USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1215 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 111 THR OG1 : rot 66:sc= 0.53 USER MOD Set 1.2: A 124 SER OG : rot -166:sc= 0.416 USER MOD Set 2.1: A 99 ASN : amide:sc= 0.13 K(o=1,f=-1.8) USER MOD Set 2.2: A 101 TYR OH : rot 77:sc= 0.869 USER MOD Set 3.1: A 28 GLN : amide:sc= 0 X(o=-0.072,f=-0.072) USER MOD Set 3.2: A 34 CYS SG : rot -20:sc= -0.0716 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0115 X(o=-0.012,f=0) USER MOD Single : A 13 THR OG1 : rot -142:sc= 0.304 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0522 USER MOD Single : A 21 ASN : amide:sc= -0.749 K(o=-0.75,f=-5.6!) USER MOD Single : A 24 ASN : amide:sc= -0.281 K(o=-0.28,f=-1) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 172:sc= 0.854 (180deg=0.788) USER MOD Single : A 44 SER OG : rot 64:sc= -0.987 USER MOD Single : A 48 GLN : amide:sc=-0.00532 K(o=-0.0053,f=-0.51) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.165) USER MOD Single : A 64 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.038) USER MOD Single : A 67 HIS : no HD1:sc= -0.261 K(o=-0.26,f=-1.6) USER MOD Single : A 72 ASN : amide:sc= -0.304 K(o=-0.3,f=-3.9!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 165:sc= 1.03 (180deg=0.832) USER MOD Single : A 84 GLN : amide:sc= -4.28! C(o=-4.3!,f=-6!) USER MOD Single : A 89 TYR OH : rot -114:sc= 0.865 USER MOD Single : A 91 SER OG : rot 73:sc= 0.682 USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= 0.724 (180deg=0.275) USER MOD Single : A 97 ASN : amide:sc= -0.259 K(o=-0.26,f=-2.3!) USER MOD Single : A 100 ASN : amide:sc= -0.0233 X(o=-0.023,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 145:sc= 0.862 (180deg=-0.139) USER MOD Single : A 103 SER OG : rot 108:sc= 0.837 USER MOD Single : A 110 SER OG : rot -140:sc= 0 USER MOD Single : A 115 SER OG : rot 170:sc= 0.315 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.00496 USER MOD Single : A 123 GLN : amide:sc= 0.695 K(o=0.7,f=0) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 HIS : no HD1:sc= -0.0956 X(o=-0.096,f=0) USER MOD Single : A 130 THR OG1 : rot 78:sc= 0.976 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -27:sc= 0.665 USER MOD Single : A 142 TYR OH : rot -30:sc= -0.0357 USER MOD Single : A 143 CYS SG : rot 180:sc= 0 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 85:sc= 0.636 USER MOD Single : A 153 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0672) USER MOD ----------------------------------------------------------------- ATOM 25 N SER A 3 -14.249 -8.216 3.647 1.00 1.71 N ATOM 26 CA SER A 3 -14.704 -8.657 2.338 1.00 1.41 C ATOM 27 C SER A 3 -13.715 -8.120 1.311 1.00 1.12 C ATOM 28 O SER A 3 -13.018 -7.139 1.563 1.00 1.35 O ATOM 29 CB SER A 3 -16.130 -8.184 2.037 1.00 1.83 C ATOM 30 OG SER A 3 -16.751 -9.091 1.147 1.00 1.90 O ATOM 0 HA SER A 3 -14.739 -9.746 2.305 1.00 1.41 H new ATOM 0 HB2 SER A 3 -16.704 -8.115 2.961 1.00 1.83 H new ATOM 0 HB3 SER A 3 -16.109 -7.186 1.599 1.00 1.83 H new ATOM 0 HG SER A 3 -17.664 -8.789 0.956 1.00 1.90 H new ATOM 36 N TYR A 4 -13.625 -8.770 0.155 1.00 0.85 N ATOM 37 CA TYR A 4 -12.642 -8.404 -0.845 1.00 0.76 C ATOM 38 C TYR A 4 -13.356 -7.665 -1.961 1.00 0.74 C ATOM 39 O TYR A 4 -14.396 -8.124 -2.434 1.00 1.00 O ATOM 40 CB TYR A 4 -11.973 -9.661 -1.409 1.00 1.06 C ATOM 41 CG TYR A 4 -11.728 -10.766 -0.403 1.00 1.16 C ATOM 42 CD1 TYR A 4 -10.494 -10.863 0.262 1.00 1.91 C ATOM 43 CD2 TYR A 4 -12.739 -11.711 -0.144 1.00 2.76 C ATOM 44 CE1 TYR A 4 -10.270 -11.908 1.174 1.00 2.16 C ATOM 45 CE2 TYR A 4 -12.525 -12.744 0.778 1.00 2.92 C ATOM 46 CZ TYR A 4 -11.287 -12.853 1.442 1.00 1.79 C ATOM 47 OH TYR A 4 -11.071 -13.874 2.318 1.00 2.19 O ATOM 0 H TYR A 4 -14.224 -9.553 -0.108 1.00 0.85 H new ATOM 0 HA TYR A 4 -11.874 -7.772 -0.399 1.00 0.76 H new ATOM 0 HB2 TYR A 4 -12.595 -10.055 -2.213 1.00 1.06 H new ATOM 0 HB3 TYR A 4 -11.019 -9.377 -1.853 1.00 1.06 H new ATOM 0 HD1 TYR A 4 -9.719 -10.135 0.072 1.00 1.91 H new ATOM 0 HD2 TYR A 4 -13.685 -11.639 -0.659 1.00 2.76 H new ATOM 0 HE1 TYR A 4 -9.316 -11.990 1.673 1.00 2.16 H new ATOM 0 HE2 TYR A 4 -13.310 -13.458 0.980 1.00 2.92 H new ATOM 0 HH TYR A 4 -11.878 -14.427 2.382 1.00 2.19 H new ATOM 57 N HIS A 5 -12.788 -6.559 -2.430 1.00 0.66 N ATOM 58 CA HIS A 5 -13.358 -5.851 -3.562 1.00 0.67 C ATOM 59 C HIS A 5 -12.226 -5.328 -4.433 1.00 0.66 C ATOM 60 O HIS A 5 -11.341 -4.639 -3.940 1.00 0.87 O ATOM 61 CB HIS A 5 -14.271 -4.723 -3.060 1.00 0.75 C ATOM 62 CG HIS A 5 -15.379 -4.386 -4.025 1.00 0.84 C ATOM 63 ND1 HIS A 5 -16.708 -4.240 -3.693 1.00 1.16 N ATOM 64 CD2 HIS A 5 -15.274 -4.231 -5.381 1.00 0.74 C ATOM 65 CE1 HIS A 5 -17.385 -4.013 -4.830 1.00 1.19 C ATOM 66 NE2 HIS A 5 -16.556 -4.011 -5.889 1.00 0.92 N ATOM 0 H HIS A 5 -11.941 -6.139 -2.046 1.00 0.66 H new ATOM 0 HA HIS A 5 -13.972 -6.519 -4.166 1.00 0.67 H new ATOM 0 HB2 HIS A 5 -14.706 -5.014 -2.104 1.00 0.75 H new ATOM 0 HB3 HIS A 5 -13.671 -3.831 -2.879 1.00 0.75 H new ATOM 0 HD2 HIS A 5 -14.361 -4.272 -5.956 1.00 0.74 H new ATOM 0 HE1 HIS A 5 -18.452 -3.853 -4.887 1.00 1.19 H new ATOM 0 HE2 HIS A 5 -16.812 -3.876 -6.867 1.00 0.92 H new ATOM 74 N VAL A 6 -12.241 -5.636 -5.730 1.00 0.53 N ATOM 75 CA VAL A 6 -11.280 -5.065 -6.661 1.00 0.54 C ATOM 76 C VAL A 6 -11.962 -3.969 -7.463 1.00 0.52 C ATOM 77 O VAL A 6 -13.071 -4.183 -7.954 1.00 0.58 O ATOM 78 CB VAL A 6 -10.713 -6.135 -7.596 1.00 0.73 C ATOM 79 CG1 VAL A 6 -9.700 -5.494 -8.550 1.00 1.52 C ATOM 80 CG2 VAL A 6 -9.999 -7.231 -6.810 1.00 1.45 C ATOM 0 H VAL A 6 -12.910 -6.278 -6.155 1.00 0.53 H new ATOM 0 HA VAL A 6 -10.446 -4.646 -6.098 1.00 0.54 H new ATOM 0 HB VAL A 6 -11.545 -6.573 -8.148 1.00 0.73 H new ATOM 0 HG11 VAL A 6 -9.295 -6.256 -9.217 1.00 1.52 H new ATOM 0 HG12 VAL A 6 -10.194 -4.721 -9.139 1.00 1.52 H new ATOM 0 HG13 VAL A 6 -8.889 -5.048 -7.974 1.00 1.52 H new ATOM 0 HG21 VAL A 6 -9.607 -7.977 -7.501 1.00 1.45 H new ATOM 0 HG22 VAL A 6 -9.177 -6.795 -6.242 1.00 1.45 H new ATOM 0 HG23 VAL A 6 -10.702 -7.705 -6.125 1.00 1.45 H new ATOM 90 N VAL A 7 -11.298 -2.823 -7.635 1.00 0.51 N ATOM 91 CA VAL A 7 -11.842 -1.724 -8.421 1.00 0.56 C ATOM 92 C VAL A 7 -10.766 -1.267 -9.400 1.00 0.56 C ATOM 93 O VAL A 7 -9.617 -1.065 -9.023 1.00 0.63 O ATOM 94 CB VAL A 7 -12.309 -0.588 -7.492 1.00 0.66 C ATOM 95 CG1 VAL A 7 -12.989 0.528 -8.296 1.00 1.66 C ATOM 96 CG2 VAL A 7 -13.309 -1.107 -6.449 1.00 1.53 C ATOM 0 H VAL A 7 -10.378 -2.636 -7.236 1.00 0.51 H new ATOM 0 HA VAL A 7 -12.718 -2.043 -8.986 1.00 0.56 H new ATOM 0 HB VAL A 7 -11.423 -0.198 -6.991 1.00 0.66 H new ATOM 0 HG11 VAL A 7 -13.311 1.320 -7.619 1.00 1.66 H new ATOM 0 HG12 VAL A 7 -12.285 0.935 -9.022 1.00 1.66 H new ATOM 0 HG13 VAL A 7 -13.856 0.123 -8.819 1.00 1.66 H new ATOM 0 HG21 VAL A 7 -13.623 -0.285 -5.806 1.00 1.53 H new ATOM 0 HG22 VAL A 7 -14.179 -1.524 -6.955 1.00 1.53 H new ATOM 0 HG23 VAL A 7 -12.836 -1.881 -5.844 1.00 1.53 H new ATOM 106 N ARG A 8 -11.102 -1.098 -10.678 1.00 0.59 N ATOM 107 CA ARG A 8 -10.128 -0.581 -11.626 1.00 0.63 C ATOM 108 C ARG A 8 -10.224 0.929 -11.566 1.00 0.63 C ATOM 109 O ARG A 8 -11.165 1.506 -12.103 1.00 0.82 O ATOM 110 CB ARG A 8 -10.431 -1.060 -13.042 1.00 0.86 C ATOM 111 CG ARG A 8 -10.277 -2.575 -13.170 1.00 2.09 C ATOM 112 CD ARG A 8 -11.513 -3.164 -13.848 1.00 2.45 C ATOM 113 NE ARG A 8 -12.601 -3.379 -12.886 1.00 3.70 N ATOM 114 CZ ARG A 8 -13.744 -2.719 -12.709 1.00 4.28 C ATOM 115 NH1 ARG A 8 -14.632 -3.223 -11.856 1.00 5.70 N ATOM 116 NH2 ARG A 8 -13.988 -1.576 -13.351 1.00 4.11 N ATOM 0 H ARG A 8 -12.020 -1.307 -11.070 1.00 0.59 H new ATOM 0 HA ARG A 8 -9.128 -0.933 -11.372 1.00 0.63 H new ATOM 0 HB2 ARG A 8 -11.447 -0.773 -13.314 1.00 0.86 H new ATOM 0 HB3 ARG A 8 -9.761 -0.565 -13.745 1.00 0.86 H new ATOM 0 HG2 ARG A 8 -9.385 -2.812 -13.750 1.00 2.09 H new ATOM 0 HG3 ARG A 8 -10.144 -3.021 -12.184 1.00 2.09 H new ATOM 0 HD2 ARG A 8 -11.851 -2.493 -14.638 1.00 2.45 H new ATOM 0 HD3 ARG A 8 -11.253 -4.110 -14.323 1.00 2.45 H new ATOM 0 HE ARG A 8 -12.458 -4.162 -12.249 1.00 3.70 H new ATOM 0 HH11 ARG A 8 -14.427 -4.091 -11.360 1.00 5.70 H new ATOM 0 HH12 ARG A 8 -15.517 -2.742 -11.698 1.00 5.70 H new ATOM 0 HH21 ARG A 8 -13.293 -1.192 -13.991 1.00 4.11 H new ATOM 0 HH22 ARG A 8 -14.870 -1.085 -13.202 1.00 4.11 H new ATOM 130 N GLY A 9 -9.260 1.557 -10.907 1.00 0.57 N ATOM 131 CA GLY A 9 -9.169 2.996 -10.830 1.00 0.63 C ATOM 132 C GLY A 9 -7.707 