123 18.739 -9.764 2.598 1.00 1.05 O ATOM 2050 CB ASN A 123 20.589 -11.737 4.098 1.00 1.10 C ATOM 2051 CG ASN A 123 21.109 -11.087 5.367 1.00 1.31 C ATOM 2052 OD1 ASN A 123 20.509 -10.164 5.924 1.00 2.13 O ATOM 2053 ND2 ASN A 123 22.241 -11.578 5.835 1.00 1.50 N ATOM 0 H ASN A 123 19.428 -12.867 2.266 1.00 0.91 H new ATOM 0 HA ASN A 123 18.617 -12.054 4.894 1.00 0.87 H new ATOM 0 HB2 ASN A 123 20.925 -12.774 4.068 1.00 1.10 H new ATOM 0 HB3 ASN A 123 21.030 -11.234 3.237 1.00 1.10 H new ATOM 0 HD21 ASN A 123 22.650 -11.194 6.687 1.00 1.50 H new ATOM 0 HD22 ASN A 123 22.707 -12.342 5.345 1.00 1.50 H new ATOM 2060 N HIS A 124 18.003 -9.656 4.711 1.00 0.61 N ATOM 2061 CA HIS A 124 17.502 -8.300 4.560 1.00 0.59 C ATOM 2062 C HIS A 124 17.726 -7.477 5.825 1.00 0.57 C ATOM 2063 O HIS A 124 17.392 -6.294 5.868 1.00 0.66 O ATOM 2064 CB HIS A 124 16.014 -8.310 4.202 1.00 0.63 C ATOM 2065 CG HIS A 124 15.128 -8.820 5.294 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.338 -7.994 6.061 1.00 0.55 N ATOM 2067 CD2 HIS A 124 14.898 -10.078 5.740 1.00 0.66 C ATOM 2068 CE1 HIS A 124 13.664 -8.717 6.928 1.00 0.57 C ATOM 2069 NE2 HIS A 124 13.983 -9.985 6.758 1.00 0.66 N ATOM 0 H HIS A 124 17.863 -10.062 5.636 1.00 0.61 H new ATOM 0 HA HIS A 124 18.061 -7.835 3.748 1.00 0.59 H new ATOM 0 HB2 HIS A 124 15.707 -7.297 3.942 1.00 0.63 H new ATOM 0 HB3 HIS A 124 15.869 -8.925 3.314 1.00 0.63 H new ATOM 0 HD1 HIS A 124 14.284 -6.979 5.971 1.00 0.55 H new ATOM 0 HD2 HIS A 124 15.350 -10.984 5.365 1.00 0.66 H new ATOM 0 HE1 HIS A 124 12.965 -8.336 7.658 1.00 0.57 H new ATOM 2078 N ASP A 125 18.286 -8.097 6.854 1.00 0.62 N ATOM 2079 CA ASP A 125 18.497 -7.405 8.116 1.00 0.72 C ATOM 2080 C ASP A 125 19.742 -6.537 8.051 1.00 0.64 C ATOM 2081 O ASP A 125 19.842 -5.529 8.752 1.00 0.66 O ATOM 2082 CB ASP A 125 18.601 -8.389 9.283 1.00 0.97 C ATOM 2083 CG ASP A 125 17.243 -8.880 9.752 1.00 1.54 C ATOM 2084 OD1 ASP A 125 16.466 -8.071 10.304 1.00 2.14 O ATOM 2085 OD2 ASP A 125 16.946 -10.078 9.563 1.00 2.11 O ATOM 0 H ASP A 125 18.599 -9.068 6.841 1.00 0.62 H new ATOM 0 HA ASP A 125 17.631 -6.766 8.288 1.00 0.72 H new ATOM 0 HB2 ASP A 125 19.208 -9.243 8.981 1.00 0.97 H new ATOM 0 HB3 ASP A 125 19.117 -7.909 10.114 1.00 0.97 H new ATOM 2090 N GLU A 126 20.681 -6.908 7.185 1.00 0.62 N ATOM 2091 CA GLU A 126 21.906 -6.132 7.033 1.00 0.62 C ATOM 2092 C GLU A 126 21.757 -5.094 5.944 1.00 0.52 C ATOM 2093 O GLU A 126 22.744 -4.642 5.378 1.00 0.61 O ATOM 2094 CB GLU A 126 23.119 -7.016 6.727 1.00 0.76 C ATOM 2095 CG GLU A 126 22.959 -7.935 5.529 1.00 1.19 C ATOM 2096 CD GLU A 126 24.144 -8.861 5.379 1.00 1.84 C ATOM 2097 OE1 GLU A 126 24.323 -9.723 6.258 1.00 2.30 O ATOM 2098 OE2 GLU A 126 24.911 -8.721 4.401 1.00 2.27 O ATOM 0 H GLU A 126 20.618 -7.731 6.585 1.00 0.62 H new ATOM 0 HA GLU A 126 22.078 -5.637 7.989 1.00 0.62 H new ATOM 0 HB2 GLU A 126 23.984 -6.374 6.560 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.337 -7.624 7.605 1.00 0.76 H new ATOM 0 HG2 GLU A 126 22.048 -8.523 5.639 1.00 1.19 H new ATOM 0 HG3 GLU A 126 22.845 -7.338 4.624 1.00 1.19 H new ATOM 2105 N TYR A 127 20.532 -4.698 5.665 1.00 0.43 N ATOM 2106 CA TYR A 127 20.287 -3.709 4.638 1.00 0.38 C ATOM 2107 C TYR A 127 19.318 -2.644 5.116 1.00 0.39 C ATOM 2108 O TYR A 127 18.330 -2.935 5.792 1.00 0.42 O ATOM 2109 CB TYR A 127 19.741 -4.364 3.371 1.00 0.36 C ATOM 2110 CG TYR A 127 20.673 -5.364 2.740 1.00 0.36 C ATOM 2111 CD1 TYR A 127 21.880 -4.962 2.200 1.00 0.38 C ATOM 2112 CD2 TYR A 127 20.351 -6.710 2.698 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.744 -5.868 1.630 1.00 0.41 C ATOM 2114 CE2 TYR A 127 21.206 -7.628 2.132 1.00 0.43 C ATOM 2115 CZ TYR A 127 22.375 -7.209 1.560 1.00 0.43 C ATOM 2116 OH TYR A 127 23.259 -8.124 1.030 1.00 0.49 O ATOM 0 H TYR A 127 19.695 -5.044 6.133 1.00 0.43 H new ATOM 0 HA TYR A 127 21.242 -3.235 4.412 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.801 -4.861 3.609 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.514 -3.586 2.642 1.00 0.36 H new ATOM 0 HD1 TYR A 127 22.150 -3.917 2.226 1.00 0.38 H new ATOM 0 HD2 TYR A 127 19.413 -7.045 3.116 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.698 -5.543 1.241 1.00 0.41 H new ATOM 0 HE2 TYR A 127 20.954 -8.678 2.140 1.00 0.43 H new ATOM 0 HH TYR A 127 22.857 -9.017 1.051 1.00 0.49 H new ATOM 2126 N SER A 128 19.617 -1.411 4.774 1.00 0.40 N ATOM 2127 CA SER A 128 18.711 -0.309 4.984 1.00 0.42 C ATOM 2128 C SER A 128 18.197 0.155 3.632 1.00 0.41 C ATOM 2129 O SER A 128 18.551 -0.422 2.601 1.00 0.54 O ATOM 2130 CB SER A 128 19.433 0.826 5.706 1.00 0.47 C ATOM 2131 OG SER A 128 20.685 1.092 5.099 1.00 1.13 O ATOM 0 H SER A 128 20.501 -1.145 4.340 1.00 0.40 H new ATOM 0 HA SER A 128 17.871 -0.623 5.604 1.00 0.42 H new ATOM 0 HB2 SER A 128 18.817 1.725 5.688 1.00 0.47 H new ATOM 0 HB3 SER A 128 19.580 0.562 6.753 1.00 0.47 H new ATOM 0 HG SER A 128 21.131 1.823 5.575 1.00 1.13 H new ATOM 2137 N LEU A 129 17.367 1.181 3.614 1.00 0.42 N ATOM 2138 CA LEU A 129 16.878 1.693 2.349 1.00 0.42 C ATOM 2139 C LEU A 129 17.191 3.176 2.257 1.00 0.43 C ATOM 2140 O LEU A 129 17.200 3.867 3.263 1.00 0.48 O ATOM 2141 CB LEU A 129 15.371 1.425 2.213 1.00 0.43 C ATOM 2142 CG LEU A 129 14.856 1.221 0.779 1.00 0.45 C ATOM 2143 CD1 LEU A 129 13.491 0.556 0.796 1.00 1.33 C ATOM 2144 CD2 LEU A 129 14.770 2.540 0.028 1.00 1.13 C ATOM 0 H LEU A 129 17.023 1.667 4.442 1.00 0.42 H new ATOM 0 HA LEU A 129 17.376 1.182 1.525 1.00 0.42 H new ATOM 0 HB2 LEU A 129 15.124 0.539 2.797 1.00 0.43 H new ATOM 0 HB3 LEU A 129 14.831 2.261 2.658 1.00 0.43 H new ATOM 0 HG LEU A 129 15.567 0.576 0.263 1.00 0.45 H new ATOM 0 HD11 LEU A 129 13.140 0.419 -0.227 1.00 1.33 H new ATOM 0 HD12 LEU A 129 13.565 -0.414 1.288 1.00 1.33 H new ATOM 0 HD13 LEU A 129 12.786 1.185 1.340 1.00 1.33 H new ATOM 0 HD21 LEU A 129 14.403 2.360 -0.982 1.00 1.13 H new ATOM 0 HD22 LEU A 129 14.087 3.211 0.549 1.00 1.13 H new ATOM 0 HD23 LEU A 129 15.759 2.996 -0.021 1.00 1.13 