3.356 -10.653 1.00 0.57 C ATOM 133 O GLY A 9 -6.828 2.638 -11.131 1.00 0.77 O ATOM 0 H GLY A 9 -8.515 1.071 -10.408 1.00 0.57 H new ATOM 0 HA2 GLY A 9 -9.569 3.454 -11.735 1.00 0.63 H new ATOM 0 HA3 GLY A 9 -9.760 3.373 -9.995 1.00 0.63 H new ATOM 137 N ASP A 10 -7.455 4.454 -9.955 1.00 0.56 N ATOM 138 CA ASP A 10 -6.130 5.001 -9.744 1.00 0.52 C ATOM 139 C ASP A 10 -6.051 5.475 -8.295 1.00 0.47 C ATOM 140 O ASP A 10 -7.078 5.683 -7.652 1.00 0.46 O ATOM 141 CB ASP A 10 -5.910 6.158 -10.728 1.00 0.61 C ATOM 142 CG ASP A 10 -4.428 6.450 -10.937 1.00 1.49 C ATOM 143 OD1 ASP A 10 -3.956 6.232 -12.073 1.00 2.16 O ATOM 144 OD2 ASP A 10 -3.799 6.893 -9.948 1.00 2.77 O ATOM 0 H ASP A 10 -8.191 5.002 -9.509 1.00 0.56 H new ATOM 0 HA ASP A 10 -5.352 4.258 -9.920 1.00 0.52 H new ATOM 0 HB2 ASP A 10 -6.371 5.914 -11.685 1.00 0.61 H new ATOM 0 HB3 ASP A 10 -6.408 7.053 -10.354 1.00 0.61 H new ATOM 149 N ILE A 11 -4.847 5.678 -7.774 1.00 0.48 N ATOM 150 CA ILE A 11 -4.610 6.234 -6.449 1.00 0.50 C ATOM 151 C ILE A 11 -5.213 7.637 -6.404 1.00 0.51 C ATOM 152 O ILE A 11 -5.864 8.010 -5.431 1.00 0.59 O ATOM 153 CB ILE A 11 -3.093 6.224 -6.182 1.00 0.57 C ATOM 154 CG1 ILE A 11 -2.506 4.803 -6.320 1.00 1.50 C ATOM 155 CG2 ILE A 11 -2.752 6.744 -4.781 1.00 1.61 C ATOM 156 CD1 ILE A 11 -1.028 4.859 -6.655 1.00 2.83 C ATOM 0 H ILE A 11 -3.987 5.454 -8.275 1.00 0.48 H new ATOM 0 HA ILE A 11 -5.085 5.645 -5.664 1.00 0.50 H new ATOM 0 HB ILE A 11 -2.654 6.884 -6.930 1.00 0.57 H new ATOM 0 HG12 ILE A 11 -2.652 4.253 -5.390 1.00 1.50 H new ATOM 0 HG13 ILE A 11 -3.039 4.259 -7.099 1.00 1.50 H new ATOM 0 HG21 ILE A 11 -1.672 6.719 -4.637 1.00 1.61 H new ATOM 0 HG22 ILE A 11 -3.109 7.769 -4.676 1.00 1.61 H new ATOM 0 HG23 ILE A 11 -3.233 6.114 -4.032 1.00 1.61 H new ATOM 0 HD11 ILE A 11 -0.637 3.846 -6.747 1.00 2.83 H new ATOM 0 HD12 ILE A 11 -0.888 5.389 -7.597 1.00 2.83 H new ATOM 0 HD13 ILE A 11 -0.495 5.383 -5.862 1.00 2.83 H new ATOM 168 N ALA A 12 -5.066 8.405 -7.485 1.00 0.52 N ATOM 169 CA ALA A 12 -5.617 9.751 -7.574 1.00 0.61 C ATOM 170 C ALA A 12 -7.139 9.735 -7.765 1.00 0.66 C ATOM 171 O ALA A 12 -7.727 10.799 -7.955 1.00 0.93 O ATOM 172 CB ALA A 12 -4.933 10.536 -8.704 1.00 0.71 C ATOM 0 H ALA A 12 -4.562 8.108 -8.320 1.00 0.52 H new ATOM 0 HA ALA A 12 -5.417 10.253 -6.627 1.00 0.61 H new ATOM 0 HB1 ALA A 12 -5.356 11.539 -8.758 1.00 0.71 H new ATOM 0 HB2 ALA A 12 -3.863 10.603 -8.505 1.00 0.71 H new ATOM 0 HB3 ALA A 12 -5.094 10.023 -9.652 1.00 0.71 H new ATOM 178 N THR A 13 -7.788 8.569 -7.732 1.00 0.51 N ATOM 179 CA THR A 13 -9.239 8.457 -7.727 1.00 0.53 C ATOM 180 C THR A 13 -9.709 7.508 -6.622 1.00 0.52 C ATOM 181 O THR A 13 -10.898 7.194 -6.573 1.00 0.55 O ATOM 182 CB THR A 13 -9.755 7.997 -9.102 1.00 0.56 C ATOM 183 OG1 THR A 13 -9.487 6.628 -9.319 1.00 0.69 O ATOM 184 CG2 THR A 13 -9.145 8.800 -10.254 1.00 0.71 C ATOM 0 H THR A 13 -7.310 7.668 -7.708 1.00 0.51 H new ATOM 0 HA THR A 13 -9.655 9.444 -7.522 1.00 0.53 H new ATOM 0 HB THR A 13 -10.831 8.168 -9.087 1.00 0.56 H new ATOM 0 HG1 THR A 13 -9.241 6.487 -10.257 1.00 0.69 H new ATOM 0 HG21 THR A 13 -9.542 8.436 -11.202 1.00 0.71 H new ATOM 0 HG22 THR A 13 -9.397 9.854 -10.136 1.00 0.71 H new ATOM 0 HG23 THR A 13 -8.061 8.683 -10.246 1.00 0.71 H new ATOM 192 N ALA A 14 -8.817 7.039 -5.742 1.00 0.50 N ATOM 193 CA ALA A 14 -9.117 6.051 -4.716 1.00 0.48 C ATOM 194 C ALA A 14 -9.681 6.773 -3.499 1.00 0.49 C ATOM 195 O ALA A 14 -9.127 6.749 -2.410 1.00 0.52 O ATOM 196 CB ALA A 14 -7.848 5.263 -4.375 1.00 0.48 C ATOM 0 H ALA A 14 -7.845 7.348 -5.729 1.00 0.50 H new ATOM 0 HA ALA A 14 -9.860 5.337 -5.070 1.00 0.48 H new ATOM 0 HB1 ALA A 14 -8.074 4.524 -3.607 1.00 0.48 H new ATOM 0 HB2 ALA A 14 -7.483 4.757 -5.269 1.00 0.48 H new ATOM 0 HB3 ALA A 14 -7.083 5.947 -4.007 1.00 0.48 H new ATOM 202 N THR A 15 -10.808 7.441 -3.688 1.00 0.51 N ATOM 203 CA THR A 15 -11.421 8.347 -2.730 1.00 0.58 C ATOM 204 C THR A 15 -12.192 7.610 -1.618 1.00 0.60 C ATOM 205 O THR A 15 -13.183 8.122 -1.102 1.00 0.65 O ATOM 206 CB THR A 15 -12.307 9.318 -3.526 1.00 0.67 C ATOM 207 OG1 THR A 15 -13.127 8.623 -4.449 1.00 1.17 O ATOM 208 CG2 THR A 15 -11.439 10.306 -4.312 1.00 0.88 C ATOM 0 H THR A 15 -11.344 7.363 -4.552 1.00 0.51 H new ATOM 0 HA THR A 15 -10.649 8.900 -2.194 1.00 0.58 H new ATOM 0 HB THR A 15 -12.933 9.848 -2.808 1.00 0.67 H new ATOM 0 HG1 THR A 15 -13.682 9.264 -4.941 1.00 1.17 H new ATOM 0 HG21 THR A 15 -12.079 10.988 -4.871 1.00 0.88 H new ATOM 0 HG22 THR A 15 -10.819 10.876 -3.620 1.00 0.88 H new ATOM 0 HG23 THR A 15 -10.800 9.758 -5.005 1.00 0.88 H new ATOM 216 N GLU A 16 -11.698 6.452 -1.169 1.00 0.60 N ATOM 217 CA GLU A 16 -12.318 5.547 -0.190 1.00 0.62 C ATOM 218 C GLU A 16 -12.126 6.031 1.248 1.00 0.64 C ATOM 219 O GLU A 16 -11.968 5.245 2.176 1.00 0.66 O ATOM 220 CB GLU A 16 -11.692 4.150 -0.375 1.00 0.62 C ATOM 221 CG GLU A 16 -12.732 3.043 -0.624 1.00 0.77 C ATOM 222 CD GLU A 16 -13.060 2.247 0.645 1.00 3.03 C ATOM 223 OE1 GLU A 16 -14.130 2.498 1.242 1.00 4.32 O ATOM 224 OE2 GLU A 16 -12.247 1.366 1.000 1.00 4.27 O ATOM 0 H GLU A 16 -10.800 6.098 -1.498 1.00 0.60 H new ATOM 0 HA GLU A 16 -13.394 5.518 -0.364 1.00 0.62 H new ATOM 0 HB2 GLU A 16 -10.996 4.180 -1.213 1.00 0.62 H new ATOM 0 HB3 GLU A 16 -11.111 3.900 0.513 1.00 0.62 H new ATOM 0 HG2 GLU A 16 -13.646 3.490 -1.015 1.00 0.77 H new ATOM 0 HG3 GLU A 16 -12.357 2.363 -1.389 1.00 0.77 H new ATOM 231 N GLY A 17 -12.050 7.341 1.459 1.00 0.69 N ATOM 232 CA GLY A 17 -11.690 7.877 2.756 1.00 0.71 C ATOM 233 C GLY A 17 -10.176 7.886 2.931 1.00 0.71 C ATOM 234 O GLY A 17 -9.639 8.877 3.423 1.00 0.79 O ATOM 0 H GLY A 17 -12.234 8.046 0.746 1.00 0.69 H new ATOM 0 HA2 GLY A 17 -12.079 8.890 2.858 1.00 0.71 H new ATOM 0 HA3 GLY A 17 -12.149 7.279 3.543 1.00 0.71 H new ATOM 238 N VAL A 18 -9.502 6.802 2.540 1.00 0.66 N ATOM 239 CA VAL A 18 -8.125 6.524 2.897 1.00 0.65 C ATOM 240 C VAL A 18 -7.450 5.935 1.667 1.00 0.60 C ATOM 241 O VAL A 18 -8.076 5.202 0.904 1.00 0.66 O ATOM 242 CB VAL A 18 -8.095 5.518 4.058 1.00 0.76 C ATOM 243 CG1 VAL A 18 -6.668 5.267 4.562 1.00 0.77 C ATOM 244 CG2 VAL A 18 -8.945 5.974 5.244 1.00 1.24 C ATOM 0 H VAL A 18 -9.917 6.080 1.951 1.00 0.66 H new ATOM 0 HA VAL A 18 -7.607 7.429 3.215 1.00 0.65 H new ATOM 0 HB VAL A 18 -8.509 4.596 3.651 1.00 0.76 H new ATOM 0 HG11 VAL A 18 -6.693 4.550 5.383 1.00 0.77 H new ATOM 0 HG12 VAL A 18 -6.060 4.868 3.750 1.00 0.77 H new ATOM 0 HG13 VAL A 18 -6.236 6.204 4.912 1.00 0.77 H new ATOM 0 HG21 VAL A 18 -8.891 5.229 6.038 1.00 1.24 H new ATOM 0 HG22 VAL A 18 -8.570 6.928 5.615 1.00 1.24 H new ATOM 0 HG23 VAL A 18 -9.981 6.090 4.926 1.00 1.24 H new ATOM 254 N ILE A 19 -6.173 6.263 1.494 1.00 0.56 N ATOM 255 CA ILE A 19 -5.322 5.847 0.399 1.00 0.58 C ATOM 256 C ILE A 19 -3.979 5.524 1.036 1.00 0.56 C ATOM 257 O ILE A 19 -3.572 6.230 1.956 1.00 0.56 O ATOM 258 CB ILE A 19 -5.176 7.015 -0.594 1.00 0.62 C ATOM 259 CG1 ILE A 19 -6.527 7.367 -1.231 1.00 0.67 C ATOM 260 CG2 ILE A 19 -4.172 6.684 -1.708 1.00 0.78 C ATOM 261 CD1 ILE A 19 -6.499 8.662 -2.053 1.00 1.29 C ATOM 0 H ILE A 19 -5.682 6.862 2.157 1.00 0.56 H new ATOM 0 HA ILE A 19 -5.722 4.992 -0.145 1.00 0.58 H new ATOM 0 HB ILE A 19 -4.807 7.869 -0.026 1.00 0.62 H new ATOM 0 HG12 ILE A 19 -6.841 6.545 -1.874 1.00 0.67 H new ATOM 0 HG13 ILE A 19 -7.276 7.461 -0.445 1.00 0.67 H new ATOM 0 HG21 ILE A 19 -4.094 7.530 -2.391 1.00 0.78 H new ATOM 0 HG22 ILE A 19 -3.195 6.481 -1.269 1.00 0.78 H new ATOM 0 HG23 ILE A 19 -4.513 5.806 -2.256 1.00 0.78 H new ATOM 0 HD11 ILE A 19 -7.488 8.848 -2.473 1.00 1.29 H new ATOM 0 HD12 ILE A 19 -6.216 9.495 -1.410 1.00 1.29 H new ATOM 0 HD13 ILE A 19 -5.774 8.564 -2.861 1.00 1.29 H new ATOM 273 N ILE A 20 -3.268 4.510 0.548 1.00 0.59 N ATOM 274 CA ILE A 20 -1.928 4.198 1.011 1.00 0.61 C ATOM 275 C ILE A 20 -1.050 4.199 -0.229 1.00 0.61 C ATOM 276 O ILE A 20 -1.458 3.688 -1.272 1.00 0.66 O ATOM 277 CB ILE A 20 -1.885 2.841 1.741 1.00 0.64 C ATOM 278 CG1 ILE A 20 -2.937 2.699 2.857 1.00 0.68 C ATOM 279 CG2 ILE A 20 -0.512 2.609 2.373 1.00 0.75 C ATOM 280 CD1 ILE A 20 -4.323 2.396 2.307 1.00 0.69 C ATOM 0 H ILE A 20 -3.610 3.884 -0.181 1.00 0.59 H new ATOM 0 HA ILE A 20 -1.579 4.930 1.739 1.00 0.61 H new ATOM 0 HB ILE A 20 -2.102 2.102 0.970 1.00 0.64 H new ATOM 0 HG12 ILE A 20 -2.636 1.903 3.538 1.00 0.68 H new ATOM 0 HG13 ILE A 20 -2.973 3.620 3.439 1.00 0.68 H new ATOM 0 HG21 ILE A 20 -0.504 1.646 2.883 1.00 0.75 H new ATOM 0 HG22 ILE A 20 0.252 2.614 1.596 1.00 0.75 H new ATOM 0 HG23 ILE A 20 -0.304 3.402 3.092 1.00 0.75 H new ATOM 0 HD11 ILE A 20 -5.030 2.305 3.132 1.00 0.69 H new ATOM 0 HD12 ILE A 20 -4.637 3.205 1.647 1.00 0.69 H new ATOM 0 HD13 ILE A 20 -4.296 1.461 1.747 1.00 0.69 H new ATOM 292 N ASN A 21 0.143 4.779 -0.127 1.00 0.60 N ATOM 293 CA ASN A 21 1.113 4.787 -1.207 1.00 0.63 C ATOM 294 C ASN A 21 2.464 4.382 -0.627 1.00 0.62 C ATOM 295 O ASN A 21 2.673 4.482 0.587 1.00 0.56 O ATOM 296 CB ASN A 21 1.161 6.178 -1.861 1.00 0.69 C ATOM 297 CG ASN A 21 1.584 6.104 -3.324 1.00 1.19 C ATOM 298 OD1 ASN A 21 2.172 5.127 -3.769 1.00 2.06 O ATOM 299 ND2 ASN A 21 1.267 7.126 -4.109 1.00 1.81 N ATOM 0 H ASN A 21 0.461 5.259 0.715 1.00 0.60 H new ATOM 0 HA ASN A 21 0.835 4.079 -1.988 1.00 0.63 H new ATOM 0 HB2 ASN A 21 0.179 6.647 -1.790 1.00 0.69 H new ATOM 0 HB3 ASN A 21 1.858 6.813 -1.313 1.00 0.69 H new ATOM 0 HD21 ASN A 21 1.513 7.105 -5.099 1.00 1.81 H new ATOM 0 HD22 ASN A 21 0.777 7.933 -3.723 1.00 1.81 H new ATOM 306 N ALA A 22 3.385 3.928 -1.477 1.00 0.77 N ATOM 307 CA ALA A 22 4.752 3.743 -1.033 1.00 0.86 C ATOM 308 C ALA A 22 5.340 5.106 -0.670 1.00 1.01 C ATOM 309 O ALA A 22 4.838 6.157 -1.065 1.00 1.97 O ATOM 310 CB ALA A 22 5.589 3.015 -2.093 1.00 1.24 C ATOM 0 H ALA A 22 3.209 3.689 -2.453 1.00 0.77 H new ATOM 0 HA ALA A 22 4.767 3.108 -0.147 1.00 0.86 H new ATOM 0 HB1 ALA A 22 6.609 2.892 -1.729 1.00 1.24 H new ATOM 0 HB2 ALA A 22 5.154 2.036 -2.291 1.00 1.24 H new ATOM 0 HB3 ALA A 22 5.600 3.600 -3.013 1.00 1.24 H new ATOM 316 N ALA A 23 6.405 5.064 0.113 1.00 0.57 N ATOM 317 CA ALA A 23 7.053 6.234 0.689 1.00 0.73 C ATOM 318 C ALA A 23 8.530 5.945 0.937 1.00 0.70 C ATOM 319 O ALA A 23 9.415 6.744 0.648 1.00 0.92 O ATOM 320 CB ALA A 23 6.336 6.588 1.991 1.00 0.97 C ATOM 0 H ALA A 23 6.858 4.188 0.374 1.00 0.57 H new ATOM 0 HA ALA A 23 6.993 7.078 0.002 1.00 0.73 H new ATOM 0 HB1 ALA A 23 6.807 7.463 2.439 1.00 0.97 H new ATOM 0 HB2 ALA A 23 5.289 6.806 1.782 1.00 0.97 H new ATOM 0 HB3 ALA A 23 6.400 5.747 2.682 1.00 0.97 H new ATOM 326 N ASN A 24 8.821 4.766 1.474 1.00 0.56 N ATOM 327 CA ASN A 24 10.176 4.337 1.768 1.00 0.61 C ATOM 328 C ASN A 24 10.800 5.267 2.810 1.00 0.62 C ATOM 329 O ASN A 24 10.148 6.163 3.343 1.00 0.74 O ATOM 330 CB ASN A 24 11.026 4.229 0.487 1.00 0.85 C ATOM 331 CG ASN A 24 10.218 3.865 -0.763 1.00 1.43 C ATOM 332 OD1 ASN A 24 9.270 3.089 -0.713 1.00 1.72 O ATOM 333 ND2 ASN A 24 10.541 4.472 -1.897 1.00 2.11 N ATOM 0 H ASN A 24 8.111 4.075 1.719 1.00 0.56 H new ATOM 0 HA ASN A 24 10.145 3.334 2.193 1.00 0.61 H new ATOM 0 HB2 ASN A 24 11.532 5.179 0.317 1.00 0.85 H new ATOM 0 HB3 ASN A 24 11.801 3.478 0.639 1.00 0.85 H new ATOM 0 HD21 ASN A 24 9.998 4.296 -2.742 1.00 2.11 H new ATOM 0 HD22 ASN A 24 11.332 5.115 -1.924 1.00 2.11 H new ATOM 340 N SER A 25 12.092 5.095 3.078 1.00 0.70 N ATOM 341 CA SER A 25 12.811 5.977 3.992 1.00 0.84 C ATOM 342 C SER A 25 12.711 7.447 3.552 1.00 1.17 C ATOM 343 O SER A 25 12.748 8.361 4.370 1.00 1.53 O ATOM 344 CB SER A 25 14.261 5.490 4.108 1.00 0.97 C ATOM 345 OG SER A 25 14.929 6.099 5.190 1.00 2.25 O ATOM 0 H SER A 25 12.663 4.352 2.675 1.00 0.70 H new ATOM 0 HA SER A 25 12.353 5.937 4.980 1.00 0.84 H new ATOM 0 HB2 SER A 25 14.273 4.408 4.236 1.00 0.97 H new ATOM 0 HB3 SER A 25 14.793 5.708 3.182 1.00 0.97 H new ATOM 0 HG SER A 25 15.849 5.765 5.236 1.00 2.25 H new ATOM 351 N LYS A 26 12.565 7.679 2.244 1.00 1.26 N ATOM 352 CA LYS A 26 12.568 9.002 1.632 1.00 1.62 C ATOM 353 C LYS A 26 11.204 9.696 1.691 1.00 1.58 C ATOM 354 O LYS A 26 11.090 10.827 1.233 1.00 1.81 O ATOM 355 CB LYS A 26 13.001 8.880 0.165 1.00 1.81 C ATOM 356 CG LYS A 26 14.373 8.208 0.015 1.00 2.01 C ATOM 357 CD LYS A 26 14.793 8.169 -1.461 1.00 2.53 C ATOM 358 CE LYS A 26 15.279 6.765 -1.837 1.00 2.44 C ATOM 359 NZ LYS A 26 15.553 6.650 -3.286 1.00 3.05 N ATOM 0 H LYS A 26 12.438 6.927 1.566 1.00 1.26 H new ATOM 0 HA LYS A 26 13.267 9.614 2.202 1.00 1.62 H new ATOM 0 HB2 LYS A 26 12.256 8.305 -0.385 1.00 1.81 H new ATOM 0 HB3 LYS A 26 13.034 9.872 -0.285 1.00 1.81 H new ATOM 0 HG2 LYS A 26 15.117 8.752 0.597 1.00 2.01 H new ATOM 0 HG3 LYS A 26 14.334 7.195 0.415 1.00 2.01 H new ATOM 0 HD2 LYS A 26 13.952 8.452 -2.093 1.00 2.53 H new ATOM 0 HD3 LYS A 26 15.585 8.896 -1.640 1.00 2.53 H new ATOM 0 HE2 LYS A 26 16.184 6.531 -1.276 1.00 2.44 H new ATOM 0 HE3 LYS A 26 14.527 6.030 -1.550 1.00 2.44 H new ATOM 0 HZ1 LYS A 26 15.880 5.687 -3.502 1.00 3.05 H new ATOM 0 HZ2 LYS A 26 14.683 6.849 -3.821 1.00 3.05 H new ATOM 0 HZ3 LYS A 26 16.289 7.334 -3.555 1.00 3.05 H new ATOM 373 N GLY A 27 10.150 9.020 2.144 1.00 1.35 N ATOM 374 CA GLY A 27 8.817 9.602 2.143 1.00 1.39 C ATOM 375 C GLY A 27 8.222 9.760 0.739 1.00 1.35 C ATOM 376 O GLY A 27 7.175 10.391 0.601 1.00 1.52 O ATOM 0 H GLY A 27 10.197 8.071 2.515 1.00 1.35 H new ATOM 0 HA2 GLY A 27 8.155 8.976 2.742 1.00 1.39 H new ATOM 0 HA3 GLY A 27 8.855 10.579 2.625 1.00 1.39 H new ATOM 380 N GLN A 28 8.849 9.196 -0.298 1.00 1.26 N ATOM 381 CA GLN A 28 8.408 9.275 -1.674 1.00 1.26 C ATOM 382 C GLN A 28 8.277 7.856 -2.240 1.00 1.10 C ATOM 383 O GLN A 28 9.232 7.081 -2.174 1.00 1.26 O ATOM 384 CB GLN A 28 9.437 10.072 -2.485 1.00 1.59 C ATOM 385 CG GLN A 28 8.984 10.129 -3.945 1.00 1.36 C ATOM 386 CD GLN A 28 9.992 10.803 -4.865 1.00 1.62 C ATOM 387 OE1 GLN A 28 10.484 11.890 -4.597 1.00 2.48 O ATOM 388 NE2 GLN A 28 10.309 10.155 -5.980 1.00 1.82 N ATOM 0 H GLN A 28 9.707 8.655 -0.187 1.00 1.26 H new ATOM 0 HA GLN A 28 7.441 9.775 -1.731 1.00 1.26 H new ATOM 0 HB2 GLN A 28 9.535 11.080 -2.082 1.00 1.59 H new ATOM 0 HB3 GLN A 28 10.418 9.603 -2.413 1.00 1.59 H new ATOM 0 HG2 GLN A 28 8.800 9.115 -4.300 1.00 1.36 H new ATOM 0 HG3 GLN A 28 8.036 10.664 -4.003 1.00 1.36 H new ATOM 0 HE21 GLN A 28 9.885 9.249 -6.182 1.00 1.82 H new ATOM 0 HE22 GLN A 28 10.976 10.563 -6.635 1.00 1.82 H new ATOM 397 N PRO A 29 7.135 7.522 -2.856 1.00 0.97 N ATOM 398 CA PRO A 29 6.937 6.241 -3.505 1.00 1.07 C ATOM 399 C PRO A 29 7.934 6.026 -4.637 1.00 1.35 C ATOM 400 O PRO A 29 8.463 6.970 -5.225 1.00 1.86 O ATOM 401 CB PRO A 29 5.498 6.227 -4.040 1.00 1.10 C ATOM 402 CG PRO A 29 4.980 7.649 -3.868 1.00 1.02 C ATOM 403 CD PRO A 29 5.951 8.349 -2.924 1.00 0.98 C ATOM 0 HA PRO A 29 7.099 5.431 -2.794 1.00 1.07 H new ATOM 0 HB2 PRO A 29 5.473 5.925 -5.087 1.00 1.10 H new ATOM 0 HB3 PRO A 29 4.882 5.517 -3.488 1.00 1.10 H new ATOM 0 HG2 PRO A 29 4.932 8.164 -4.828 1.00 1.02 H new ATOM 0 HG3 PRO A 29 3.971 7.648 -3.456 1.00 1.02 H new ATOM 0 HD2 PRO A 29 6.196 9.346 -3.291 1.00 0.98 H new ATOM 0 HD3 PRO A 29 5.508 8.473 -1.936 1.00 0.98 H new ATOM 411 N GLY A 30 8.141 4.754 -4.973 1.00 1.14 N ATOM 412 CA GLY A 30 8.867 4.390 -6.183 1.00 1.30 C ATOM 413 C GLY A 30 8.349 5.168 -7.400 1.00 1.98 C ATOM 414 O GLY A 30 7.161 5.490 -7.491 1.00 2.72 O ATOM 0 H GLY A 30 7.815 3.960 -4.422 1.00 1.14 H new ATOM 0 HA2 GLY A 30 9.930 4.590 -6.046 1.00 1.30 H new ATOM 0 HA3 GLY A 30 8.765 3.320 -6.363 1.00 1.30 H new ATOM 418 N GLY A 31 9.258 5.490 -8.326 1.00 2.17 N ATOM 419 CA GLY A 31 8.934 6.260 -9.516 1.00 2.90 C ATOM 420 C GLY A 31 7.816 5.581 -10.298 1.00 1.64 C ATOM 421 O GLY A 31 7.816 4.364 -10.459 1.00 2.14 O ATOM 0 H GLY A 31 10.240 5.220 -8.265 1.00 2.17 H new ATOM 0 HA2 GLY A 31 8.629 7.268 -9.233 1.00 2.90 H new ATOM 0 HA3 GLY A 31 9.819 6.359 -10.145 1.00 2.90 H new ATOM 425 N GLY A 32 6.849 6.371 -10.761 1.00 1.45 N ATOM 426 CA GLY A 32 5.618 5.864 -11.330 1.00 1.49 C ATOM 427 C GLY A 32 4.487 6.646 -10.691 1.00 1.32 C ATOM 428 O GLY A 32 4.296 7.818 -11.000 1.00 1.35 O ATOM 0 H GLY A 32 6.906 7.389 -10.748 1.00 1.45 H new ATOM 0 HA2 GLY A 32 5.612 5.990 -12.413 1.00 1.49 H new ATOM 0 HA3 GLY A 32 5.511 4.797 -11.132 1.00 1.49 H new ATOM 432 N VAL A 33 3.767 6.032 -9.754 1.00 1.24 N ATOM 433 CA VAL A 33 2.599 6.661 -9.154 1.00 1.11 C ATOM 434 C VAL A 33 2.923 7.847 -8.251 1.00 1.17 C ATOM 435 O VAL A 33 2.016 8.624 -7.954 1.00 1.18 O ATOM 436 CB VAL A 33 1.741 5.631 -8.423 1.00 1.12 C ATOM 437 CG1 VAL A 33 1.208 4.598 -9.424 1.00 2.00 C ATOM 438 CG2 VAL A 33 2.485 4.927 -7.282 1.00 1.92 C ATOM 0 H VAL A 33 3.974 5.100 -9.396 1.00 1.24 H new ATOM 0 HA VAL A 33 2.028 7.076 -9.985 1.00 1.11 H new ATOM 0 HB VAL A 33 0.913 6.173 -7.965 1.00 1.12 H new ATOM 0 HG11 VAL A 33 0.596 3.865 -8.899 1.00 2.00 H new ATOM 0 HG12 VAL A 33 0.604 5.101 -10.179 