H new ATOM 2156 N VAL A 130 17.480 3.651 1.066 1.00 0.42 N ATOM 2157 CA VAL A 130 17.729 5.065 0.852 1.00 0.46 C ATOM 2158 C VAL A 130 17.005 5.521 -0.410 1.00 0.46 C ATOM 2159 O VAL A 130 17.278 5.041 -1.510 1.00 0.45 O ATOM 2160 CB VAL A 130 19.249 5.368 0.775 1.00 0.48 C ATOM 2161 CG1 VAL A 130 19.937 4.439 -0.193 1.00 0.49 C ATOM 2162 CG2 VAL A 130 19.522 6.807 0.383 1.00 0.60 C ATOM 0 H VAL A 130 17.549 3.078 0.225 1.00 0.42 H new ATOM 0 HA VAL A 130 17.341 5.624 1.703 1.00 0.46 H new ATOM 0 HB VAL A 130 19.652 5.206 1.775 1.00 0.48 H new ATOM 0 HG11 VAL A 130 21.001 4.673 -0.228 1.00 0.49 H new ATOM 0 HG12 VAL A 130 19.803 3.408 0.134 1.00 0.49 H new ATOM 0 HG13 VAL A 130 19.505 4.564 -1.186 1.00 0.49 H new ATOM 0 HG21 VAL A 130 20.598 6.975 0.341 1.00 0.60 H new ATOM 0 HG22 VAL A 130 19.085 7.007 -0.596 1.00 0.60 H new ATOM 0 HG23 VAL A 130 19.079 7.476 1.121 1.00 0.60 H new ATOM 2172 N ARG A 131 16.047 6.413 -0.241 1.00 0.48 N ATOM 2173 CA ARG A 131 15.216 6.836 -1.348 1.00 0.50 C ATOM 2174 C ARG A 131 15.690 8.163 -1.907 1.00 0.57 C ATOM 2175 O ARG A 131 15.422 9.224 -1.332 1.00 0.64 O ATOM 2176 CB ARG A 131 13.771 6.991 -0.889 1.00 0.54 C ATOM 2177 CG ARG A 131 13.272 5.854 -0.022 1.00 0.51 C ATOM 2178 CD ARG A 131 11.782 5.972 0.206 1.00 0.62 C ATOM 2179 NE ARG A 131 11.024 5.675 -1.008 1.00 0.96 N ATOM 2180 CZ ARG A 131 10.096 4.725 -1.091 1.00 1.65 C ATOM 2181 NH1 ARG A 131 9.729 4.058 -0.004 1.00 2.18 N ATOM 2182 NH2 ARG A 131 9.508 4.468 -2.256 1.00 2.01 N ATOM 0 H ARG A 131 15.827 6.857 0.651 1.00 0.48 H new ATOM 0 HA ARG A 131 15.284 6.074 -2.124 1.00 0.50 H new ATOM 0 HB2 ARG A 131 13.675 7.925 -0.335 1.00 0.54 H new ATOM 0 HB3 ARG A 131 13.129 7.073 -1.766 1.00 0.54 H new ATOM 0 HG2 ARG A 131 13.498 4.900 -0.499 1.00 0.51 H new ATOM 0 HG3 ARG A 131 13.794 5.864 0.935 1.00 0.51 H new ATOM 0 HD2 ARG A 131 11.480 5.289 1.000 1.00 0.62 H new ATOM 0 HD3 ARG A 131 11.545 6.980 0.546 1.00 0.62 H new ATOM 0 HE ARG A 131 11.218 6.229 -1.842 1.00 0.96 H new ATOM 0 HH11 ARG A 131 10.158 4.273 0.896 1.00 2.18 H new ATOM 0 HH12 ARG A 131 9.018 3.330 -0.068 1.00 2.18 H new ATOM 0 HH21 ARG A 131 9.768 4.999 -3.087 1.00 2.01 H new ATOM 0 HH22 ARG A 131 8.797 3.740 -2.319 1.00 2.01 H new ATOM 2196 N GLU A 132 16.365 8.111 -3.037 1.00 0.58 N ATOM 2197 CA GLU A 132 16.751 9.323 -3.723 1.00 0.66 C ATOM 2198 C GLU A 132 15.594 9.796 -4.587 1.00 0.73 C ATOM 2199 O GLU A 132 15.293 9.206 -5.630 1.00 0.74 O ATOM 2200 CB GLU A 132 18.002 9.105 -4.574 1.00 0.68 C ATOM 2201 CG GLU A 132 19.225 8.671 -3.782 1.00 0.64 C ATOM 2202 CD GLU A 132 20.469 8.559 -4.644 1.00 0.72 C ATOM 2203 OE1 GLU A 132 20.341 8.586 -5.889 1.00 0.90 O ATOM 2204 OE2 GLU A 132 21.584 8.450 -4.084 1.00 1.05 O ATOM 0 H GLU A 132 16.655 7.248 -3.496 1.00 0.58 H new ATOM 0 HA GLU A 132 16.990 10.086 -2.982 1.00 0.66 H new ATOM 0 HB2 GLU A 132 17.786 8.351 -5.331 1.00 0.68 H new ATOM 0 HB3 GLU A 132 18.234 10.030 -5.103 1.00 0.68 H new ATOM 0 HG2 GLU A 132 19.406 9.386 -2.980 1.00 0.64 H new ATOM 0 HG3 GLU A 132 19.026 7.708 -3.311 1.00 0.64 H new ATOM 2211 N LEU A 133 14.932 10.844 -4.138 1.00 0.80 N ATOM 2212 CA LEU A 133 13.706 11.285 -4.774 1.00 0.87 C ATOM 2213 C LEU A 133 13.934 12.437 -5.740 1.00 0.97 C ATOM 2214 O LEU A 133 15.067 12.799 -6.055 1.00 1.02 O ATOM 2215 CB LEU A 133 12.690 11.721 -3.723 1.00 0.92 C ATOM 2216 CG LEU A 133 12.399 10.714 -2.616 1.00 0.87 C ATOM 2217 CD1 LEU A 133 11.198 11.176 -1.817 1.00 0.97 C ATOM 2218 CD2 LEU A 133 12.160 9.321 -3.180 1.00 0.80 C ATOM 0 H LEU A 133 15.221 11.405 -3.337 1.00 0.80 H new ATOM 0 HA LEU A 133 13.327 10.434 -5.341 1.00 0.87 H new ATOM 0 HB2 LEU A 133 13.045 12.643 -3.264 1.00 0.92 H new ATOM 0 HB3 LEU A 133 11.753 11.957 -4.228 1.00 0.92 H new ATOM 0 HG LEU A 133 13.270 10.656 -1.963 1.00 0.87 H new ATOM 0 HD11 LEU A 133 10.989 10.457 -1.025 1.00 0.97 H new ATOM 0 HD12 LEU A 133 11.407 12.150 -1.376 1.00 0.97 H new ATOM 0 HD13 LEU A 133 10.332 11.254 -2.474 1.00 0.97 H new ATOM 0 HD21 LEU A 133 11.956 8.628 -2.364 1.00 0.80 H new ATOM 0 HD22 LEU A 133 11.307 9.344 -3.858 1.00 0.80 H new ATOM 0 HD23 LEU A 133 13.046 8.991 -3.723 1.00 0.80 H new ATOM 2230 N MET A 134 12.824 12.997 -6.193 1.00 1.04 N ATOM 2231 CA MET A 134 12.812 14.145 -7.091 1.00 1.15 C ATOM 2232 C MET A 134 12.023 15.273 -6.444 1.00 1.22 C ATOM 2233 O MET A 134 11.876 16.359 -7.008 1.00 1.29 O ATOM 2234 CB MET A 134 12.160 13.740 -8.415 1.00 1.27 C ATOM 2235 CG MET A 134 10.764 13.171 -8.221 1.00 1.36 C ATOM 2236 SD MET A 134 9.482 14.443 -8.155 1.00 1.80 S ATOM 2237 CE MET A 134 8.184 13.575 -7.279 1.00 2.03 C ATOM 0 H MET A 134 11.892 12.664 -5.945 1.00 1.04 H new ATOM 0 HA MET A 134 13.830 14.483 -7.283 1.00 1.15 H new ATOM 0 HB2 MET A 134 12.108 14.608 -9.072 1.00 1.27 H new ATOM 0 HB3 MET A 134 12.785 13.000 -8.914 1.00 1.27 H new ATOM 0 HG2 MET A 134 10.542 12.482 -9.036 1.00 1.36 H new ATOM 0 HG3 MET A 134 10.740 12.591 -7.298 1.00 1.36 H new ATOM 0 HE1 MET A 134 7.217 13.835 -7.710 1.00 2.03 H new ATOM 0 HE2 MET A 134 8.342 12.500 -7.366 1.00 2.03 H new ATOM 0 HE3 MET A 134 8.201 13.861 -6.227 1.00 2.03 H new ATOM 2247 N GLU A 135 11.510 14.970 -5.255 1.00 1.27 N ATOM 2248 CA GLU A 135 10.682 15.868 -4.472 1.00 1.39 C ATOM 2249 C GLU A 135 11.125 17.320 -4.506 1.00 1.41 C ATOM 2250 O GLU A 135 12.290 17.635 -4.269 1.00 1.45 O ATOM 2251 CB GLU A 135 10.667 15.380 -3.050 1.00 1.48 C ATOM 2252 CG GLU A 135 9.416 14.615 -2.743 1.00 1.58 C ATOM 2253 CD GLU A 135 8.384 15.488 -2.076 1.00 1.83 C ATOM 2254 OE1 GLU A 135 8.499 15.710 -0.854 1.00 2.04 O ATOM 2255 OE2 GLU A 135 7.480 15.982 -2.774 1.00 2.29 O ATOM 0 H GLU A 135 11.665 14.069 -4.802 1.00 1.27 H new ATOM 0 HA GLU A 135 9.688 15.853 -4.919 1.00 1.39 H new ATOM 0 HB2 GLU A 135 11.535 14.745 -2.873 1.00 1.48 H new ATOM 0 HB3 GLU A 135 10.750 16.230 -2.372 1.00 1.48 H new ATOM 0 HG2 GLU A 135 9.005 14.203 -3.665 1.00 1.58 H new ATOM 0 HG3 GLU A 135 9.654 13.771 -2.095 1.00 1.58 H new ATOM 2262 N GLU A 136 10.172 18.193 -4.797 1.00 1.46 N ATOM 2263 CA GLU A 136 10.386 19.632 -4.721 1.00 1.52 C ATOM 2264 C GLU A 136 10.727 20.026 -3.289 1.00 1.52 C ATOM 2265 O GLU A 136 11.500 20.949 -3.047 1.00 1.59 O ATOM 2266 CB GLU A 136 9.121 20.376 -5.165 1.00 1.67 C ATOM 2267 CG GLU A 136 7.947 20.173 -4.214 1.00 1.73 C ATOM 2268 CD GLU A 136 6.676 20.845 -4.664 1.00 1.93 C ATOM 2269 OE1 GLU A 136 6.058 20.369 -5.637 1.00 1.99 O ATOM 2270 OE2 GLU A 136 6.265 21.829 -4.015 1.00 2.12 O ATOM 0 H GLU A 136 9.232 17.926 -5.091 1.00 1.46 H new ATOM 0 HA GLU A 136 11.211 19.901 -5.380 1.00 1.52 H new ATOM 0 HB2 GLU A 136 9.340 21.441 -5.241 1.00 1.67 H new ATOM 0 HB3 GLU A 136 8.837 20.037 -6.161 1.00 1.67 H new ATOM 0 HG2 GLU A 136 7.762 19.105 -4.103 1.00 1.73 H new ATOM 0 HG3 GLU A 136 8.219 20.554 -3.229 1.00 1.73 H new ATOM 2277 N LYS A 137 10.146 19.296 -2.347 1.00 1.53 N ATOM 2278 CA LYS A 137 10.283 19.610 -0.937 1.00 1.61 C ATOM 2279 C LYS A 137 11.501 18.918 -0.348 1.00 1.55 C ATOM 2280 O LYS A 137 12.477 19.567 0.021 1.00 1.63 O ATOM 2281 CB LYS A 137 9.019 19.189 -0.183 1.00 1.72 C ATOM 2282 CG LYS A 137 7.759 19.862 -0.697 1.00 1.83 C ATOM 2283 CD LYS A 137 6.519 19.354 0.014 1.00 2.14 C ATOM 2284 CE LYS A 137 5.274 20.104 -0.439 1.00 2.31 C ATOM 2285 NZ LYS A 137 5.004 19.941 -1.894 1.00 2.98 N ATOM 0 H LYS A 137 9.571 18.476 -2.539 1.00 1.53 H new ATOM 0 HA LYS A 137 10.418 20.687 -0.833 1.00 1.61 H new ATOM 0 HB2 LYS A 137 8.902 18.108 -0.260 1.00 1.72 H new ATOM 0 HB3 LYS A 137 9.141 19.422 0.875 1.00 1.72 H new ATOM 0 HG2 LYS A 137 7.841 20.940 -0.559 1.00 1.83 H new ATOM 0 HG3 LYS A 137 7.663 19.684 -1.768 1.00 1.83 H new ATOM 0 HD2 LYS A 137 6.396 18.289 -0.182 1.00 2.14 H new ATOM 0 HD3 LYS A 137 6.643 19.468 1.091 1.00 2.14 H new ATOM 0 HE2 LYS A 137 4.414 19.748 0.128 1.00 2.31 H new ATOM 0 HE3 LYS A 137 5.390 21.164 -0.211 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 3.983 19.812 -2.045 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 5.326 20.789 -2.404 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 5.514 19.108 -2.251 1.00 2.98 H new ATOM 2299 N LYS A 138 11.439 17.594 -0.273 1.00 1.47 N ATOM 2300 CA LYS A 138 12.525 16.818 0.302 1.00 1.45 C ATOM 2301 C LYS A 138 13.756 16.857 -0.586 1.00 1.34 C ATOM 2302 O LYS A 138 14.725 17.559 -0.292 1.00 1.43 O ATOM 2303 CB LYS A 138 12.101 15.363 0.524 1.00 1.48 C ATOM 2304 CG LYS A 138 10.908 15.222 1.443 1.00 1.52 C ATOM 2305 CD LYS A 138 10.634 13.770 1.807 1.00 1.58 C ATOM 2306 CE LYS A 138 9.841 13.045 0.730 1.00 1.42 C ATOM 2307 NZ LYS A 138 8.450 13.563 0.613 1.00 1.76 N ATOM 0 H LYS A 138 10.649 17.039 -0.603 1.00 1.47 H new ATOM 0 HA LYS A 138 12.771 17.267 1.264 1.00 1.45 H new ATOM 0 HB2 LYS A 138 11.865 14.909 -0.439 1.00 1.48 H new ATOM 0 HB3 LYS A 138 12.940 14.807 0.941 1.00 1.48 H new ATOM 0 HG2 LYS A 138 11.082 15.797 2.353 1.00 1.52 H new ATOM 0 HG3 LYS A 138 10.027 15.647 0.961 1.00 1.52 H new ATOM 0 HD2 LYS A 138 11.580 13.253 1.968 1.00 1.58 H new ATOM 0 HD3 LYS A 138 10.085 13.731 2.748 1.00 1.58 H new ATOM 0 HE2 LYS A 138 10.349 13.153 -0.228 1.00 1.42 H new ATOM 0 HE3 LYS A 138 9.812 11.979 0.957 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 7.884 12.909 0.035 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 8.028 13.642 1.560 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 8.465 14.500 0.161 1.00 1.76 H new ATOM 2321 N ASP A 169 13.692 16.105 -1.683 1.00 1.23 N ATOM 2322 CA ASP A 169 14.849 15.884 -2.545 1.00 1.18 C ATOM 2323 C ASP A 169 16.000 15.352 -1.700 1.00 1.11 C ATOM 2324 O ASP A 169 17.175 15.636 -1.929 1.00 1.30 O ATOM 2325 CB ASP A 169 15.236 17.180 -3.273 1.00 1.35 C ATOM 2326 CG ASP A 169 16.282 16.967 -4.349 1.00 1.44 C ATOM 2327 OD1 ASP A 169 16.070 16.107 -5.226 1.00 1.48 O ATOM 2328 OD2 ASP A 169 17.305 17.682 -4.335 1.00 1.59 O ATOM 0 H ASP A 169 12.843 15.635 -1.997 1.00 1.23 H new ATOM 0 HA ASP A 169 14.604 15.147 -3.310 1.00 1.18 H new ATOM 0 HB2 ASP A 169 14.345 17.617 -3.723 1.00 1.35 H new ATOM 0 HB3 ASP A 169 15.612 17.900 -2.546 1.00 1.35 H new ATOM 2333 N GLU A 170 15.620 14.562 -0.714 1.00 0.96 N ATOM 2334 CA GLU A 170 16.544 14.024 0.259 1.00 0.90 C ATOM 2335 C GLU A 170 17.000 12.639 -0.181 1.00 0.78 C ATOM 2336 O GLU A 170 16.469 12.083 -1.148 1.00 0.77 O ATOM 2337 CB GLU A 170 15.831 13.946 1.614 1.00 0.98 C ATOM 2338 CG GLU A 170 16.672 14.380 2.803 1.00 1.24 C ATOM 2339 CD GLU A 170 17.723 13.365 3.177 1.00 1.90 C ATOM 2340 OE1 GLU A 170 17.416 12.446 3.960 1.00 2.57 O ATOM 2341 OE2 GLU A 170 18.872 13.501 2.715 1.00 2.27 O ATOM 0 H GLU A 170 14.652 14.275 -0.567 1.00 0.96 H new ATOM 0 HA GLU A 170 17.421 14.665 0.344 1.00 0.90 H new ATOM 0 HB2 GLU A 170 14.936 14.567 1.574 1.00 0.98 H new ATOM 0 HB3 GLU A 170 15.500 12.920 1.776 1.00 0.98 H new ATOM 0 HG2 GLU A 170 17.156 15.329 2.573 1.00 1.24 H new ATOM 0 HG3 GLU A 170 16.020 14.554 3.659 1.00 1.24 H new ATOM 2348 N LEU A 171 17.975 12.095 0.528 1.00 0.73 N ATOM 2349 CA LEU A 171 18.412 10.731 0.302 1.00 0.67 C ATOM 2350 C LEU A 171 17.407 9.782 0.899 1.00 0.62 C ATOM 2351 O LEU A 171 17.304 8.646 0.481 1.00 0.57 O ATOM 2352 CB LEU A 171 19.777 10.476 0.938 1.00 0.71 C ATOM 2353 CG LEU A 171 20.882 11.406 0.472 1.00 0.77 C ATOM 2354 CD1 LEU A 171 22.219 10.989 1.064 1.00 0.86 C ATOM 2355 CD2 LEU A 171 20.939 11.424 -1.046 1.00 0.74 C ATOM 0 H LEU A 171 18.480 12.582 1.268 1.00 0.73 H new ATOM 0 HA LEU A 171 18.495 10.572 -0.773 1.00 0.67 H new ATOM 0 HB2 LEU A 171 19.680 10.564 2.020 1.00 0.71 H new ATOM 0 HB3 LEU A 171 20.074 9.449 0.727 1.00 0.71 H new ATOM 0 HG LEU A 171 20.664 12.415 0.821 1.00 0.77 H new ATOM 0 HD11 LEU A 171 22.998 11.668 0.718 1.00 0.86 H new ATOM 0 HD12 LEU A 171 22.163 11.026 2.152 1.00 0.86 H new ATOM 0 HD13 LEU A 171 22.456 9.973 0.747 1.00 0.86 H new ATOM 0 HD21 LEU A 171 21.735 12.094 -1.372 1.00 0.74 H new ATOM 0 HD22 LEU A 171 21.138 10.418 -1.415 1.00 0.74 H new ATOM 0 HD23 LEU A 171 19.985 11.773 -1.442 1.00 0.74 