1.00 2.00 H new ATOM 0 HG13 VAL A 33 2.045 4.093 -9.907 1.00 2.00 H new ATOM 0 HG21 VAL A 33 1.820 4.208 -6.803 1.00 1.92 H new ATOM 0 HG22 VAL A 33 3.355 4.406 -7.682 1.00 1.92 H new ATOM 0 HG23 VAL A 33 2.809 5.665 -6.549 1.00 1.92 H new ATOM 448 N CYS A 34 4.192 8.049 -7.873 1.00 1.28 N ATOM 449 CA CYS A 34 4.633 9.335 -7.358 1.00 1.38 C ATOM 450 C CYS A 34 4.088 10.456 -8.244 1.00 1.33 C ATOM 451 O CYS A 34 3.487 11.398 -7.749 1.00 1.35 O ATOM 452 CB CYS A 34 6.164 9.346 -7.274 1.00 1.54 C ATOM 453 SG CYS A 34 6.721 10.915 -6.560 1.00 1.97 S ATOM 0 H CYS A 34 4.922 7.338 -7.917 1.00 1.28 H new ATOM 0 HA CYS A 34 4.245 9.500 -6.353 1.00 1.38 H new ATOM 0 HB2 CYS A 34 6.511 8.513 -6.663 1.00 1.54 H new ATOM 0 HB3 CYS A 34 6.594 9.213 -8.267 1.00 1.54 H new ATOM 0 HG CYS A 34 5.780 11.804 -6.678 1.00 1.97 H new ATOM 459 N GLY A 35 4.220 10.339 -9.565 1.00 1.33 N ATOM 460 CA GLY A 35 3.757 11.367 -10.482 1.00 1.32 C ATOM 461 C GLY A 35 2.244 11.579 -10.412 1.00 1.28 C ATOM 462 O GLY A 35 1.779 12.708 -10.536 1.00 1.30 O ATOM 0 H GLY A 35 4.648 9.534 -10.022 1.00 1.33 H new ATOM 0 HA2 GLY A 35 4.263 12.306 -10.255 1.00 1.32 H new ATOM 0 HA3 GLY A 35 4.035 11.093 -11.500 1.00 1.32 H new ATOM 466 N ALA A 36 1.457 10.516 -10.238 1.00 1.29 N ATOM 467 CA ALA A 36 0.005 10.622 -10.294 1.00 1.28 C ATOM 468 C ALA A 36 -0.497 11.340 -9.052 1.00 1.12 C ATOM 469 O ALA A 36 -1.175 12.366 -9.140 1.00 1.11 O ATOM 470 CB ALA A 36 -0.622 9.228 -10.412 1.00 1.38 C ATOM 0 H ALA A 36 1.804 9.574 -10.057 1.00 1.29 H new ATOM 0 HA ALA A 36 -0.286 11.197 -11.173 1.00 1.28 H new ATOM 0 HB1 ALA A 36 -1.707 9.320 -10.453 1.00 1.38 H new ATOM 0 HB2 ALA A 36 -0.264 8.744 -11.321 1.00 1.38 H new ATOM 0 HB3 ALA A 36 -0.341 8.628 -9.546 1.00 1.38 H new ATOM 476 N LEU A 37 -0.151 10.807 -7.883 1.00 1.05 N ATOM 477 CA LEU A 37 -0.592 11.396 -6.636 1.00 0.89 C ATOM 478 C LEU A 37 0.044 12.769 -6.444 1.00 1.08 C ATOM 479 O LEU A 37 -0.535 13.609 -5.782 1.00 1.25 O ATOM 480 CB LEU A 37 -0.314 10.428 -5.477 1.00 0.91 C ATOM 481 CG LEU A 37 -0.863 10.921 -4.123 1.00 0.75 C ATOM 482 CD1 LEU A 37 -2.390 10.814 -4.111 1.00 0.79 C ATOM 483 CD2 LEU A 37 -0.355 10.030 -2.987 1.00 0.87 C ATOM 0 H LEU A 37 0.429 9.974 -7.780 1.00 1.05 H new ATOM 0 HA LEU A 37 -1.669 11.560 -6.659 1.00 0.89 H new ATOM 0 HB2 LEU A 37 -0.756 9.459 -5.709 1.00 0.91 H new ATOM 0 HB3 LEU A 37 0.762 10.275 -5.391 1.00 0.91 H new ATOM 0 HG LEU A 37 -0.535 11.951 -3.987 1.00 0.75 H new ATOM 0 HD11 LEU A 37 -2.772 11.164 -3.152 1.00 0.79 H new ATOM 0 HD12 LEU A 37 -2.804 11.427 -4.912 1.00 0.79 H new ATOM 0 HD13 LEU A 37 -2.683 9.775 -4.261 1.00 0.79 H new ATOM 0 HD21 LEU A 37 -0.751 10.390 -2.037 1.00 0.87 H new ATOM 0 HD22 LEU A 37 -0.686 9.005 -3.153 1.00 0.87 H new ATOM 0 HD23 LEU A 37 0.734 10.060 -2.961 1.00 0.87 H new ATOM 495 N TYR A 38 1.187 13.054 -7.062 1.00 1.14 N ATOM 496 CA TYR A 38 1.761 14.390 -7.069 1.00 1.31 C ATOM 497 C TYR A 38 0.942 15.322 -7.947 1.00 1.34 C ATOM 498 O TYR A 38 0.769 16.489 -7.616 1.00 1.45 O ATOM 499 CB TYR A 38 3.184 14.283 -7.604 1.00 1.45 C ATOM 500 CG TYR A 38 3.900 15.572 -7.946 1.00 1.64 C ATOM 501 CD1 TYR A 38 4.677 16.235 -6.979 1.00 2.41 C ATOM 502 CD2 TYR A 38 3.854 16.055 -9.268 1.00 2.27 C ATOM 503 CE1 TYR A 38 5.422 17.374 -7.335 1.00 2.70 C ATOM 504 CE2 TYR A 38 4.592 17.193 -9.630 1.00 2.66 C ATOM 505 CZ TYR A 38 5.387 17.853 -8.666 1.00 2.45 C ATOM 506 OH TYR A 38 6.127 18.934 -9.040 1.00 2.95 O ATOM 0 H TYR A 38 1.739 12.363 -7.571 1.00 1.14 H new ATOM 0 HA TYR A 38 1.761 14.801 -6.059 1.00 1.31 H new ATOM 0 HB2 TYR A 38 3.783 13.752 -6.864 1.00 1.45 H new ATOM 0 HB3 TYR A 38 3.161 13.663 -8.500 1.00 1.45 H new ATOM 0 HD1 TYR A 38 4.702 15.870 -5.963 1.00 2.41 H new ATOM 0 HD2 TYR A 38 3.249 15.548 -10.006 1.00 2.27 H new ATOM 0 HE1 TYR A 38 6.020 17.882 -6.593 1.00 2.70 H new ATOM 0 HE2 TYR A 38 4.552 17.564 -10.644 1.00 2.66 H new ATOM 0 HH TYR A 38 5.979 19.119 -9.991 1.00 2.95 H new ATOM 516 N LYS A 39 0.455 14.848 -9.093 1.00 1.29 N ATOM 517 CA LYS A 39 -0.203 15.735 -10.035 1.00 1.35 C ATOM 518 C LYS A 39 -1.558 16.135 -9.466 1.00 1.35 C ATOM 519 O LYS A 39 -2.037 17.240 -9.701 1.00 1.49 O ATOM 520 CB LYS A 39 -0.322 15.031 -11.391 1.00 1.31 C ATOM 521 CG LYS A 39 -0.780 16.021 -12.462 1.00 1.45 C ATOM 522 CD LYS A 39 -1.077 15.315 -13.785 1.00 1.44 C ATOM 523 CE LYS A 39 -1.716 16.328 -14.739 1.00 1.73 C ATOM 524 NZ LYS A 39 -2.236 15.685 -15.965 1.00 2.32 N ATOM 0 H LYS A 39 0.505 13.871 -9.383 1.00 1.29 H new ATOM 0 HA LYS A 39 0.376 16.645 -10.190 1.00 1.35 H new ATOM 0 HB2 LYS A 39 0.639 14.600 -11.671 1.00 1.31 H new ATOM 0 HB3 LYS A 39 -1.032 14.207 -11.320 1.00 1.31 H new ATOM 0 HG2 LYS A 39 -1.673 16.544 -12.118 1.00 1.45 H new ATOM 0 HG3 LYS A 39 -0.008 16.775 -12.616 1.00 1.45 H new ATOM 0 HD2 LYS A 39 -0.159 14.915 -14.216 1.00 1.44 H new ATOM 0 HD3 LYS A 39 -1.748 14.471 -13.623 1.00 1.44 H new ATOM 0 HE2 LYS A 39 -2.529 16.844 -14.228 1.00 1.73 H new ATOM 0 HE3 LYS A 39 -0.979 17.084 -15.011 1.00 1.73 H new ATOM 0 HZ1 LYS A 39 -2.660 16.407 -16.582 1.00 2.32 H new ATOM 0 HZ2 LYS A 39 -1.457 15.214 -16.467 1.00 2.32 H new ATOM 0 HZ3 LYS A 39 -2.958 14.982 -15.709 1.00 2.32 H new ATOM 538 N LYS A 40 -2.199 15.210 -8.751 1.00 1.23 N ATOM 539 CA LYS A 40 -3.557 15.388 -8.269 1.00 1.20 C ATOM 540 C LYS A 40 -3.582 15.821 -6.803 1.00 1.21 C ATOM 541 O LYS A 40 -4.486 16.536 -6.388 1.00 1.29 O ATOM 542 CB LYS A 40 -4.283 14.060 -8.472 1.00 1.12 C ATOM 543 CG LYS A 40 -5.807 14.230 -8.440 1.00 1.19 C ATOM 544 CD LYS A 40 -6.322 14.465 -9.859 1.00 1.46 C ATOM 545 CE LYS A 40 -6.347 13.197 -10.715 1.00 2.40 C ATOM 546 NZ LYS A 40 -7.491 12.330 -10.362 1.00 3.35 N ATOM 0 H LYS A 40 -1.784 14.315 -8.492 1.00 1.23 H new ATOM 0 HA LYS A 40 -4.055 16.184 -8.823 1.00 1.20 H new ATOM 0 HB2 LYS A 40 -3.986 13.626 -9.427 1.00 1.12 H new ATOM 0 HB3 LYS A 40 -3.980 13.358 -7.695 1.00 1.12 H new ATOM 0 HG2 LYS A 40 -6.274 13.342 -8.014 1.00 1.19 H new ATOM 0 HG3 LYS A 40 -6.077 15.070 -7.800 1.00 1.19 H new ATOM 0 HD2 LYS A 40 -7.329 14.880 -9.808 1.00 1.46 H new ATOM 0 HD3 LYS A 40 -5.694 15.211 -10.346 1.00 1.46 H new ATOM 0 HE2 LYS A 40 -6.406 13.469 -11.769 1.00 2.40 H new ATOM 0 HE3 LYS A 40 -5.416 12.646 -10.580 1.00 2.40 H new ATOM 0 HZ1 LYS A 40 -7.559 11.550 -11.046 1.00 3.35 H new ATOM 0 HZ2 LYS A 40 -7.351 11.942 -9.407 1.00 3.35 H new ATOM 0 HZ3 LYS A 40 -8.369 12.887 -10.384 1.00 3.35 H new ATOM 560 N PHE A 41 -2.610 15.365 -6.016 1.00 1.19 N ATOM 561 CA PHE A 41 -2.539 15.613 -4.577 1.00 1.28 C ATOM 562 C PHE A 41 -1.093 15.930 -4.174 1.00 1.10 C ATOM 563 O PHE A 41 -0.535 15.262 -3.303 1.00 1.09 O ATOM 564 CB PHE A 41 -3.025 14.392 -3.768 1.00 1.61 C ATOM 565 CG PHE A 41 -4.463 13.936 -3.941 1.00 0.77 C ATOM 566 CD1 PHE A 41 -4.849 13.201 -5.067 1.00 0.79 C ATOM 567 CD2 PHE A 41 -5.412 14.168 -2.936 1.00 1.23 C ATOM 568 CE1 PHE A 41 -6.175 12.767 -5.235 1.00 0.68 C ATOM 569 CE2 PHE A 41 -6.751 13.779 -3.112 1.00 2.01 C ATOM 570 CZ PHE A 41 -7.137 13.078 -4.265 1.00 1.72 C ATOM 0 H PHE A 41 -1.835 14.802 -6.367 1.00 1.19 H new ATOM 0 HA PHE A 41 -3.189 16.460 -4.355 1.00 1.28 H new ATOM 0 HB2 PHE A 41 -2.378 13.551 -4.016 1.00 1.61 H new ATOM 0 HB3 PHE A 41 -2.871 14.611 -2.711 1.00 1.61 H new ATOM 0 HD1 PHE A 41 -4.114 12.963 -5.822 1.00 0.79 H new ATOM 0 HD2 PHE A 41 -5.111 14.650 -2.018 1.00 1.23 H new ATOM 0 HE1 PHE A 41 -6.452 12.196 -6.109 1.00 0.68 H new ATOM 0 HE2 PHE A 41 -7.485 14.020 -2.358 1.00 2.01 H new ATOM 0 HZ PHE A 41 -8.166 12.781 -4.403 1.00 1.72 H new ATOM 580 N PRO A 42 -0.480 16.993 -4.710 1.00 1.16 N ATOM 581 CA PRO A 42 0.884 17.362 -4.347 1.00 1.13 C ATOM 582 C PRO A 42 0.994 17.698 -2.858 1.00 1.00 C ATOM 583 O PRO A 42 2.057 17.575 -2.260 1.00 1.13 O ATOM 584 CB PRO A 42 1.247 18.555 -5.234 1.00 1.37 C ATOM 585 CG PRO A 42 -0.105 19.145 -5.647 1.00 1.53 C ATOM 586 CD PRO A 42 -1.071 17.959 -5.618 1.00 1.39 C ATOM 0 HA PRO A 42 1.577 16.536 -4.507 1.00 1.13 H new ATOM 0 HB2 PRO A 42 1.850 19.284 -4.693 1.00 1.37 H new ATOM 0 HB3 PRO A 42 1.827 18.243 -6.103 1.00 1.37 H new ATOM 0 HG2 PRO A 42 -0.421 19.930 -4.960 1.00 1.53 H new ATOM 0 HG3 PRO A 42 -0.056 19.591 -6.640 1.00 1.53 H new ATOM 0 HD2 PRO A 42 -2.058 18.267 -5.274 1.00 1.39 H new ATOM 0 HD3 PRO A 42 -1.199 17.534 -6.613 1.00 1.39 H new ATOM 594 N GLU A 43 -0.123 18.062 -2.226 1.00 0.96 N ATOM 595 CA GLU A 43 -0.176 18.430 -0.820 1.00 1.06 