H new ATOM 2367 N ASN A 172 16.684 10.269 1.897 1.00 0.65 N ATOM 2368 CA ASN A 172 15.651 9.492 2.563 1.00 0.63 C ATOM 2369 C ASN A 172 16.168 8.120 2.958 1.00 0.57 C ATOM 2370 O ASN A 172 15.793 7.111 2.358 1.00 0.53 O ATOM 2371 CB ASN A 172 14.416 9.332 1.672 1.00 0.65 C ATOM 2372 CG ASN A 172 13.708 10.638 1.393 1.00 0.75 C ATOM 2373 OD1 ASN A 172 12.956 11.149 2.222 1.00 0.90 O ATOM 2374 ND2 ASN A 172 13.906 11.161 0.198 1.00 0.80 N ATOM 0 H ASN A 172 16.797 11.213 2.267 1.00 0.65 H new ATOM 0 HA ASN A 172 15.369 10.039 3.463 1.00 0.63 H new ATOM 0 HB2 ASN A 172 14.715 8.879 0.727 1.00 0.65 H new ATOM 0 HB3 ASN A 172 13.719 8.643 2.149 1.00 0.65 H new ATOM 0 HD21 ASN A 172 13.427 12.021 -0.068 1.00 0.80 H new ATOM 0 HD22 ASN A 172 14.538 10.705 -0.460 1.00 0.80 H new ATOM 2381 N TRP A 173 17.010 8.068 3.973 1.00 0.58 N ATOM 2382 CA TRP A 173 17.532 6.801 4.439 1.00 0.55 C ATOM 2383 C TRP A 173 16.507 6.183 5.379 1.00 0.54 C ATOM 2384 O TRP A 173 16.389 6.591 6.535 1.00 0.61 O ATOM 2385 CB TRP A 173 18.862 7.002 5.172 1.00 0.60 C ATOM 2386 CG TRP A 173 20.045 7.181 4.273 1.00 0.63 C ATOM 2387 CD1 TRP A 173 20.424 8.321 3.629 1.00 0.72 C ATOM 2388 CD2 TRP A 173 21.020 6.187 3.938 1.00 0.64 C ATOM 2389 NE1 TRP A 173 21.567 8.095 2.906 1.00 0.78 N ATOM 2390 CE2 TRP A 173 21.954 6.793 3.079 1.00 0.73 C ATOM 2391 CE3 TRP A 173 21.190 4.843 4.278 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 23.045 6.102 2.559 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 22.272 4.158 3.761 1.00 0.73 C ATOM 2394 CH2 TRP A 173 23.187 4.788 2.909 1.00 0.79 C ATOM 0 H TRP A 173 17.344 8.883 4.486 1.00 0.58 H new ATOM 0 HA TRP A 173 17.714 6.142 3.590 1.00 0.55 H new ATOM 0 HB2 TRP A 173 18.778 7.875 5.819 1.00 0.60 H new ATOM 0 HB3 TRP A 173 19.040 6.143 5.819 1.00 0.60 H new ATOM 0 HD1 TRP A 173 19.901 9.264 3.681 1.00 0.72 H new ATOM 0 HE1 TRP A 173 22.051 8.785 2.332 1.00 0.78 H new ATOM 0 HE3 TRP A 173 20.488 4.349 4.933 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 23.753 6.586 1.903 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 22.415 3.119 4.018 1.00 0.73 H new ATOM 0 HH2 TRP A 173 24.022 4.224 2.520 1.00 0.79 H new ATOM 2405 N LEU A 174 15.742 5.235 4.867 1.00 0.49 N ATOM 2406 CA LEU A 174 14.653 4.639 5.617 1.00 0.49 C ATOM 2407 C LEU A 174 15.173 3.833 6.793 1.00 0.53 C ATOM 2408 O LEU A 174 16.030 2.951 6.635 1.00 0.56 O ATOM 2409 CB LEU A 174 13.794 3.737 4.737 1.00 0.48 C ATOM 2410 CG LEU A 174 13.098 4.408 3.554 1.00 0.50 C ATOM 2411 CD1 LEU A 174 12.041 3.469 3.001 1.00 0.52 C ATOM 2412 CD2 LEU A 174 12.482 5.743 3.956 1.00 0.54 C ATOM 0 H LEU A 174 15.858 4.859 3.926 1.00 0.49 H new ATOM 0 HA LEU A 174 14.040 5.461 5.986 1.00 0.49 H new ATOM 0 HB2 LEU A 174 14.423 2.934 4.353 1.00 0.48 H new ATOM 0 HB3 LEU A 174 13.032 3.273 5.364 1.00 0.48 H new ATOM 0 HG LEU A 174 13.838 4.617 2.781 1.00 0.50 H new ATOM 0 HD11 LEU A 174 11.540 3.942 2.156 1.00 0.52 H new ATOM 0 HD12 LEU A 174 12.513 2.544 2.671 1.00 0.52 H new ATOM 0 HD13 LEU A 174 11.310 3.246 3.778 1.00 0.52 H new ATOM 0 HD21 LEU A 174 11.995 6.194 3.091 1.00 0.54 H new ATOM 0 HD22 LEU A 174 11.746 5.582 4.744 1.00 0.54 H new ATOM 0 HD23 LEU A 174 13.264 6.409 4.321 1.00 0.54 H new ATOM 2424 N ASP A 175 14.600 4.127 7.953 1.00 0.61 N ATOM 2425 CA ASP A 175 14.970 3.498 9.219 1.00 0.72 C ATOM 2426 C ASP A 175 14.273 2.153 9.378 1.00 0.68 C ATOM 2427 O ASP A 175 14.469 1.460 10.375 1.00 0.75 O ATOM 2428 CB ASP A 175 14.554 4.400 10.384 1.00 0.93 C ATOM 2429 CG ASP A 175 13.056 4.352 10.640 1.00 1.83 C ATOM 2430 OD1 ASP A 175 12.279 4.538 9.680 1.00 2.56 O ATOM 2431 OD2 ASP A 175 12.648 4.131 11.806 1.00 2.37 O ATOM 0 H ASP A 175 13.855 4.818 8.045 1.00 0.61 H new ATOM 0 HA ASP A 175 16.050 3.348 9.220 1.00 0.72 H new ATOM 0 HB2 ASP A 175 15.085 4.095 11.286 1.00 0.93 H new ATOM 0 HB3 ASP A 175 14.852 5.427 10.171 1.00 0.93 H new ATOM 2436 N HIS A 176 13.444 1.816 8.390 1.00 0.66 N ATOM 2437 CA HIS A 176 12.639 0.593 8.399 1.00 0.71 C ATOM 2438 C HIS A 176 11.442 0.716 9.330 1.00 0.83 C ATOM 2439 O HIS A 176 10.863 -0.287 9.737 1.00 1.10 O ATOM 2440 CB HIS A 176 13.470 -0.646 8.766 1.00 0.71 C ATOM 2441 CG HIS A 176 14.352 -1.129 7.661 1.00 0.69 C ATOM 2442 ND1 HIS A 176 13.896 -1.929 6.641 1.00 0.77 N ATOM 2443 CD2 HIS A 176 15.661 -0.913 7.407 1.00 0.67 C ATOM 2444 CE1 HIS A 176 14.880 -2.178 5.806 1.00 0.76 C ATOM 2445 NE2 HIS A 176 15.970 -1.579 6.245 1.00 0.69 N ATOM 0 H HIS A 176 13.311 2.387 7.555 1.00 0.66 H new ATOM 0 HA HIS A 176 12.273 0.461 7.381 1.00 0.71 H new ATOM 0 HB2 HIS A 176 14.086 -0.415 9.635 1.00 0.71 H new ATOM 0 HB3 HIS A 176 12.796 -1.451 9.058 1.00 0.71 H new ATOM 0 HD2 HIS A 176 16.340 -0.325 8.007 1.00 0.67 H new ATOM 0 HE1 HIS A 176 14.808 -2.775 4.909 1.00 0.76 H new ATOM 0 HE2 HIS A 176 16.887 -1.605 5.798 1.00 0.69 H new ATOM 2454 N GLY A 177 11.038 1.943 9.617 1.00 0.82 N ATOM 2455 CA GLY A 177 9.921 2.155 10.517 1.00 0.96 C ATOM 2456 C GLY A 177 8.887 3.078 9.921 1.00 1.00 C ATOM 2457 O GLY A 177 7.683 2.884 10.102 1.00 1.34 O ATOM 0 H GLY A 177 11.460 2.794 9.246 1.00 0.82 H new ATOM 0 HA2 GLY A 177 9.459 1.197 10.754 1.00 0.96 H new ATOM 0 HA3 GLY A 177 10.285 2.574 11.455 1.00 0.96 H new ATOM 2461 N ARG A 178 9.362 4.089 9.216 1.00 0.90 N ATOM 2462 CA ARG A 178 8.493 5.028 8.528 1.00 0.99 C ATOM 2463 C ARG A 178 7.685 4.326 7.438 1.00 0.87 C ATOM 2464 O ARG A 178 8.210 3.473 6.718 1.00 0.86 O ATOM 2465 CB ARG A 178 9.336 6.133 7.903 1.00 1.22 C ATOM 2466 CG ARG A 178 8.520 7.201 7.201 1.00 1.27 C ATOM 2467 CD ARG A 178 7.779 8.078 8.191 1.00 1.18 C ATOM 2468 NE ARG A 178 8.696 8.705 9.135 1.00 1.23 N ATOM 2469 CZ ARG A 178 8.395 8.997 10.399 1.00 1.74 C ATOM 2470 NH1 ARG A 178 7.209 8.676 10.903 1.00 2.16 N ATOM 2471 NH2 ARG A 178 9.295 9.595 11.167 1.00 2.18 N ATOM 0 H ARG A 178 10.357 4.282 9.104 1.00 0.90 H new ATOM 0 HA ARG A 178 7.799 5.453 9.253 1.00 0.99 H new ATOM 0 HB2 ARG A 178 9.939 6.602 8.681 1.00 1.22 H new ATOM 0 HB3 ARG A 178 10.028 5.689 7.188 1.00 1.22 H new ATOM 0 HG2 ARG A 178 9.177 7.818 6.588 1.00 1.27 H new ATOM 0 HG3 ARG A 178 7.806 6.729 6.526 1.00 1.27 H new ATOM 0 HD2 ARG A 178 7.225 8.848 7.654 1.00 1.18 H new ATOM 0 HD3 ARG A 178 7.048 7.479 8.734 1.00 1.18 H new ATOM 0 HE ARG A 178 9.633 8.936 8.805 1.00 1.23 H new ATOM 0 HH11 ARG A 178 6.519 8.201 10.321 1.00 2.16 H new ATOM 0 HH12 ARG A 178 6.988 8.904 11.872 1.00 2.16 H new ATOM 0 HH21 ARG A 178 10.213 9.829 10.789 1.00 2.18 H new ATOM 0 HH22 ARG A 178 9.069 9.821 12.136 1.00 2.18 H new ATOM 2485 N THR A 179 6.416 4.694 7.309 1.00 0.91 N ATOM 2486 CA THR A 179 5.566 4.131 6.271 1.00 0.89 C ATOM 2487 C THR A 179 5.805 4.885 4.963 1.00 0.86 C ATOM 2488 O THR A 179 6.242 6.035 4.983 1.00 0.91 O ATOM 2489 CB THR A 179 4.070 4.195 6.667 1.00 1.05 C ATOM 2490 OG1 THR A 179 3.499 5.452 6.309 1.00 1.20 O ATOM 2491 CG2 THR A 179 3.911 3.991 8.165 1.00 1.11 C ATOM 0 H THR A 179 5.955 5.378 7.909 1.00 0.91 H new ATOM 0 HA THR A 179 5.823 3.080 6.142 1.00 0.89 H new ATOM 0 HB THR A 179 3.552 3.401 6.129 1.00 1.05 H new ATOM 0 HG1 THR A 179 2.738 5.644 6.896 1.00 1.20 H new ATOM 0 HG21 THR A 179 2.854 4.039 8.429 1.00 1.11 H new ATOM 0 HG22 THR A 179 4.311 3.016 8.444 1.00 1.11 H new ATOM 0 HG23 THR A 179 4.453 4.772 8.698 1.00 1.11 H new ATOM 2499 N LEU A 180 5.531 4.246 3.836 1.00 0.84 N ATOM 2500 CA LEU A 180 5.854 4.826 2.533 1.00 0.84 C ATOM 2501 C LEU A 180 4.983 6.041 2.255 1.00 0.93 C ATOM 2502 O LEU A 180 5.456 7.073 1.773 1.00 0.97 O ATOM 2503 CB LEU A 180 5.674 3.782 1.434 1.00 0.85 C ATOM 2504 CG LEU A 180 6.316 2.431 1.736 1.00 0.83 C ATOM 2505 CD1 LEU A 180 6.288 1.535 0.506 1.00 1.08 C ATOM 2506 CD2 LEU A 180 7.738 2.622 2.242 1.00 0.90 C ATOM 0 H LEU A 180 5.087 3.329 3.793 1.00 0.84 H new ATOM 0 HA LEU A 180 6.895 5.148 2.546 1.00 0.84 H new ATOM 0 HB2 LEU A 180 4.608 3.634 1.262 1.00 0.85 H new ATOM 0 HB3 LEU A 180 6.095 4.172 0.507 1.00 0.85 H new ATOM 0 HG LEU A 180 5.739 1.940 2.520 1.00 0.83 H new ATOM 0 HD11 LEU A 180 6.751 0.577 0.743 1.00 1.08 H new ATOM 0 HD12 LEU A 180 5.255 1.373 0.197 1.00 1.08 H new ATOM 0 HD13 LEU A 180 6.838 2.013 -0.305 1.00 1.08 H new ATOM 0 HD21 LEU A 180 8.183 1.650 2.453 1.00 0.90 H new ATOM 0 HD22 LEU A 180 8.329 3.134 1.482 1.00 0.90 H new ATOM 0 HD23 LEU A 180 7.723 3.220 3.154 1.00 0.90 H new ATOM 2518 N ARG A 181 3.713 5.899 2.575 1.00 1.02 N ATOM 2519 CA ARG A 181 2.748 6.978 2.477 1.00 1.13 C ATOM 2520 C ARG A 181 3.168 8.148 3.365 1.00 1.18 C ATOM 2521 O ARG A 181 2.966 9.315 3.028 1.00 1.36 O ATOM 2522 CB ARG A 181 1.405 6.441 2.938 1.00 1.22 C ATOM 2523 CG ARG A 181 0.195 7.223 2.472 1.00 1.15 C ATOM 2524 CD ARG A 181 -1.046 6.698 3.170 1.00 0.69 C ATOM 2525 NE ARG A 181 -0.916 5.263 3.449 1.00 1.10 N ATOM 2526 CZ ARG A 181 -1.180 4.701 4.629 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -1.821 5.381 5.568 1.00 2.54 N ATOM 2528 NH2 ARG A 181 -0.826 3.444 4.852 1.00 2.64 N ATOM 0 H ARG A 181 3.316 5.023 2.914 1.00 1.02 H new ATOM 0 HA ARG A 181 2.688 7.336 1.449 1.00 1.13 H new ATOM 0 HB2 ARG A 181 1.306 5.412 2.591 1.00 1.22 H new ATOM 0 HB3 ARG A 181 1.400 6.412 4.028 1.00 1.22 H new ATOM 0 HG2 ARG A 181 0.327 8.283 2.690 1.00 1.15 H new ATOM 0 HG3 ARG A 181 0.084 7.132 1.392 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -1.203 7.242 4.101 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -1.922 6.874 2.546 1.00 0.69 H new ATOM 0 HE ARG A 181 -0.603 4.656 2.691 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -2.116 6.341 5.391 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -2.019 4.944 6.468 1.00 2.54 H new ATOM 0 HH21 ARG A 181 -0.353 2.910 4.123 1.00 2.64 H new ATOM 0 HH22 ARG A 181 -1.026 3.010 5.753 1.00 2.64 H new ATOM 2542 N GLU A 182 3.777 7.807 4.495 1.00 1.11 N ATOM 2543 CA GLU A 182 4.185 8.783 5.494 1.00 1.18 C ATOM 2544 C GLU A 182 5.428 9.519 5.016 1.00 1.16 C ATOM 2545 O GLU A 182 5.624 10.697 5.311 1.00 1.25 O ATOM 2546 CB GLU A 182 4.467 8.067 6.815 1.00 1.25 C ATOM 2547 CG GLU A 182 4.179 8.891 8.047 1.00 1.34 C ATOM 2548 CD GLU A 182 4.250 8.077 9.322 1.00 1.89 C ATOM 2549 OE1 GLU A 182 5.281 7.415 9.559 1.00 2.31 O ATOM 2550 OE2 GLU A 182 3.276 8.106 10.101 1.00 2.30 O ATOM 0 H GLU A 182 4.001 6.843 4.743 1.00 1.11 H new ATOM 0 HA GLU A 182 3.386 9.509 5.645 1.00 1.18 H new ATOM 0 HB2 GLU A 182 3.870 7.156 6.855 1.00 1.25 H new ATOM 0 HB3 GLU A 182 5.514 7.763 6.833 1.00 1.25 H new ATOM 0 HG2 GLU A 182 4.893 9.713 8.105 1.00 1.34 H new ATOM 0 HG3 GLU A 182 3.188 9.335 7.959 1.00 1.34 H new ATOM 2557 N GLN A 183 6.254 8.802 4.265 1.00 1.07 N ATOM 2558 CA GLN A 183 7.458 9.363 3.670 1.00 1.06 C ATOM 2559 C GLN A 183 7.103 10.408 2.623 1.00 1.13 C ATOM 2560 O GLN A 183 7.880 11.323 2.357 1.00 1.22 O ATOM 2561 CB GLN A 183 8.285 8.251 3.025 1.00 1.00 C ATOM 2562 CG GLN A 183 8.903 7.299 4.030 1.00 1.00 C ATOM 2563 CD GLN A 183 9.240 5.942 3.447 1.00 1.04 C ATOM 2564 OE1 GLN A 183 9.527 5.809 2.260 1.00 1.65 O ATOM 2565 NE2 GLN A 183 9.210 4.917 4.288 1.00 0.81 N ATOM 0 H GLN A 183 6.107 7.815 4.052 1.00 1.07 H new ATOM 0 HA GLN A 183 8.041 9.841 4.457 1.00 1.06 H new ATOM 0 HB2 GLN A 183 7.650 7.685 2.343 1.00 1.00 H new ATOM 0 HB3 GLN A 183 9.077 8.699 2.425 1.00 1.00 H new ATOM 0 HG2 GLN A 183 9.810 7.748 4.434 1.00 1.00 H new ATOM 0 HG3 GLN A 183 8.214 7.167 4.864 1.00 1.00 H new ATOM 0 HE21 GLN A 183 8.967 5.068 5.267 1.00 0.81 H new ATOM 0 HE22 GLN A 183 9.430 3.978 3.956 1.00 0.81 H new ATOM 2574 N GLY A 184 5.920 10.269 2.037 1.00 1.16 N ATOM 2575 CA GLY A 184 5.505 11.171 0.987 1.00 1.28 C ATOM 2576 C GLY A 184 6.296 10.954 -0.282 1.00 1.23 C ATOM 2577 O GLY A 184 6.579 11.900 -1.017 1.00 1.38 O ATOM 0 H GLY A 184 5.241 9.545 2.273 1.00 1.16 H new ATOM 0 HA2 GLY A 184 4.444 11.028 0.783 1.00 1.28 H new ATOM 0 HA3 GLY A 184 5.630 12.201 1.322 1.00 1.28 H new ATOM 2581 N VAL A 185 6.695 9.711 -0.505 1.00 1.10 N ATOM 2582 CA VAL A 185 7.428 9.339 -1.704 1.00 1.08 C ATOM 2583 C VAL A 185 6.480 8.936 -2.834 