C ATOM 596 C GLU A 43 -0.257 17.183 0.063 1.00 0.94 C ATOM 597 O GLU A 43 -0.478 17.279 1.266 1.00 1.34 O ATOM 598 CB GLU A 43 -1.387 19.347 -0.616 1.00 1.52 C ATOM 599 CG GLU A 43 -0.992 20.799 -0.900 1.00 2.07 C ATOM 600 CD GLU A 43 -2.220 21.708 -0.888 1.00 2.33 C ATOM 601 OE1 GLU A 43 -2.909 21.718 0.155 1.00 3.08 O ATOM 602 OE2 GLU A 43 -2.463 22.357 -1.928 1.00 3.34 O ATOM 0 H GLU A 43 -1.030 18.108 -2.690 1.00 0.96 H new ATOM 0 HA GLU A 43 0.732 18.959 -0.531 1.00 1.06 H new ATOM 0 HB2 GLU A 43 -2.199 19.045 -1.278 1.00 1.52 H new ATOM 0 HB3 GLU A 43 -1.757 19.254 0.405 1.00 1.52 H new ATOM 0 HG2 GLU A 43 -0.275 21.139 -0.152 1.00 2.07 H new ATOM 0 HG3 GLU A 43 -0.496 20.863 -1.869 1.00 2.07 H new ATOM 609 N SER A 44 -0.067 16.003 -0.528 1.00 0.82 N ATOM 610 CA SER A 44 0.007 14.735 0.170 1.00 0.93 C ATOM 611 C SER A 44 1.368 14.090 -0.084 1.00 0.98 C ATOM 612 O SER A 44 1.547 12.913 0.212 1.00 1.29 O ATOM 613 CB SER A 44 -1.138 13.846 -0.310 1.00 1.20 C ATOM 614 OG SER A 44 -2.346 14.579 -0.248 1.00 2.60 O ATOM 0 H SER A 44 0.042 15.909 -1.538 1.00 0.82 H new ATOM 0 HA SER A 44 -0.094 14.880 1.246 1.00 0.93 H new ATOM 0 HB2 SER A 44 -0.953 13.511 -1.331 1.00 1.20 H new ATOM 0 HB3 SER A 44 -1.207 12.953 0.311 1.00 1.20 H new ATOM 0 HG SER A 44 -2.302 15.335 -0.869 1.00 2.60 H new ATOM 620 N PHE A 45 2.346 14.860 -0.577 1.00 1.09 N ATOM 621 CA PHE A 45 3.723 14.421 -0.676 1.00 1.43 C ATOM 622 C PHE A 45 4.585 15.419 0.073 1.00 1.19 C ATOM 623 O PHE A 45 5.129 16.363 -0.487 1.00 1.58 O ATOM 624 CB PHE A 45 4.167 14.236 -2.131 1.00 2.28 C ATOM 625 CG PHE A 45 3.773 12.908 -2.742 1.00 3.62 C ATOM 626 CD1 PHE A 45 3.246 12.858 -4.041 1.00 3.56 C ATOM 627 CD2 PHE A 45 3.975 11.707 -2.037 1.00 5.61 C ATOM 628 CE1 PHE A 45 2.939 11.618 -4.621 1.00 5.39 C ATOM 629 CE2 PHE A 45 3.603 10.476 -2.593 1.00 7.33 C ATOM 630 CZ PHE A 45 3.111 10.426 -3.902 1.00 7.19 C ATOM 0 H PHE A 45 2.192 15.809 -0.918 1.00 1.09 H new ATOM 0 HA PHE A 45 3.831 13.436 -0.222 1.00 1.43 H new ATOM 0 HB2 PHE A 45 3.742 15.039 -2.733 1.00 2.28 H new ATOM 0 HB3 PHE A 45 5.251 14.339 -2.183 1.00 2.28 H new ATOM 0 HD1 PHE A 45 3.077 13.771 -4.593 1.00 3.56 H new ATOM 0 HD2 PHE A 45 4.423 11.735 -1.055 1.00 5.61 H new ATOM 0 HE1 PHE A 45 2.566 11.581 -5.634 1.00 5.39 H new ATOM 0 HE2 PHE A 45 3.696 9.569 -2.014 1.00 7.33 H new ATOM 0 HZ PHE A 45 2.866 9.477 -4.355 1.00 7.19 H new ATOM 640 N ASP A 46 4.708 15.153 1.368 1.00 1.32 N ATOM 641 CA ASP A 46 5.586 15.859 2.285 1.00 1.91 C ATOM 642 C ASP A 46 7.013 15.310 2.183 1.00 1.95 C ATOM 643 O ASP A 46 7.945 15.944 2.665 1.00 2.73 O ATOM 644 CB ASP A 46 5.038 15.679 3.704 1.00 2.61 C ATOM 645 CG ASP A 46 5.589 16.713 4.683 1.00 3.60 C ATOM 646 OD1 ASP A 46 5.796 16.326 5.854 1.00 4.11 O ATOM 647 OD2 ASP A 46 5.734 17.882 4.268 1.00 4.58 O ATOM 0 H ASP A 46 4.177 14.410 1.823 1.00 1.32 H new ATOM 0 HA ASP A 46 5.620 16.919 2.033 1.00 1.91 H new ATOM 0 HB2 ASP A 46 3.951 15.750 3.681 1.00 2.61 H new ATOM 0 HB3 ASP A 46 5.285 14.679 4.061 1.00 2.61 H new ATOM 652 N LEU A 47 7.173 14.121 1.567 1.00 1.35 N ATOM 653 CA LEU A 47 8.433 13.439 1.240 1.00 1.31 C ATOM 654 C LEU A 47 9.496 13.647 2.317 1.00 1.27 C ATOM 655 O LEU A 47 10.659 13.954 2.068 1.00 1.37 O ATOM 656 CB LEU A 47 8.881 13.667 -0.221 1.00 1.30 C ATOM 657 CG LEU A 47 8.316 14.928 -0.882 1.00 1.43 C ATOM 658 CD1 LEU A 47 8.958 16.208 -0.351 1.00 2.06 C ATOM 659 CD2 LEU A 47 8.480 14.844 -2.398 1.00 1.75 C ATOM 0 H LEU A 47 6.365 13.577 1.265 1.00 1.35 H new ATOM 0 HA LEU A 47 8.248 12.365 1.266 1.00 1.31 H new ATOM 0 HB2 LEU A 47 9.969 13.718 -0.248 1.00 1.30 H new ATOM 0 HB3 LEU A 47 8.587 12.801 -0.815 1.00 1.30 H new ATOM 0 HG LEU A 47 7.257 14.975 -0.630 1.00 1.43 H new ATOM 0 HD11 LEU A 47 8.520 17.070 -0.854 1.00 2.06 H new ATOM 0 HD12 LEU A 47 8.782 16.285 0.722 1.00 2.06 H new ATOM 0 HD13 LEU A 47 10.031 16.183 -0.541 1.00 2.06 H new ATOM 0 HD21 LEU A 47 8.075 15.745 -2.858 1.00 1.75 H new ATOM 0 HD22 LEU A 47 9.538 14.754 -2.645 1.00 1.75 H new ATOM 0 HD23 LEU A 47 7.944 13.972 -2.774 1.00 1.75 H new ATOM 671 N GLN A 48 9.034 13.434 3.546 1.00 1.20 N ATOM 672 CA GLN A 48 9.823 13.516 4.758 1.00 1.24 C ATOM 673 C GLN A 48 10.511 12.185 5.052 1.00 1.24 C ATOM 674 O GLN A 48 10.110 11.146 4.532 1.00 1.13 O ATOM 675 CB GLN A 48 8.906 13.892 5.934 1.00 1.24 C ATOM 676 CG GLN A 48 8.931 15.404 6.191 1.00 2.20 C ATOM 677 CD GLN A 48 8.689 15.740 7.660 1.00 2.79 C ATOM 678 OE1 GLN A 48 8.169 14.945 8.437 1.00 2.92 O ATOM 679 NE2 GLN A 48 9.161 16.901 8.100 1.00 3.77 N ATOM 0 H GLN A 48 8.060 13.190 3.725 1.00 1.20 H new ATOM 0 HA GLN A 48 10.592 14.277 4.624 1.00 1.24 H new ATOM 0 HB2 GLN A 48 7.886 13.573 5.720 1.00 1.24 H new ATOM 0 HB3 GLN A 48 9.224 13.362 6.832 1.00 1.24 H new ATOM 0 HG2 GLN A 48 9.895 15.808 5.881 1.00 2.20 H new ATOM 0 HG3 GLN A 48 8.170 15.888 5.579 1.00 2.20 H new ATOM 0 HE21 GLN A 48 9.592 17.556 7.448 1.00 3.77 H new ATOM 0 HE22 GLN A 48 9.093 17.137 9.090 1.00 3.77 H new ATOM 688 N PRO A 49 11.516 12.195 5.935 1.00 1.42 N ATOM 689 CA PRO A 49 12.189 10.986 6.369 1.00 1.44 C ATOM 690 C PRO A 49 11.251 10.139 7.239 1.00 1.24 C ATOM 691 O PRO A 49 10.749 10.608 8.264 1.00 1.39 O ATOM 692 CB PRO A 49 13.422 11.477 7.131 1.00 1.70 C ATOM 693 CG PRO A 49 13.004 12.848 7.664 1.00 1.76 C ATOM 694 CD PRO A 49 12.079 13.375 6.572 1.00 1.62 C ATOM 0 HA PRO A 49 12.480 10.336 5.543 1.00 1.44 H new ATOM 0 HB2 PRO A 49 13.688 10.798 7.941 1.00 1.70 H new ATOM 0 HB3 PRO A 49 14.292 11.550 6.478 1.00 1.70 H new ATOM 0 HG2 PRO A 49 12.492 12.769 8.623 1.00 1.76 H new ATOM 0 HG3 PRO A 49 13.863 13.501 7.815 1.00 1.76 H new ATOM 0 HD2 PRO A 49 11.295 14.005 6.992 1.00 1.62 H new ATOM 0 HD3 PRO A 49 12.627 13.984 5.854 1.00 1.62 H new ATOM 702 N ILE A 50 11.028 8.877 6.859 1.00 0.97 N ATOM 703 CA ILE A 50 10.208 7.931 7.594 1.00 0.83 C ATOM 704 C ILE A 50 11.108 6.765 8.001 1.00 0.80 C ATOM 705 O ILE A 50 12.079 6.453 7.316 1.00 0.81 O ATOM 706 CB ILE A 50 9.033 7.446 6.722 1.00 0.70 C ATOM 707 CG1 ILE A 50 8.311 8.562 5.941 1.00 0.80 C ATOM 708 CG2 ILE A 50 8.036 6.681 7.584 1.00 0.71 C ATOM 709 CD1 ILE A 50 7.658 9.632 6.820 1.00 2.00 C ATOM 0 H ILE A 50 11.427 8.482 6.007 1.00 0.97 H new ATOM 0 HA ILE A 50 9.778 8.399 8.479 1.00 0.83 H new ATOM 0 HB ILE A 50 9.470 6.795 5.964 1.00 0.70 H new ATOM 0 HG12 ILE A 50 9.027 9.044 5.275 1.00 0.80 H new ATOM 0 HG13 ILE A 50 7.545 8.110 5.311 1.00 0.80 H new ATOM 0 HG21 ILE A 50 7.207 6.339 6.965 1.00 0.71 H new ATOM 0 HG22 ILE A 50 8.530 5.821 8.035 1.00 0.71 H new ATOM 0 HG23 ILE A 50 7.657 7.335 8.369 1.00 0.71 H new ATOM 0 HD11 ILE A 50 7.174 10.376 6.188 1.00 2.00 H new ATOM 0 HD12 ILE A 50 6.915 9.167 7.468 1.00 2.00 H new ATOM 0 HD13 ILE A 50 8.420 10.116 7.431 1.00 2.00 H new ATOM 721 N GLU A 51 10.796 6.119 9.123 1.00 0.80 N ATOM 722 CA GLU A 51 11.544 4.975 9.603 1.00 0.78 C ATOM 723 C GLU A 51 11.308 3.759 8.709 1.00 0.75 C ATOM 724 O GLU A 51 10.306 3.642 8.009 1.00 1.15 O ATOM 725 CB GLU A 51 11.106 4.642 11.035 1.00 0.84 C ATOM 726 CG GLU A 51 12.235 4.775 12.068 1.00 0.99 C ATOM 727 CD GLU A 51 11.898 5.846 13.111 1.00 1.37 C ATOM 728 OE1 GLU A 51 11.594 6.989 12.693 1.00 2.19 O ATOM 729 OE2 GLU A 51 11.892 5.500 14.313 1.00 2.50 O ATOM 0 H GLU A 51 10.013 6.381 9.722 1.00 0.80 H new ATOM 0 HA GLU A 51 12.605 5.223 9.584 1.00 0.78 H new ATOM 0 HB2 GLU A 51 10.286 5.302 11.318 1.00 0.84 H new ATOM 0 HB3 GLU A 51 10.719 3.623 11.060 1.00 0.84 H new ATOM 0 HG2 GLU A 51 12.395 3.817 12.563 1.00 0.99 H new ATOM 0 HG3 GLU A 51 13.166 5.033 11.564 1.00 0.99 H new ATOM 736 N VAL A 52 12.219 2.798 8.794 1.00 0.48 N ATOM 737 CA VAL A 52 12.187 1.608 7.971 1.00 0.47 C ATOM 738 C VAL A 52 11.300 0.579 8.652 1.00 0.53 C ATOM 739 O VAL A 52 11.710 -0.076 9.602 1.00 0.69 O ATOM 740 CB VAL A 52 13.615 1.094 7.723 1.00 0.57 C ATOM 741 CG1 VAL A 52 13.615 -0.147 6.822 1.00 0.88 C ATOM 742 CG2 VAL A 52 14.473 2.170 7.040 1.00 0.88 C ATOM 0 H VAL A 52 13.005 2.828 9.443 1.00 0.48 H new ATOM 0 HA VAL A 52 11.766 1.825 6.989 1.00 0.47 H new ATOM 0 HB VAL A 52 14.030 0.841 8.699 1.00 0.57 H new ATOM 0 HG11 VAL A 52 14.640 -0.484 6.667 1.00 0.88 H new ATOM 0 HG12 VAL A 52 13.040 -0.942 7.297 1.00 0.88 H new ATOM 0 HG13 VAL A 52 13.166 0.101 5.861 1.00 0.88 H new ATOM 0 HG21 VAL A 52 15.479 1.783 6.875 1.00 0.88 H new ATOM 0 HG22 VAL A 52 14.026 2.438 6.083 1.00 0.88 H new ATOM 0 HG23 VAL A 52 14.524 