1.00 1.02 C ATOM 2584 O VAL A 185 5.331 8.559 -2.590 1.00 1.15 O ATOM 2585 CB VAL A 185 8.379 8.167 -1.406 1.00 1.13 C ATOM 2586 CG1 VAL A 185 9.351 8.546 -0.299 1.00 1.31 C ATOM 2587 CG2 VAL A 185 7.587 6.925 -1.022 1.00 1.14 C ATOM 0 H VAL A 185 6.521 8.937 0.136 1.00 1.10 H new ATOM 0 HA VAL A 185 8.001 10.210 -2.021 1.00 1.08 H new ATOM 0 HB VAL A 185 8.951 7.944 -2.307 1.00 1.13 H new ATOM 0 HG11 VAL A 185 10.018 7.708 -0.098 1.00 1.31 H new ATOM 0 HG12 VAL A 185 9.938 9.410 -0.610 1.00 1.31 H new ATOM 0 HG13 VAL A 185 8.795 8.792 0.605 1.00 1.31 H new ATOM 0 HG21 VAL A 185 8.274 6.105 -0.814 1.00 1.14 H new ATOM 0 HG22 VAL A 185 6.992 7.133 -0.133 1.00 1.14 H new ATOM 0 HG23 VAL A 185 6.927 6.646 -1.843 1.00 1.14 H new ATOM 2597 N GLU A 186 6.967 9.014 -4.066 1.00 0.93 N ATOM 2598 CA GLU A 186 6.208 8.583 -5.222 1.00 0.92 C ATOM 2599 C GLU A 186 6.616 7.172 -5.620 1.00 0.83 C ATOM 2600 O GLU A 186 7.348 6.493 -4.891 1.00 0.82 O ATOM 2601 CB GLU A 186 6.425 9.540 -6.396 1.00 1.02 C ATOM 2602 CG GLU A 186 5.767 10.894 -6.218 1.00 1.46 C ATOM 2603 CD GLU A 186 4.255 10.808 -6.263 1.00 2.45 C ATOM 2604 OE1 GLU A 186 3.708 10.657 -7.376 1.00 2.97 O ATOM 2605 OE2 GLU A 186 3.606 10.886 -5.200 1.00 3.02 O ATOM 0 H GLU A 186 7.895 9.376 -4.286 1.00 0.93 H new ATOM 0 HA GLU A 186 5.150 8.588 -4.961 1.00 0.92 H new ATOM 0 HB2 GLU A 186 7.496 9.684 -6.541 1.00 1.02 H new ATOM 0 HB3 GLU A 186 6.040 9.077 -7.305 1.00 1.02 H new ATOM 0 HG2 GLU A 186 6.076 11.323 -5.265 1.00 1.46 H new ATOM 0 HG3 GLU A 186 6.114 11.570 -7.000 1.00 1.46 H new ATOM 2612 N GLU A 187 6.140 6.734 -6.770 1.00 0.89 N ATOM 2613 CA GLU A 187 6.416 5.392 -7.256 1.00 0.91 C ATOM 2614 C GLU A 187 7.515 5.398 -8.318 1.00 0.91 C ATOM 2615 O GLU A 187 8.169 4.387 -8.553 1.00 1.14 O ATOM 2616 CB GLU A 187 5.132 4.801 -7.827 1.00 1.05 C ATOM 2617 CG GLU A 187 4.048 4.576 -6.782 1.00 1.11 C ATOM 2618 CD GLU A 187 2.676 4.381 -7.394 1.00 1.36 C ATOM 2619 OE1 GLU A 187 2.327 5.123 -8.336 1.00 1.86 O ATOM 2620 OE2 GLU A 187 1.935 3.487 -6.942 1.00 1.72 O ATOM 0 H GLU A 187 5.555 7.293 -7.391 1.00 0.89 H new ATOM 0 HA GLU A 187 6.770 4.782 -6.425 1.00 0.91 H new ATOM 0 HB2 GLU A 187 4.748 5.467 -8.600 1.00 1.05 H new ATOM 0 HB3 GLU A 187 5.362 3.851 -8.310 1.00 1.05 H new ATOM 0 HG2 GLU A 187 4.302 3.701 -6.184 1.00 1.11 H new ATOM 0 HG3 GLU A 187 4.021 5.429 -6.104 1.00 1.11 H new ATOM 2627 N HIS A 188 7.724 6.553 -8.938 1.00 0.92 N ATOM 2628 CA HIS A 188 8.673 6.674 -10.048 1.00 0.95 C ATOM 2629 C HIS A 188 10.071 7.058 -9.579 1.00 0.92 C ATOM 2630 O HIS A 188 11.006 7.106 -10.378 1.00 1.01 O ATOM 2631 CB HIS A 188 8.177 7.707 -11.067 1.00 1.04 C ATOM 2632 CG HIS A 188 7.807 9.033 -10.467 1.00 1.03 C ATOM 2633 ND1 HIS A 188 6.506 9.403 -10.225 1.00 1.09 N ATOM 2634 CD2 HIS A 188 8.572 10.076 -10.061 1.00 1.08 C ATOM 2635 CE1 HIS A 188 6.484 10.612 -9.697 1.00 1.14 C ATOM 2636 NE2 HIS A 188 7.726 11.046 -9.589 1.00 1.15 N ATOM 0 H HIS A 188 7.250 7.423 -8.694 1.00 0.92 H new ATOM 0 HA HIS A 188 8.735 5.691 -10.515 1.00 0.95 H new ATOM 0 HB2 HIS A 188 8.953 7.863 -11.816 1.00 1.04 H new ATOM 0 HB3 HIS A 188 7.309 7.301 -11.587 1.00 1.04 H new ATOM 0 HD1 HIS A 188 5.685 8.832 -10.423 1.00 1.09 H new ATOM 0 HD2 HIS A 188 9.650 10.132 -10.102 1.00 1.08 H new ATOM 0 HE1 HIS A 188 5.598 11.155 -9.403 1.00 1.14 H new ATOM 2645 N GLU A 189 10.214 7.334 -8.295 1.00 0.89 N ATOM 2646 CA GLU A 189 11.485 7.797 -7.753 1.00 0.92 C ATOM 2647 C GLU A 189 12.376 6.608 -7.404 1.00 0.78 C ATOM 2648 O GLU A 189 11.891 5.599 -6.890 1.00 0.74 O ATOM 2649 CB GLU A 189 11.228 8.674 -6.529 1.00 1.10 C ATOM 2650 CG GLU A 189 10.254 9.809 -6.813 1.00 1.37 C ATOM 2651 CD GLU A 189 9.954 10.656 -5.596 1.00 1.82 C ATOM 2652 OE1 GLU A 189 9.250 10.166 -4.691 1.00 2.34 O ATOM 2653 OE2 GLU A 189 10.423 11.813 -5.546 1.00 2.38 O ATOM 0 H GLU A 189 9.467 7.246 -7.606 1.00 0.89 H new ATOM 0 HA GLU A 189 12.005 8.393 -8.503 1.00 0.92 H new ATOM 0 HB2 GLU A 189 10.835 8.057 -5.721 1.00 1.10 H new ATOM 0 HB3 GLU A 189 12.173 9.090 -6.181 1.00 1.10 H new ATOM 0 HG2 GLU A 189 10.665 10.444 -7.597 1.00 1.37 H new ATOM 0 HG3 GLU A 189 9.323 9.392 -7.196 1.00 1.37 H new ATOM 2660 N THR A 190 13.666 6.716 -7.708 1.00 0.74 N ATOM 2661 CA THR A 190 14.588 5.599 -7.530 1.00 0.66 C ATOM 2662 C THR A 190 15.021 5.440 -6.073 1.00 0.57 C ATOM 2663 O THR A 190 15.560 6.361 -5.460 1.00 0.61 O ATOM 2664 CB THR A 190 15.837 5.750 -8.428 1.00 0.70 C ATOM 2665 OG1 THR A 190 15.444 5.853 -9.805 1.00 0.81 O ATOM 2666 CG2 THR A 190 16.777 4.560 -8.265 1.00 0.66 C ATOM 0 H THR A 190 14.096 7.564 -8.078 1.00 0.74 H new ATOM 0 HA THR A 190 14.045 4.702 -7.826 1.00 0.66 H new ATOM 0 HB THR A 190 16.360 6.656 -8.123 1.00 0.70 H new ATOM 0 HG1 THR A 190 16.241 5.950 -10.366 1.00 0.81 H new ATOM 0 HG21 THR A 190 17.647 4.693 -8.908 1.00 0.66 H new ATOM 0 HG22 THR A 190 17.101 4.492 -7.226 1.00 0.66 H new ATOM 0 HG23 THR A 190 16.256 3.644 -8.544 1.00 0.66 H new ATOM 2674 N LEU A 191 14.791 4.250 -5.538 1.00 0.48 N ATOM 2675 CA LEU A 191 15.159 3.930 -4.168 1.00 0.42 C ATOM 2676 C LEU A 191 16.292 2.913 -4.209 1.00 0.39 C ATOM 2677 O LEU A 191 16.308 2.036 -5.072 1.00 0.38 O ATOM 2678 CB LEU A 191 13.971 3.349 -3.372 1.00 0.41 C ATOM 2679 CG LEU A 191 12.614 4.072 -3.487 1.00 0.51 C ATOM 2680 CD1 LEU A 191 12.778 5.571 -3.677 1.00 1.01 C ATOM 2681 CD2 LEU A 191 11.773 3.473 -4.602 1.00 0.82 C ATOM 0 H LEU A 191 14.346 3.482 -6.040 1.00 0.48 H new ATOM 0 HA LEU A 191 15.469 4.846 -3.664 1.00 0.42 H new ATOM 0 HB2 LEU A 191 13.829 2.315 -3.687 1.00 0.41 H new ATOM 0 HB3 LEU A 191 14.251 3.326 -2.319 1.00 0.41 H new ATOM 0 HG LEU A 191 12.091 3.924 -2.542 1.00 0.51 H new ATOM 0 HD11 LEU A 191 11.796 6.038 -3.753 1.00 1.01 H new ATOM 0 HD12 LEU A 191 13.314 5.989 -2.825 1.00 1.01 H new ATOM 0 HD13 LEU A 191 13.342 5.762 -4.590 1.00 1.01 H new ATOM 0 HD21 LEU A 191 10.821 4.000 -4.663 1.00 0.82 H new ATOM 0 HD22 LEU A 191 12.303 3.570 -5.550 1.00 0.82 H new ATOM 0 