3.053 7.677 1.00 0.88 H new ATOM 752 N GLY A 53 10.067 0.485 8.159 1.00 0.57 N ATOM 753 CA GLY A 53 9.038 -0.428 8.644 1.00 0.79 C ATOM 754 C GLY A 53 7.803 0.351 9.089 1.00 0.82 C ATOM 755 O GLY A 53 6.677 -0.138 9.035 1.00 1.29 O ATOM 0 H GLY A 53 9.747 1.064 7.383 1.00 0.57 H new ATOM 0 HA2 GLY A 53 8.768 -1.132 7.857 1.00 0.79 H new ATOM 0 HA3 GLY A 53 9.426 -1.014 9.477 1.00 0.79 H new ATOM 759 N LYS A 54 8.013 1.587 9.536 1.00 0.42 N ATOM 760 CA LYS A 54 6.992 2.409 10.140 1.00 0.35 C ATOM 761 C LYS A 54 6.235 3.103 9.019 1.00 0.35 C ATOM 762 O LYS A 54 6.845 3.736 8.163 1.00 0.43 O ATOM 763 CB LYS A 54 7.739 3.402 11.034 1.00 0.51 C ATOM 764 CG LYS A 54 6.882 4.502 11.661 1.00 1.62 C ATOM 765 CD LYS A 54 6.787 4.391 13.189 1.00 1.85 C ATOM 766 CE LYS A 54 6.563 5.783 13.785 1.00 3.32 C ATOM 767 NZ LYS A 54 6.419 5.731 15.256 1.00 3.65 N ATOM 0 H LYS A 54 8.922 2.046 9.483 1.00 0.42 H new ATOM 0 HA LYS A 54 6.267 1.852 10.734 1.00 0.35 H new ATOM 0 HB2 LYS A 54 8.227 2.846 11.834 1.00 0.51 H new ATOM 0 HB3 LYS A 54 8.527 3.872 10.445 1.00 0.51 H new ATOM 0 HG2 LYS A 54 7.299 5.474 11.398 1.00 1.62 H new ATOM 0 HG3 LYS A 54 5.879 4.460 11.236 1.00 1.62 H new ATOM 0 HD2 LYS A 54 5.968 3.728 13.467 1.00 1.85 H new ATOM 0 HD3 LYS A 54 7.701 3.954 13.591 1.00 1.85 H new ATOM 0 HE2 LYS A 54 7.401 6.430 13.524 1.00 3.32 H new ATOM 0 HE3 LYS A 54 5.669 6.227 13.347 1.00 3.32 H new ATOM 0 HZ1 LYS A 54 6.269 6.692 15.624 1.00 3.65 H new ATOM 0 HZ2 LYS A 54 5.605 5.134 15.504 1.00 3.65 H new ATOM 0 HZ3 LYS A 54 7.282 5.331 15.675 1.00 3.65 H new ATOM 781 N ALA A 55 4.909 3.048 9.052 1.00 0.34 N ATOM 782 CA ALA A 55 4.096 3.888 8.183 1.00 0.34 C ATOM 783 C ALA A 55 3.666 5.126 8.972 1.00 0.41 C ATOM 784 O ALA A 55 3.399 5.034 10.170 1.00 0.54 O ATOM 785 CB ALA A 55 2.876 3.107 7.684 1.00 0.35 C ATOM 0 H ALA A 55 4.377 2.434 9.668 1.00 0.34 H new ATOM 0 HA ALA A 55 4.672 4.195 7.310 1.00 0.34 H new ATOM 0 HB1 ALA A 55 2.276 3.745 7.035 1.00 0.35 H new ATOM 0 HB2 ALA A 55 3.208 2.232 7.126 1.00 0.35 H new ATOM 0 HB3 ALA A 55 2.275 2.788 8.536 1.00 0.35 H new ATOM 791 N ARG A 56 3.584 6.285 8.316 1.00 0.40 N ATOM 792 CA ARG A 56 3.051 7.509 8.907 1.00 0.52 C ATOM 793 C ARG A 56 1.994 8.068 7.961 1.00 0.44 C ATOM 794 O ARG A 56 2.220 8.132 6.758 1.00 0.42 O ATOM 795 CB ARG A 56 4.171 8.539 9.111 1.00 0.73 C ATOM 796 CG ARG A 56 4.971 8.324 10.403 1.00 1.37 C ATOM 797 CD ARG A 56 6.173 9.282 10.415 1.00 1.84 C ATOM 798 NE ARG A 56 6.830 9.352 11.731 1.00 2.68 N ATOM 799 CZ ARG A 56 8.122 9.651 11.942 1.00 3.59 C ATOM 800 NH1 ARG A 56 8.603 9.663 13.187 1.00 4.31 N ATOM 801 NH2 ARG A 56 8.935 9.943 10.923 1.00 4.41 N ATOM 0 H ARG A 56 3.890 6.399 7.350 1.00 0.40 H new ATOM 0 HA ARG A 56 2.613 7.292 9.881 1.00 0.52 H new ATOM 0 HB2 ARG A 56 4.851 8.498 8.260 1.00 0.73 H new ATOM 0 HB3 ARG A 56 3.737 9.539 9.124 1.00 0.73 H new ATOM 0 HG2 ARG A 56 4.338 8.504 11.272 1.00 1.37 H new ATOM 0 HG3 ARG A 56 5.313 7.291 10.466 1.00 1.37 H new ATOM 0 HD2 ARG A 56 6.898 8.958 9.668 1.00 1.84 H new ATOM 0 HD3 ARG A 56 5.841 10.279 10.126 1.00 1.84 H new ATOM 0 HE ARG A 56 6.256 9.157 12.551 1.00 2.68 H new ATOM 0 HH11 ARG A 56 7.990 9.446 13.973 1.00 4.31 H new ATOM 0 HH12 ARG A 56 9.584 9.889 13.353 1.00 4.31 H new ATOM 0 HH21 ARG A 56 8.577 9.941 9.968 1.00 4.41 H new ATOM 0 HH22 ARG A 56 9.914 10.168 11.100 1.00 4.41 H new ATOM 815 N LEU A 57 0.841 8.469 8.486 1.00 0.48 N ATOM 816 CA LEU A 57 -0.167 9.177 7.710 1.00 0.47 C ATOM 817 C LEU A 57 0.298 10.597 7.400 1.00 0.51 C ATOM 818 O LEU A 57 1.090 11.163 8.150 1.00 0.57 O ATOM 819 CB LEU A 57 -1.522 9.161 8.431 1.00 0.59 C ATOM 820 CG LEU A 57 -1.530 9.895 9.785 1.00 0.88 C ATOM 821 CD1 LEU A 57 -2.505 11.073 9.749 1.00 1.73 C ATOM 822 CD2 LEU A 57 -1.945 8.931 10.900 1.00 1.23 C ATOM 0 H LEU A 57 0.581 8.312 9.460 1.00 0.48 H new ATOM 0 HA LEU A 57 -0.303 8.661 6.759 1.00 0.47 H new ATOM 0 HB2 LEU A 57 -2.271 9.614 7.781 1.00 0.59 H new ATOM 0 HB3 LEU A 57 -1.823 8.126 8.591 1.00 0.59 H new ATOM 0 HG LEU A 57 -0.525 10.269 9.979 1.00 0.88 H new ATOM 0 HD11 LEU A 57 -2.498 11.581 10.714 1.00 1.73 H new ATOM 0 HD12 LEU A 57 -2.203 11.772 8.969 1.00 1.73 H new ATOM 0 HD13 LEU A 57 -3.510 10.707 9.539 1.00 1.73 H new ATOM 0 HD21 LEU A 57 -1.948 9.458 11.854 1.00 1.23 H new ATOM 0 HD22 LEU A 57 -2.944 8.546 10.695 1.00 1.23 H new ATOM 0 HD23 LEU A 57 -1.239 8.102 10.946 1.00 1.23 H new ATOM 834 N VAL A 58 -0.209 11.179 6.311 1.00 0.60 N ATOM 835 CA VAL A 58 0.107 12.528 5.897 1.00 0.71 C ATOM 836 C VAL A 58 -1.219 13.261 5.692 1.00 0.67 C ATOM 837 O VAL A 58 -2.134 12.764 5.029 1.00 0.63 O ATOM 838 CB VAL A 58 1.005 12.506 4.649 1.00 0.83 C ATOM 839 CG1 VAL A 58 2.228 11.604 4.864 1.00 1.44 C ATOM 840 CG2 VAL A 58 0.290 12.042 3.379 1.00 1.02 C ATOM 0 H VAL A 58 -0.863 10.707 5.686 1.00 0.60 H new ATOM 0 HA VAL A 58 0.682 13.064 6.652 1.00 0.71 H new ATOM 0 HB VAL A 58 1.306 13.544 4.505 1.00 0.83 H new ATOM 0 HG11 VAL A 58 2.845 11.607 3.966 1.00 1.44 H new ATOM 0 HG12 VAL A 58 2.811 11.976 5.706 1.00 1.44 H new ATOM 0 HG13 VAL A 58 1.897 10.587 5.073 1.00 1.44 H new ATOM 0 HG21 VAL A 58 0.989 12.054 2.543 1.00 1.02 H new ATOM 0 HG22 VAL A 58 -0.087 11.029 3.523 1.00 1.02 H new ATOM 0 HG23 VAL A 58 -0.543 12.712 3.165 1.00 1.02 H new ATOM 850 N LYS A 59 -1.360 14.428 6.323 1.00 0.84 N ATOM 851 CA LYS A 59 -2.597 15.188 6.271 1.00 0.90 C ATOM 852 C LYS A 59 -2.650 15.943 4.947 1.00 0.90 C ATOM 853 O LYS A 59 -2.338 17.131 4.902 1.00 1.32 O ATOM 854 CB LYS A 59 -2.646 16.150 7.468 1.00 1.33 C ATOM 855 CG LYS A 59 -3.996 16.876 7.601 1.00 2.61 C ATOM 856 CD LYS A 59 -3.801 18.343 8.009 1.00 3.43 C ATOM 857 CE LYS A 59 -3.557 19.197 6.758 1.00 5.06 C ATOM 858 NZ LYS A 59 -3.078 20.558 7.077 1.00 6.24 N ATOM 0 H LYS A 59 -0.624 14.864 6.878 1.00 0.84 H new ATOM 0 HA LYS A 59 -3.463 14.528 6.330 1.00 0.90 H new ATOM 0 HB2 LYS A 59 -2.448 15.593 8.383 1.00 1.33 H new ATOM 0 HB3 LYS A 59 -1.851 16.889 7.366 1.00 1.33 H new ATOM 0 HG2 LYS A 59 -4.532 16.828 6.653 1.00 2.61 H new ATOM 0 HG3 LYS A 59 -4.613 16.369 8.343 1.00 2.61 H new ATOM 0 HD2 LYS A 59 -4.681 18.703 8.541 1.00 3.43 H new ATOM 0 HD3 LYS A 59 -2.957 18.432 8.693 1.00 3.43 H new ATOM 0 HE2 LYS A 59 -2.825 18.699 6.121 1.00 5.06 H new ATOM 0 HE3 LYS A 59 -4.482 19.267 6.186 1.00 5.06 H new ATOM 0 HZ1 LYS A 59 -2.930 21.090 6.195 1.00 6.24 H new ATOM 0 HZ2 LYS A 59 -3.786 21.047 7.662 1.00 6.24 H new ATOM 0 HZ3 LYS A 59 -2.181 20.497 7.599 1.00 6.24 H new ATOM 872 N GLY A 60 -3.066 15.285 3.871 1.00 0.80 N ATOM 873 CA GLY A 60 -3.311 15.971 2.630 1.00 1.07 C ATOM 874 C GLY A 60 -4.584 16.779 2.797 1.00 0.94 C ATOM 875 O GLY A 60 -5.628 16.251 3.175 1.00 0.92 O ATOM 0 H GLY A 60 -3.237 14.280 3.843 1.00 0.80 H new ATOM 0 HA2 GLY A 60 -2.474 16.623 2.381 1.00 1.07 H new ATOM 0 HA3 GLY A 60 -3.414 15.258 1.812 1.00 1.07 H new ATOM 879 N ALA A 61 -4.497 18.074 2.511 1.00 0.96 N ATOM 880 CA ALA A 61 -5.662 18.950 2.491 1.00 0.97 C ATOM 881 C ALA A 61 -6.703 18.412 1.510 1.00 0.91 C ATOM 882 O ALA A 61 -7.897 18.410 1.791 1.00 0.96 O ATOM 883 CB ALA A 61 -5.241 20.374 2.121 1.00 1.11 C ATOM 0 H ALA A 61 -3.620 18.544 2.287 1.00 0.96 H new ATOM 0 HA ALA A 61 -6.111 18.976 3.484 1.00 0.97 H new ATOM 0 HB1 ALA A 61 -6.118 21.021 2.109 1.00 1.11 H new ATOM 0 HB2 ALA A 61 -4.527 20.745 2.856 1.00 1.11 H new ATOM 0 HB3 ALA A 61 -4.778 20.372 1.134 1.00 1.11 H new ATOM 889 N ALA A 62 -6.231 17.946 0.352 1.00 0.86 N ATOM 890 CA ALA A 62 -7.070 17.351 -0.673 1.00 0.87 C ATOM 891 C ALA A 62 -7.708 16.041 -0.182 1.00 0.90 C ATOM 892 O ALA A 62 -8.902 15.837 -0.389 1.00 0.98 O ATOM 893 CB ALA A 62 -6.237 17.177 -1.949 1.00 0.86 C ATOM 0 H ALA A 62 -5.242 17.975 0.103 1.00 0.86 H new ATOM 0 HA ALA A 62 -7.907 18.010 -0.902 1.00 0.87 H new ATOM 0 HB1 ALA A 62 -6.854 16.731 -2.729 1.00 0.86 H new ATOM 0 HB2 ALA A 62 -5.877 18.150 -2.284 1.00 0.86 H new ATOM 0 HB3 ALA A 62 -5.387 16.527 -1.743 1.00 0.86 H new ATOM 899 N LYS A 63 -6.948 15.137 0.451 1.00 0.84 N ATOM 900 CA LYS A 63 -7.508 13.969 1.139 1.00 0.81 C ATOM 901 C LYS A 63 -6.453 13.430 2.104 1.00 0.72 C ATOM 902 O LYS A 63 -5.269 13.704 1.935 1.00 0.69 O ATOM 903 CB LYS A 63 -7.934 12.891 0.118 1.00 0.88 C ATOM 904 CG LYS A 63 -8.780 11.741 0.684 1.00 1.52 C ATOM 905 CD LYS A 63 -10.189 12.221 1.048 1.00 2.09 C ATOM 906 CE LYS A 63 -10.930 11.132 1.826 1.00 3.00 C ATOM 907 NZ LYS A 63 -12.329 11.524 2.104 1.00 3.45 N ATOM 0 H LYS A 63 -5.931 15.196 0.500 1.00 0.84 H new ATOM 0 HA LYS A 63 -8.400 14.254 1.697 1.00 0.81 H new ATOM 0 HB2 LYS A 63 -8.497 13.374 -0.680 1.00 0.88 H new ATOM 0 HB3 LYS A 63 -7.037 12.470 -0.335 1.00 0.88 H new ATOM 0 HG2 LYS A 63 -8.844 10.937 -0.050 1.00 1.52 H new ATOM 0 HG3 LYS A 63 -8.293 11.328 1.568 1.00 1.52 H new ATOM 0 HD2 LYS A 63 -10.129 13.130 1.647 1.00 2.09 H new ATOM 0 HD3 LYS A 63 -10.741 12.472 0.143 1.00 2.09 H new ATOM 0 HE2 LYS A 63 -10.917 10.203 1.256 1.00 3.00 H new ATOM 0 HE3 LYS A 63 -10.412 10.937 2.765 1.00 3.00 H new ATOM 0 HZ1 LYS A 63 -12.687 10.980 2.915 1.00 3.45 H new ATOM 0 HZ2 LYS A 63 -12.368 12.540 2.324 1.00 3.45 H new ATOM 0 HZ3 LYS A 63 -12.917 11.328 1.269 1.00 3.45 H new ATOM 921 N HIS A 64 -6.858 12.650 3.105 1.00 0.76 N ATOM 922 CA HIS A 64 -5.918 11.972 3.985 1.00 0.69 C ATOM 923 C HIS A 64 -5.227 10.854 3.204 1.00 0.58 C ATOM 924 O HIS A 64 -5.902 10.062 2.546 1.00 0.66 O ATOM 925 CB HIS A 64 -6.667 11.373 5.182 1.00 0.81 C ATOM 926 CG HIS A 64 -7.461 12.355 6.012 1.00 1.09 C ATOM 927 ND1 HIS A 64 -8.278 12.011 7.065 1.00 1.35 N ATOM 928 CD2 HIS A 64 -7.525 13.717 5.866 1.00 1.24 C ATOM 929 CE1 HIS A 64 -8.826 13.143 7.539 1.00 1.61 C ATOM 930 NE2 HIS A 64 -8.399 14.206 6.839 1.00 1.56 N ATOM 0 H HIS A 64 -7.838 12.474 3.325 1.00 0.76 H new ATOM 0 HA HIS A 64 -5.177 12.684 4.349 1.00 0.69 H new ATOM 0 HB2 HIS A 64 -7.345 10.603 4.815 1.00 0.81 H new ATOM 0 HB3 HIS A 64 -5.944 10.878 5.830 1.00 0.81 H new ATOM 0 HD2 HIS A 64 -6.995 14.305 5.131 1.00 1.24 H new ATOM 0 HE1 HIS A 64 -9.515 13.191 8.369 1.00 1.61 H new ATOM 0 HE2 HIS A 64 -8.662 15.180 6.989 1.00 1.56 H new ATOM 938 N ILE A 65 -3.899 10.763 3.293 1.00 0.47 N ATOM 939 CA ILE A 65 -3.112 9.722 2.639 1.00 0.40 C ATOM 940 C ILE A 65 -2.309 9.015 3.729 1.00 0.36 C ATOM 941 O ILE A 65 -2.127 9.560 4.815 1.00 0.47 O ATOM 942 CB ILE A 65 -2.244 10.344 1.515 1.00 0.41 C ATOM 943 CG1 ILE A 65 -2.990 10.496 0.176 1.00 0.73 C ATOM 944 CG2 ILE A 65 -0.998 9.537 1.140 1.00 0.64 C ATOM 945 CD1 ILE A 65 -3.969 11.653 0.152 1.00 0.74 C ATOM 0 H ILE A 65 -3.334 11.421 3.830 1.00 0.47 H new ATOM 0 HA ILE A 65 -3.735 8.979 2.141 1.00 0.40 H new ATOM 0 HB ILE A 65 -1.978 11.301 1.964 1.00 0.41 H new ATOM 0 HG12 ILE A 65 -2.261 10.632 -0.623 1.00 0.73 H new ATOM 0 HG13 ILE A 65 -3.528 9.572 -0.037 1.00 0.73 H new ATOM 0 HG21 ILE A 65 -0.456 10.052 0.346 1.00 0.64 H new ATOM 0 HG22 ILE A 65 -0.353 9.436 2.013 1.00 0.64 H new ATOM 0 HG23 ILE A 65 -1.296 8.548 0.793 1.00 0.64 H new ATOM 0 HD11 ILE A 65 -4.456 11.697 -0.822 1.00 0.74 H new ATOM 0 HD12 ILE A 65 -4.721 11.509 0.928 1.00 0.74 H new ATOM 0 HD13 ILE A 65 -3.435 12.586 0.333 1.00 0.74 H new ATOM 957 N ILE A 66 -1.816 7.810 3.453 1.00 0.33 N ATOM 958 CA ILE A 66 -0.952 7.059 4.343 1.00 0.32 C ATOM 959 C ILE A 66 0.327 6.764 3.568 1.00 0.36 C ATOM 960 O ILE A 66 0.270 6.443 2.381 1.00 0.44 O ATOM 961 CB ILE A 66 -1.632 5.766 4.828 1.00 0.39 C ATOM 962 CG1 ILE A 66 -3.107 5.919 5.254 1.00 0.47 C ATOM 963 CG2 ILE A 66 -0.825 5.125 5.967 1.00 0.41 C ATOM 964 CD1 ILE A 66 -3.324 6.753 6.516 1.00 0.47 C ATOM 0 H ILE A 66 -2.015 7.321 2.580 1.00 0.33 H new ATOM 0 HA ILE A 66 -0.731 7.634 5.242 1.00 0.32 H new ATOM 0 HB ILE A 66 -1.646 5.116 3.953 1.00 0.39 H new ATOM 0 HG12 ILE A 66 -3.662 6.374 4.434 1.00 0.47 H new ATOM 0 HG13 ILE A 66 -3.530 4.927 5.413 1.00 0.47 H new ATOM 0 HG21 ILE A 66 -1.322 4.212 6.296 1.00 0.41 H new ATOM 0 HG22 ILE A 66 0.177 4.885 5.612 1.00 0.41 H new ATOM 0 HG23 ILE A 66 -0.757 5.822 6.802 1.00 0.41 H new ATOM 0 HD11 ILE A 66 -4.390 6.806 6.738 1.00 0.47 H new ATOM 0 HD12 ILE A 66 -2.801 6.290 7.353 1.00 0.47 H new ATOM 0 HD13 ILE A 66 -2.936 7.759 6.358 1.00 0.47 H new ATOM 976 N HIS A 67 1.477 6.863 4.232 1.00 0.35 N ATOM 977 CA HIS A 67 2.768 6.599 3.619 1.00 0.45 C ATOM 978 C HIS A 67 3.376 5.390 4.305 1.00 0.36 C ATOM 979 O HIS A 67 3.564 5.402 5.520 1.00 0.42 O ATOM 980 CB HIS A 67 3.684 7.820 3.779 1.00 0.66 C ATOM 981 CG HIS A 67 3.664 8.794 2.633 1.00 1.10 C ATOM 982 ND1 HIS A 67 4.477 9.898 2.543 1.00 1.89 N ATOM 983 CD2 HIS A 67 2.919 8.727 1.484 1.00 1.59 C ATOM 984 CE1 HIS A 67 4.231 10.480 1.362 1.00 2.41 C ATOM 985 NE2 HIS A 67 3.292 9.805 0.680 1.00 2.31 N ATOM 0 H HIS A 67 1.535 7.130 5.215 1.00 0.35 H new ATOM 0 HA HIS A 67 2.649 6.403 2.553 1.00 0.45 H new ATOM 0 HB2 HIS A 67 3.401 8.349 4.689 1.00 0.66 H new ATOM 0 HB3 HIS A 67 4.707 7.470 3.919 1.00 0.66 H new ATOM 0 HD2 HIS A 67 2.179 7.977 1.245 1.00 1.59 H new ATOM 0 HE1 HIS A 67 4.723 11.373 1.006 1.00 2.41 H new ATOM 0 HE2 HIS A 67 2.924 10.035 -0.243 1.00 2.31 H new ATOM 993 N ALA A 68 3.698 4.359 3.524 1.00 0.37 N ATOM 994 CA ALA A 68 4.310 3.146 4.033 1.00 0.40 C ATOM 995 C ALA A 68 5.719 3.019 3.470 1.00 0.41 C ATOM 996 O ALA A 68 5.976 3.319 2.302 1.00 0.44 O ATOM 997 CB ALA A 68 3.455 1.936 3.652 1.00 0.51 C ATOM 0 H ALA A 68 3.538 4.348 2.517 1.00 0.37 H new ATOM 0 HA ALA A 68 4.372 3.189 5.120 1.00 0.40 H new ATOM 0 HB1 ALA A 68 3.919 1.027 4.036 1.00 0.51 H new ATOM 0 HB2 ALA A 68 2.459 2.045 4.081 1.00 0.51 H new ATOM 0 HB3 ALA A 68 3.377 1.873 2.567 1.00 0.51 H new ATOM 1003 N VAL A 69 6.653 2.565 4.297 1.00 0.59 N ATOM 1004 CA VAL A 69 7.978 2.263 3.860 1.00 0.65 C ATOM 1005 C VAL A 69 7.949 0.850 3.316 1.00 0.71 C ATOM 1006 O VAL A 69 7.492 -0.064 3.990 1.00 0.78 O ATOM 1007 CB VAL A 69 8.941 2.482 5.029 1.00 0.72 C ATOM 1008 CG1 VAL A 69 10.313 1.902 4.692 1.00 1.45 C ATOM 1009 CG2 VAL A 69 8.979 3.989 5.315 1.00 1.52 C ATOM 0 H VAL A 69 6.495 2.401 5.291 1.00 0.59 H new ATOM 0 HA VAL A 69 8.335 2.913 3.061 1.00 0.65 H new ATOM 0 HB VAL A 69 8.610 1.964 5.929 1.00 0.72 H new ATOM 0 HG11 VAL A 69 10.992 2.063 5.530 1.00 1.45 H new ATOM 0 HG12 VAL A 69 10.219 0.833 4.501 1.00 1.45 H new ATOM 0 HG13 VAL A 69 10.709 2.396 3.805 1.00 1.45 H new ATOM 0 HG21 VAL A 69 9.657 4.185 6.145 1.00 1.52 H new ATOM 0 HG22 VAL A 69 9.328 4.519 4.429 1.00 1.52 H new ATOM 0 HG23 VAL A 69 7.979 4.335 5.575 1.00 1.52 H new ATOM 1019 N GLY A 70 8.422 0.714 2.081 1.00 0.96 N ATOM 1020 CA GLY A 70 8.716 -0.547 1.435 1.00 1.21 C ATOM 1021 C GLY A 70 10.074 -0.402 0.753 1.00 1.66 C ATOM 1022 O GLY A 70 10.205 0.401 -0.165 1.00 1.88 O ATOM 0 H GLY A 70 8.617 1.517 1.484 1.00 0.96 H new ATOM 0 HA2 GLY A 70 8.737 -1.357 2.164 1.00 1.21 H new ATOM 0 HA3 GLY A 70 7.944 -0.794 0.706 1.00 1.21 H new ATOM 1026 N PRO A 71 11.116 -1.110 1.202 1.00 2.23 N ATOM 1027 CA PRO A 71 12.361 -1.219 0.475 1.00 2.62 C ATOM 1028 C PRO A 71 12.151 -2.216 -0.670 1.00 1.82 C ATOM 1029 O PRO A 71 11.024 -2.626 -0.941 1.00 1.47 O ATOM 1030 CB PRO A 71 13.360 -1.699 1.525 1.00 3.52 C ATOM 1031 CG PRO A 71 12.513 -2.630 2.393 1.00 3.47 C ATOM 1032 CD PRO A 71 11.109 -2.025 2.319 1.00 2.71 C ATOM 0 HA PRO A 71 12.717 -0.297 0.015 1.00 2.62 H new ATOM 0 HB2 PRO A 71 14.203 -2.222 1.073 1.00 3.52 H new ATOM 0 HB3 PRO A 71 13.771 -0.870 2.102 1.00 3.52 H new ATOM 0 HG2 PRO A 71 12.528 -3.652 2.015 1.00 3.47 H new ATOM 0 HG3 PRO A 71 12.880 -2.664 3.419 1.00 3.47 H new ATOM 0 HD2 PRO A 71 10.358 -2.803 2.179 1.00 2.71 H new ATOM 0 HD3 PRO A 71 10.861 -1.506 3.245 1.00 2.71 H new ATOM 1040 N ASN A 72 13.216 -2.617 -1.366 1.00 1.72 N ATOM 1041 CA ASN A 72 13.093 -3.454 -2.550 1.00 1.21 C ATOM 1042 C ASN A 72 13.893 -4.720 -2.309 1.00 1.07 C ATOM 1043 O ASN A 72 15.103 -4.621 -2.156 1.00 1.16 O ATOM 1044 CB ASN A 72 13.579 -2.727 -3.824 1.00 1.72 C ATOM 1045 CG ASN A 72 14.983 -2.145 -3.725 1.00 2.38 C ATOM 1046 OD1 ASN A 72 15.929 -2.663 -4.310 1.00 4.10 O ATOM 1047 ND2 ASN A 72 15.124 -1.031 -3.017 1.00 2.60 N ATOM 0 H ASN A 72 14.176 -2.372 -1.125 1.00 1.72 H new ATOM 0 HA ASN A 72 12.043 -3.693 -2.718 1.00 1.21 H new ATOM 0 HB2 ASN A 72 13.548 -3.426 -4.660 1.00 1.72 H new ATOM 0 HB3 ASN A 72 12.882 -1.922 -4.056 1.00 1.72 H new ATOM 0 HD21 ASN A 72 16.037 -0.582 -2.949 1.00 2.60 H new ATOM 0 HD22 ASN A 72 14.319 -0.624 -2.541 1.00 2.60 H new ATOM 1054 N PHE A 73 13.254 -5.898 -2.294 1.00 0.93 N ATOM 1055 CA PHE A 73 13.964 -7.165 -2.092 1.00 0.88 C ATOM 1056 C PHE A 73 15.050 -7.344 -3.155 1.00 0.83 C ATOM 1057 O PHE A 73 16.056 -7.995 -2.906 1.00 0.88 O ATOM 1058 CB PHE A 73 12.984 -8.351 -2.042 1.00 0.88 C ATOM 1059 CG PHE A 73 13.607 -9.737 -2.033 1.00 1.78 C ATOM 1060 CD1 PHE A 73 14.688 -10.032 -1.183 1.00 3.29 C ATOM 1061 CD2 PHE A 73 13.120 -10.733 -2.902 1.00 2.72 C ATOM 1062 CE1 PHE