HD23 LEU A 191 11.591 2.419 -4.394 1.00 0.82 H new ATOM 2693 N LEU A 192 17.249 3.018 -3.308 1.00 0.39 N ATOM 2694 CA LEU A 192 18.420 2.164 -3.374 1.00 0.41 C ATOM 2695 C LEU A 192 18.510 1.282 -2.138 1.00 0.40 C ATOM 2696 O LEU A 192 18.251 1.734 -1.021 1.00 0.44 O ATOM 2697 CB LEU A 192 19.678 3.026 -3.475 1.00 0.44 C ATOM 2698 CG LEU A 192 19.490 4.361 -4.198 1.00 0.49 C ATOM 2699 CD1 LEU A 192 20.697 5.250 -3.985 1.00 0.56 C ATOM 2700 CD2 LEU A 192 19.250 4.150 -5.683 1.00 0.50 C ATOM 0 H LEU A 192 17.241 3.678 -2.530 1.00 0.39 H new ATOM 0 HA LEU A 192 18.336 1.527 -4.255 1.00 0.41 H new ATOM 0 HB2 LEU A 192 20.047 3.224 -2.468 1.00 0.44 H new ATOM 0 HB3 LEU A 192 20.451 2.456 -3.991 1.00 0.44 H new ATOM 0 HG LEU A 192 18.611 4.850 -3.778 1.00 0.49 H new ATOM 0 HD11 LEU A 192 20.548 6.196 -4.505 1.00 0.56 H new ATOM 0 HD12 LEU A 192 20.827 5.439 -2.919 1.00 0.56 H new ATOM 0 HD13 LEU A 192 21.586 4.756 -4.377 1.00 0.56 H new ATOM 0 HD21 LEU A 192 19.120 5.116 -6.171 1.00 0.50 H new ATOM 0 HD22 LEU A 192 20.105 3.635 -6.120 1.00 0.50 H new ATOM 0 HD23 LEU A 192 18.352 3.548 -5.825 1.00 0.50 H new ATOM 2712 N LEU A 193 18.851 0.021 -2.345 1.00 0.43 N ATOM 2713 CA LEU A 193 19.087 -0.896 -1.246 1.00 0.50 C ATOM 2714 C LEU A 193 20.546 -0.787 -0.796 1.00 0.47 C ATOM 2715 O LEU A 193 21.463 -0.916 -1.608 1.00 0.49 O ATOM 2716 CB LEU A 193 18.732 -2.323 -1.695 1.00 0.68 C ATOM 2717 CG LEU A 193 18.795 -3.409 -0.617 1.00 0.44 C ATOM 2718 CD1 LEU A 193 17.787 -4.504 -0.917 1.00 1.09 C ATOM 2719 CD2 LEU A 193 20.184 -4.012 -0.542 1.00 1.03 C ATOM 0 H LEU A 193 18.971 -0.391 -3.270 1.00 0.43 H new ATOM 0 HA LEU A 193 18.456 -0.643 -0.394 1.00 0.50 H new ATOM 0 HB2 LEU A 193 17.724 -2.310 -2.109 1.00 0.68 H new ATOM 0 HB3 LEU A 193 19.406 -2.605 -2.504 1.00 0.68 H new ATOM 0 HG LEU A 193 18.557 -2.948 0.342 1.00 0.44 H new ATOM 0 HD11 LEU A 193 17.841 -5.270 -0.144 1.00 1.09 H new ATOM 0 HD12 LEU A 193 16.783 -4.079 -0.937 1.00 1.09 H new ATOM 0 HD13 LEU A 193 18.012 -4.950 -1.886 1.00 1.09 H new ATOM 0 HD21 LEU A 193 20.206 -4.781 0.230 1.00 1.03 H new ATOM 0 HD22 LEU A 193 20.440 -4.456 -1.504 1.00 1.03 H new ATOM 0 HD23 LEU A 193 20.906 -3.233 -0.298 1.00 1.03 H new ATOM 2731 N ARG A 194 20.752 -0.526 0.489 1.00 0.46 N ATOM 2732 CA ARG A 194 22.091 -0.314 1.031 1.00 0.46 C ATOM 2733 C ARG A 194 22.383 -1.316 2.127 1.00 0.44 C ATOM 2734 O ARG A 194 21.481 -1.721 2.850 1.00 0.49 O ATOM 2735 CB ARG A 194 22.222 1.094 1.615 1.00 0.53 C ATOM 2736 CG ARG A 194 22.194 2.205 0.585 1.00 0.60 C ATOM 2737 CD ARG A 194 23.386 2.136 -0.351 1.00 0.65 C ATOM 2738 NE ARG A 194 24.651 2.028 0.375 1.00 0.69 N ATOM 2739 CZ ARG A 194 25.845 2.137 -0.203 1.00 0.95 C ATOM 2740 NH1 ARG A 194 25.936 2.382 -1.505 1.00 1.25 N ATOM 2741 NH2 ARG A 194 26.945 1.999 0.525 1.00 1.06 N ATOM 0 H ARG A 194 20.005 -0.456 1.180 1.00 0.46 H new ATOM 0 HA ARG A 194 22.801 -0.440 0.214 1.00 0.46 H new ATOM 0 HB2 ARG A 194 21.413 1.255 2.327 1.00 0.53 H new ATOM 0 HB3 ARG A 194 23.156 1.157 2.174 1.00 0.53 H new ATOM 0 HG2 ARG A 194 21.273 2.140 0.006 1.00 0.60 H new ATOM 0 HG3 ARG A 194 22.185 3.170 1.092 1.00 0.60 H new ATOM 0 HD2 ARG A 194 23.276 1.279 -1.015 1.00 0.65 H new ATOM 0 HD3 ARG A 194 23.404 3.026 -0.980 1.00 0.65 H new ATOM 0 HE ARG A 194 24.616 1.860 1.380 1.00 0.69 H new ATOM 0 HH11 ARG A 194 25.090 2.487 -2.065 1.00 1.25 H new ATOM 0 HH12 ARG A 194 26.852 2.465 -1.945 1.00 1.25 H new ATOM 0 HH21 ARG A 194 26.874 1.810 1.525 1.00 1.06 H new ATOM 0 HH22 ARG A 194 27.861 2.082 0.085 1.00 1.06 H new ATOM 2755 N ARG A 195 23.634 -1.717 2.257 1.00 0.45 N ATOM 2756 CA ARG A 195 24.013 -2.604 3.339 1.00 0.50 C ATOM 2757 C ARG A 195 24.294 -1.813 4.614 1.00 0.55 C ATOM 2758 O ARG A 195 24.999 -0.799 4.601 1.00 0.64 O ATOM 2759 CB ARG A 195 25.228 -3.464 2.971 1.00 0.59 C ATOM 2760 CG ARG A 195 26.486 -2.670 2.671 1.00 1.02 C ATOM 2761 CD ARG A 195 27.698 -3.269 3.366 1.00 1.07 C ATOM 2762 NE ARG A 195 27.595 -3.175 4.822 1.00 1.49 N ATOM 2763 CZ ARG A 195 28.103 -2.159 5.528 1.00 2.13 C ATOM 2764 NH1 ARG A 195 28.636 -1.119 4.899 1.00 2.34 N ATOM 2765 NH2 ARG A 195 28.064 -2.171 6.854 1.00 2.68 N ATOM 0 H ARG A 195 24.396 -1.446 1.635 1.00 0.45 H new ATOM 0 HA ARG A 195 23.172 -3.274 3.517 1.00 0.50 H new ATOM 0 HB2 ARG A 195 25.433 -4.152 3.791 1.00 0.59 H new ATOM 0 HB3 ARG A 195 24.979 -4.071 2.100 1.00 0.59 H new ATOM 0 HG2 ARG A 195 26.656 -2.648 1.595 1.00 1.02 H new ATOM 0 HG3 ARG A 195 26.352 -1.638 2.994 1.00 1.02 H new ATOM 0 HD2 ARG A 195 27.802 -4.315 3.076 1.00 1.07 H new ATOM 0 HD3 ARG A 195 28.599 -2.754 3.032 1.00 1.07 H new ATOM 0 HE ARG A 195 27.112 -3.921 5.323 1.00 1.49 H new ATOM 0 HH11 ARG A 195 28.658 -1.096 3.879 1.00 2.34 H new ATOM 0 HH12 ARG A 195 29.024 -0.343 5.435 1.00 2.34 H new ATOM 0 HH21 ARG A 195 27.644 -2.960 7.345 1.00 2.68 H new ATOM 0 HH22 ARG A 195 28.454 -1.391 7.383 1.00 2.68 H new ATOM 2779 N LYS A 196 23.710 -2.273 5.703 1.00 0.60 N ATOM 2780 CA LYS A 196 23.959 -1.706 7.014 1.00 0.69 C ATOM 2781 C LYS A 196 24.966 -2.589 7.749 1.00 0.76 C ATOM 2782 O LYS A 196 25.742 -2.119 8.579 1.00 0.88 O ATOM 2783 CB LYS A 196 22.650 -1.590 7.804 1.00 0.75 C ATOM 2784 CG LYS A 196 22.793 -0.842 9.119 1.00 0.88 C ATOM 2785 CD LYS A 196 21.443 -0.599 9.777 1.00 1.28 C ATOM 2786 CE LYS A 196 21.583 0.263 11.021 1.00 1.65 C ATOM 2787 NZ LYS A 196 20.266 0.644 11.599 1.00 2.15 N ATOM 0 H LYS A 196 23.050 -3.050 5.704 1.00 0.60 H new ATOM 0 HA LYS A 196 24.371 -0.702 6.910 1.00 0.69 H new ATOM 0 HB2 LYS A 196 21.908 -1.083 7.187 1.00 0.75 H new ATOM 0 HB3 LYS A 196 22.268 -2.591 8.005 1.00 0.75 H new ATOM 0 HG2 LYS A 196 23.430 -1.413 9.795 1.00 0.88 H new ATOM 0 HG3 LYS A 196 23.289 0.112 8.943 1.00 0.88 H new ATOM 0 HD2 LYS A 196 20.773 -0.113 9.068 1.00 1.28 H new ATOM 0 HD3 LYS A 196 20.988 -1.553 10.042 1.00 1.28 H new ATOM 0 HE2 LYS A 196 22.163 -0.276 11.770 1.00 1.65 H new ATOM 0 HE3 LYS A 196 22.143 1.165 10.773 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 20.415 1.231 12.445 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 19.721 1.182 10.896 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 19.741 -0.214 11.861 1.00 2.15 H new ATOM 2801 N PHE A 197 24.942 -3.877 7.421 1.00 0.77 N ATOM 2802 CA PHE A 197 25.945 -4.826 7.891 1.00 0.89 C ATOM 2803 C PHE A 197 26.446 -5.601 6.680 1.00 0.96 C ATOM 2804 O PHE A 197 25.939 -5.397 5.578 1.00 0.92 O ATOM 2805 CB PHE A 197 25.369 -5.808 8.927 1.00 0.95 C ATOM 2806 CG PHE A 197 24.435 -5.191 9.931 1.00 0.94 C ATOM 2807 CD1 PHE A 197 24.895 -4.213 10.794 1.00 1.14 C ATOM 2808 CD2 PHE A 197 23.107 -5.575 10.009 1.00 0.92 C ATOM 2809 CE1 PHE A 197 24.057 -3.630 11.719 1.00 1.19 C ATOM 2810 CE2 PHE A 197 22.257 -4.996 10.933 1.00 0.95 C ATOM 2811 CZ PHE A 197 22.684 -4.084 11.782 1.00 1.03 C ATOM 0 H PHE A 197 24.228 -4.292 6.823 1.00 0.77 H new ATOM 0 HA PHE A 197 26.751 -4.280 8.380 1.00 0.89 H new ATOM 0 HB2 PHE A 197 24.840 -6.601 8.399 1.00 0.95 H new ATOM 0 HB3 PHE A 197 26.196 -6.277 9.461 1.00 0.95 H new ATOM 0 HD1 PHE A 197 25.928 -3.901 10.742 1.00 1.14 H new ATOM 0 HD2 PHE A 197 22.731 -6.335 9.341 1.00 0.92 H new ATOM 0 HE1 PHE A 197 24.415 -2.854 12.380 1.00 1.19 H new ATOM 0 HE2 PHE A 197 21.220 -5.298 10.959 1.00 0.95 H new ATOM 0 HZ PHE A 197 22.012 -3.676 12.523 1.00 1.03 H new ATOM 2821 N PHE A 198 27.438 -6.459 6.851 1.00 1.16 N ATOM 2822 CA PHE A 198 27.904 -7.285 5.743 1.00 1.33 C ATOM 2823 C PHE A 198 28.323 -8.673 6.213 1.00 1.58 C ATOM 2824 O PHE A 198 29.255 -9.271 5.669 1.00 2.05 O ATOM 2825 CB PHE A 198 29.050 -6.595 4.985 1.00 1.51 C ATOM 2826 CG PHE A 198 30.177 -6.088 5.846 1.00 1.40 C ATOM 2827 CD1 PHE A 198 31.166 -6.942 6.310 1.00 1.61 C ATOM 2828 CD2 PHE A 198 30.250 -4.747 6.176 1.00 1.53 C ATOM 2829 CE1 PHE A 198 32.202 -6.465 7.089 1.00 1.95 C ATOM 2830 CE2 PHE A 198 31.282 -4.263 6.952 1.00 1.78 C ATOM 2831 CZ PHE A 198 32.261 -5.123 7.411 1.00 2.00 C ATOM 0 H PHE A 198 27.932 -6.603 7.732 1.00 1.16 H new ATOM 0 HA PHE A 198 27.067 -7.410 5.056 1.00 1.33 H new ATOM 0 HB2 PHE A 198 29.458 -7.297 4.258 1.00 1.51 H new ATOM 0 HB3 PHE A 198 28.639 -5.757 4.422 1.00 1.51 H new ATOM 0 HD1 PHE A 198 31.126 -7.992 6.059 1.00 1.61 H new ATOM 0 HD2 PHE A 198 29.488 -4.069 5.821 1.00 1.53 H new ATOM 0 HE1 PHE A 198 32.965 -7.141 7.446 1.00 1.95 H new ATOM 0 HE2 PHE A 198 31.325 -3.213 7.201 1.00 1.78 H new ATOM 0 HZ PHE A 198 33.070 -4.747 8.020 1.00 2.00 H new ATOM 2841 N TYR A 199 27.609 -9.205 7.197 1.00 1.48 N ATOM 2842 CA TYR A 199 27.882 -10.554 7.669 1.00 1.79 C ATOM 2843 C TYR A 199 27.448 -11.571 6.617 1.00 2.06 C ATOM 2844 O TYR A 199 28.065 -12.624 6.466 1.00 2.27 O ATOM 2845 CB TYR A 199 27.204 -10.828 9.024 1.00 2.08 C ATOM 2846 CG TYR A 199 25.692 -10.719 9.032 1.00 2.04 C ATOM 2847 CD1 TYR A 199 24.897 -11.813 8.711 1.00 2.35 C ATOM 2848 CD2 TYR A 199 25.062 -9.520 9.344 1.00 2.05 C ATOM 2849 CE1 TYR A 199 23.519 -11.715 8.704 1.00 2.78 C ATOM 2850 CE2 TYR A 199 23.686 -9.416 9.341 1.00 2.47 C ATOM 2851 CZ TYR A 199 22.918 -10.523 9.072 1.00 2.89 C ATOM 2852 OH TYR A 199 21.548 -10.411 9.024 1.00 3.53 O ATOM 0 H TYR A 199 26.846 -8.729 7.678 1.00 1.48 H new ATOM 0 HA TYR A 199 28.956 -10.652 7.826 1.00 1.79 H new ATOM 0 HB2 TYR A 199 27.480 -11.830 9.353 1.00 2.08 H new ATOM 0 HB3 TYR A 199 27.605 -10.130 9.759 1.00 2.08 H new ATOM 0 HD1 TYR A 199 25.364 -12.755 8.463 1.00 2.35 H new ATOM 0 HD2 TYR A 199 25.659 -8.655 9.593 1.00 2.05 H new ATOM 0 HE1 TYR A 199 22.915 -12.562 8.414 1.00 2.78 H new ATOM 0 HE2 TYR A 199 23.214 -8.467 9.550 1.00 2.47 H new ATOM 0 HH TYR A 199 21.260 -10.322 8.092 1.00 3.53 H new ATOM 2862 N SER A 200 26.387 -11.227 5.891 1.00 2.43 N ATOM 2863 CA SER A 200 25.885 -12.022 4.777 1.00 3.08 C ATOM 2864 C SER A 200 25.679 -13.481 5.168 1.00 3.06 C ATOM 2865 O SER A 200 26.359 -14.381 4.666 1.00 3.33 O ATOM 2866 CB SER A 200 26.812 -11.883 3.573 1.00 3.56 C ATOM 2867 OG SER A 200 26.897 -10.519 3.177 1.00 4.12 O ATOM 0 H SER A 200 25.847 -10.379 6.063 1.00 2.43 H new ATOM 0 HA SER A 200 24.904 -11.637 4.499 1.00 3.08 H new ATOM 0 HB2 SER A 200 27.804 -12.260 3.822 1.00 3.56 H new ATOM 0 HB3 SER A 200 26.440 -12.488 2.746 1.00 3.56 H new ATOM 0 HG SER A 200 26.200 -10.002 3.632 1.00 4.12 H new ATOM 2873 N ASP A 201 24.748 -13.679 6.104 1.00 2.98 N ATOM 2874 CA ASP A 201 24.329 -14.999 6.576 1.00 3.19 C ATOM 2875 C ASP A 201 25.358 -15.613 7.532 1.00 3.05 C ATOM 2876 O ASP A 201 25.083 -16.615 8.190 1.00 3.25 O ATOM 2877 CB ASP A 201 24.045 -15.923 5.389 1.00 3.87 C ATOM 2878 CG ASP A 201 23.470 -17.268 5.791 1.00 4.29 C ATOM 2879 OD1 ASP A 201 22.260 -17.335 6.103 1.00 4.89 O ATOM 2880 OD2 ASP A 201 24.213 -18.273 5.770 1.00 4.31 O ATOM 0 H ASP A 201 24.256 -12.912 6.563 1.00 2.98 H new ATOM 0 HA ASP A 201 23.406 -14.877 7.143 1.00 3.19 H new ATOM 0 HB2 ASP A 201 23.349 -15.428 4.712 1.00 3.87 H new ATOM 0 HB3 ASP A 201 24.970 -16.083 4.835 1.00 3.87 H new ATOM 2885 N GLN A 202 26.530 -14.997 7.625 1.00 3.02 N ATOM 2886 CA GLN A 202 27.552 -15.434 8.567 1.00 3.45 C ATOM 2887 C GLN A 202 27.614 -14.485 9.757 1.00 3.85 C ATOM 2888 O GLN A 202 26.758 -14.611 10.658 1.00 4.18 O ATOM 2889 CB GLN A 202 28.921 -15.511 7.887 1.00 3.65 C ATOM 2890 CG GLN A 202 29.034 -16.618 6.859 1.00 4.42 C ATOM 2891 CD GLN A 202 28.791 -17.989 7.457 1.00 5.07 C ATOM 2892 OE1 GLN A 202 27.663 -18.482 7.476 1.00 5.73 O ATOM 2893 NE2 GLN A 202 29.845 -18.615 7.951 1.00 5.30 N ATOM 2894 OXT GLN A 202 28.511 -13.616 9.785 1.00 4.27 O ATOM 0 H GLN A 202 26.796 -14.192 7.058 1.00 3.02 H new ATOM 0 HA GLN A 202 27.285 -16.430 8.920 1.00 3.45 H new ATOM 0 HB2 GLN A 202 29.130 -14.557 7.403 1.00 3.65 H new ATOM 0 HB3 GLN A 202 29.687 -15.657 8.649 1.00 3.65 H new ATOM 0 HG2 GLN A 202 28.316 -16.441 6.058 1.00 4.42 H new ATOM 0 HG3 GLN A 202 30.026 -16.592 6.408 1.00 4.42 H new ATOM 0 HE21 GLN A 202 30.763 -18.173 7.916 1.00 5.30 H new ATOM 0 HE22 GLN A 202 29.740 -19.540 8.367 1.00 5.30 H new TER 2903 GLN A 202