A 73 15.323 -11.283 -1.254 1.00 4.53 C ATOM 1063 CE2 PHE A 73 13.732 -11.997 -2.946 1.00 3.87 C ATOM 1064 CZ PHE A 73 14.847 -12.268 -2.135 1.00 4.52 C ATOM 0 H PHE A 73 12.247 -5.998 -2.420 1.00 0.93 H new ATOM 0 HA PHE A 73 14.462 -7.137 -1.123 1.00 0.88 H new ATOM 0 HB2 PHE A 73 12.366 -8.247 -1.150 1.00 0.88 H new ATOM 0 HB3 PHE A 73 12.317 -8.281 -2.901 1.00 0.88 H new ATOM 0 HD1 PHE A 73 15.031 -9.294 -0.473 1.00 3.29 H new ATOM 0 HD2 PHE A 73 12.272 -10.524 -3.537 1.00 2.72 H new ATOM 0 HE1 PHE A 73 16.180 -11.488 -0.629 1.00 4.53 H new ATOM 0 HE2 PHE A 73 13.345 -12.761 -3.604 1.00 3.87 H new ATOM 0 HZ PHE A 73 15.336 -13.229 -2.189 1.00 4.52 H new ATOM 1074 N ASN A 74 14.914 -6.679 -4.303 1.00 0.83 N ATOM 1075 CA ASN A 74 15.973 -6.594 -5.299 1.00 0.91 C ATOM 1076 C ASN A 74 17.357 -6.278 -4.713 1.00 1.05 C ATOM 1077 O ASN A 74 18.355 -6.822 -5.178 1.00 1.18 O ATOM 1078 CB ASN A 74 15.564 -5.554 -6.342 1.00 0.96 C ATOM 1079 CG ASN A 74 16.617 -5.411 -7.426 1.00 1.25 C ATOM 1080 OD1 ASN A 74 16.776 -6.289 -8.262 1.00 2.23 O ATOM 1081 ND2 ASN A 74 17.330 -4.293 -7.442 1.00 1.75 N ATOM 0 H ASN A 74 14.062 -6.184 -4.565 1.00 0.83 H new ATOM 0 HA ASN A 74 16.084 -7.578 -5.755 1.00 0.91 H new ATOM 0 HB2 ASN A 74 14.614 -5.842 -6.792 1.00 0.96 H new ATOM 0 HB3 ASN A 74 15.408 -4.591 -5.856 1.00 0.96 H new ATOM 0 HD21 ASN A 74 18.034 -4.147 -8.166 1.00 1.75 H new ATOM 0 HD22 ASN A 74 17.174 -3.579 -6.731 1.00 1.75 H new ATOM 1088 N LYS A 75 17.431 -5.407 -3.704 1.00 1.13 N ATOM 1089 CA LYS A 75 18.660 -5.119 -2.969 1.00 1.24 C ATOM 1090 C LYS A 75 18.427 -5.189 -1.457 1.00 1.21 C ATOM 1091 O LYS A 75 19.088 -4.491 -0.692 1.00 1.34 O ATOM 1092 CB LYS A 75 19.167 -3.731 -3.371 1.00 1.51 C ATOM 1093 CG LYS A 75 19.907 -3.707 -4.716 1.00 1.66 C ATOM 1094 CD LYS A 75 21.315 -3.139 -4.495 1.00 2.34 C ATOM 1095 CE LYS A 75 22.051 -2.932 -5.818 1.00 2.58 C ATOM 1096 NZ LYS A 75 23.416 -2.406 -5.594 1.00 3.75 N ATOM 0 H LYS A 75 16.626 -4.876 -3.372 1.00 1.13 H new ATOM 0 HA LYS A 75 19.409 -5.870 -3.220 1.00 1.24 H new ATOM 0 HB2 LYS A 75 18.321 -3.046 -3.420 1.00 1.51 H new ATOM 0 HB3 LYS A 75 19.834 -3.359 -2.593 1.00 1.51 H new ATOM 0 HG2 LYS A 75 19.967 -4.713 -5.132 1.00 1.66 H new ATOM 0 HG3 LYS A 75 19.362 -3.096 -5.436 1.00 1.66 H new ATOM 0 HD2 LYS A 75 21.246 -2.190 -3.964 1.00 2.34 H new ATOM 0 HD3 LYS A 75 21.887 -3.818 -3.862 1.00 2.34 H new ATOM 0 HE2 LYS A 75 22.107 -3.877 -6.358 1.00 2.58 H new ATOM 0 HE3 LYS A 75 21.490 -2.239 -6.445 1.00 2.58 H new ATOM 0 HZ1 LYS A 75 23.892 -2.275 -6.509 1.00 3.75 H new ATOM 0 HZ2 LYS A 75 23.359 -1.493 -5.100 1.00 3.75 H new ATOM 0 HZ3 LYS A 75 23.957 -3.080 -5.015 1.00 3.75 H new ATOM 1110 N VAL A 76 17.531 -6.058 -1.004 1.00 1.11 N ATOM 1111 CA VAL A 76 17.326 -6.309 0.420 1.00 1.17 C ATOM 1112 C VAL A 76 17.416 -7.817 0.653 1.00 1.19 C ATOM 1113 O VAL A 76 17.364 -8.591 -0.298 1.00 1.46 O ATOM 1114 CB VAL A 76 16.028 -5.607 0.888 1.00 1.16 C ATOM 1115 CG1 VAL A 76 15.022 -6.482 1.635 1.00 0.96 C ATOM 1116 CG2 VAL A 76 16.405 -4.411 1.755 1.00 1.47 C ATOM 0 H VAL A 76 16.926 -6.609 -1.612 1.00 1.11 H new ATOM 0 HA VAL A 76 18.100 -5.871 1.050 1.00 1.17 H new ATOM 0 HB VAL A 76 15.511 -5.315 -0.026 1.00 1.16 H new ATOM 0 HG11 VAL A 76 14.155 -5.883 1.913 1.00 0.96 H new ATOM 0 HG12 VAL A 76 14.705 -7.303 0.991 1.00 0.96 H new ATOM 0 HG13 VAL A 76 15.488 -6.885 2.534 1.00 0.96 H new ATOM 0 HG21 VAL A 76 15.500 -3.906 2.092 1.00 1.47 H new ATOM 0 HG22 VAL A 76 16.973 -4.753 2.620 1.00 1.47 H new ATOM 0 HG23 VAL A 76 17.012 -3.717 1.174 1.00 1.47 H new ATOM 1126 N SER A 77 17.607 -8.266 1.895 1.00 1.17 N ATOM 1127 CA SER A 77 17.592 -9.689 2.180 1.00 1.21 C ATOM 1128 C SER A 77 16.143 -10.090 2.376 1.00 1.14 C ATOM 1129 O SER A 77 15.365 -9.306 2.909 1.00 1.08 O ATOM 1130 CB SER A 77 18.392 -9.972 3.452 1.00 1.37 C ATOM 1131 OG SER A 77 18.369 -11.356 3.740 1.00 1.67 O ATOM 0 H SER A 77 17.771 -7.668 2.705 1.00 1.17 H new ATOM 0 HA SER A 77 18.042 -10.255 1.365 1.00 1.21 H new ATOM 0 HB2 SER A 77 19.421 -9.635 3.327 1.00 1.37 H new ATOM 0 HB3 SER A 77 17.973 -9.411 4.287 1.00 1.37 H new ATOM 0 HG SER A 77 18.885 -11.529 4.555 1.00 1.67 H new ATOM 1137 N GLU A 78 15.792 -11.327 2.037 1.00 1.19 N ATOM 1138 CA GLU A 78 14.468 -11.882 2.297 1.00 1.15 C ATOM 1139 C GLU A 78 14.131 -11.773 3.786 1.00 1.09 C ATOM 1140 O GLU A 78 12.975 -11.622 4.153 1.00 1.04 O ATOM 1141 CB GLU A 78 14.431 -13.341 1.806 1.00 1.28 C ATOM 1142 CG GLU A 78 13.409 -13.566 0.684 1.00 1.29 C ATOM 1143 CD GLU A 78 12.064 -14.036 1.227 1.00 1.88 C ATOM 1144 OE1 GLU A 78 11.276 -13.155 1.632 1.00 3.30 O ATOM 1145 OE2 GLU A 78 11.858 -15.270 1.236 1.00 2.17 O ATOM 0 H GLU A 78 16.424 -11.978 1.570 1.00 1.19 H new ATOM 0 HA GLU A 78 13.711 -11.316 1.754 1.00 1.15 H new ATOM 0 HB2 GLU A 78 15.422 -13.625 1.451 1.00 1.28 H new ATOM 0 HB3 GLU A 78 14.193 -13.996 2.644 1.00 1.28 H new ATOM 0 HG2 GLU A 78 13.272 -12.639 0.126 1.00 1.29 H new ATOM 0 HG3 GLU A 78 13.796 -14.305 -0.017 1.00 1.29 H new ATOM 1152 N VAL A 79 15.133 -11.807 4.666 1.00 1.13 N ATOM 1153 CA VAL A 79 14.877 -11.730 6.100 1.00 1.10 C ATOM 1154 C VAL A 79 14.390 -10.332 6.469 1.00 1.02 C ATOM 1155 O VAL A 79 13.478 -10.171 7.279 1.00 0.98 O ATOM 1156 CB VAL A 79 16.143 -12.113 6.882 1.00 1.15 C ATOM 1157 CG1 VAL A 79 15.948 -11.946 8.394 1.00 1.17 C ATOM 1158 CG2 VAL A 79 16.499 -13.576 6.593 1.00 1.19 C ATOM 0 H VAL A 79 16.118 -11.886 4.412 1.00 1.13 H new ATOM 0 HA VAL A 79 14.093 -12.438 6.368 1.00 1.10 H new ATOM 0 HB VAL A 79 16.945 -11.448 6.560 1.00 1.15 H new ATOM 0 HG11 VAL A 79 16.865 -12.227 8.912 1.00 1.17 H new ATOM 0 HG12 VAL A 79 15.709 -10.906 8.617 1.00 1.17 H new ATOM 0 HG13 VAL A 79 15.132 -12.586 8.728 1.00 1.17 H new ATOM 0 HG21 VAL A 79 17.397 -13.848 7.147 1.00 1.19 H new ATOM 0 HG22 VAL A 79 15.674 -14.219 6.900 1.00 1.19 H new ATOM 0 HG23 VAL A 79 16.679 -13.703 5.526 1.00 1.19 H new ATOM 1168 N GLU A 80 15.021 -9.306 5.901 1.00 1.02 N ATOM 1169 CA GLU A 80 14.628 -7.943 6.187 1.00 0.95 C ATOM 1170 C GLU A 80 13.296 -7.664 5.522 1.00 0.76 C ATOM 1171 O GLU A 80 12.435 -7.090 6.165 1.00 0.58 O ATOM 1172 CB GLU A 80 15.730 -6.970 5.758 1.00 1.09 C ATOM 1173 CG GLU A 80 15.314 -5.514 6.003 1.00 1.36 C ATOM 1174 CD GLU A 80 16.468 -4.547 5.738 1.00 2.87 C ATOM 1175 OE1 GLU A 80 16.295 -3.675 4.857 1.00 4.57 O ATOM 1176 OE2 GLU A 80 17.512 -4.702 6.408 1.00 3.09 O ATOM 0 H GLU A 80 15.798 -9.399 5.247 1.00 1.02 H new ATOM 0 HA GLU A 80 14.497 -7.800 7.260 1.00 0.95 H new ATOM 0 HB2 GLU A 80 16.645 -7.187 6.310 1.00 1.09 H new ATOM 0 HB3 GLU A 80 15.954 -7.114 4.701 1.00 1.09 H new ATOM 0 HG2 GLU A 80 14.472 -5.262 5.358 1.00 1.36 H new ATOM 0 HG3 GLU A 80 14.973 -5.401 7.032 1.00 1.36 H new ATOM 1183 N GLY A 81 13.081 -8.081 4.278 1.00 0.85 N ATOM 1184 CA GLY A 81 11.823 -7.823 3.603 1.00 0.73 C ATOM 1185 C GLY A 81 10.665 -8.616 4.187 1.00 0.67 C ATOM 1186 O GLY A 81 9.528 -8.180 4.067 1.00 0.57 O ATOM 0 H GLY A 81 13.763 -8.597 3.722 1.00 0.85 H new ATOM 0 HA2 GLY A 81 11.595 -6.759 3.664 1.00 0.73 H new ATOM 0 HA3 GLY A 81 11.927 -8.067 2.546 1.00 0.73 H new ATOM 1190 N ASP A 82 10.919 -9.754 4.825 1.00 0.75 N ATOM 1191 CA ASP A 82 9.905 -10.482 5.576 1.00 0.75 C ATOM 1192 C ASP A 82 9.416 -9.585 6.704 1.00 0.65 C ATOM 1193 O ASP A 82 8.231 -9.266 6.805 1.00 0.59 O ATOM 1194 CB ASP A 82 10.512 -11.793 6.102 1.00 0.97 C ATOM 1195 CG ASP A 82 9.755 -12.392 7.287 1.00 1.25 C ATOM 1196 OD1 ASP A 82 8.526 -12.571 7.171 1.00 1.56 O ATOM 1197 OD2 ASP A 82 10.427 -12.671 8.309 1.00 2.34 O ATOM 0 H ASP A 82 11.837 -10.198 4.835 1.00 0.75 H new ATOM 0 HA ASP A 82 9.054 -10.744 4.948 1.00 0.75 H new ATOM 0 HB2 ASP A 82 10.536 -12.522 5.292 1.00 0.97 H new ATOM 0 HB3 ASP A 82 11.545 -11.611 6.397 1.00 0.97 H new ATOM 1202 N LYS A 83 10.348 -9.107 7.529 1.00 0.67 N ATOM 1203 CA LYS A 83 9.950 -8.304 8.674 1.00 0.57 C ATOM 1204 C LYS A 83 9.337 -7.006 8.201 1.00 0.49 C ATOM 1205 O LYS A 83 8.315 -6.610 8.734 1.00 0.44 O ATOM 1206 CB LYS A 83 11.106 -8.031 9.639 1.00 0.62 C ATOM 1207 CG LYS A 83 11.215 -9.138 10.695 1.00 0.73 C ATOM 1208 CD LYS A 83 11.894 -10.398 10.158 1.00 1.71 C ATOM 1209 CE LYS A 83 11.414 -11.614 10.952 1.00 2.67 C ATOM 1210 NZ LYS A 83 12.075 -12.846 10.486 1.00 4.47 N ATOM 0 H LYS A 83 11.352 -9.258 7.428 1.00 0.67 H new ATOM 0 HA LYS A 83 9.211 -8.879 9.231 1.00 0.57 H new ATOM 0 HB2 LYS A 83 12.040 -7.962 9.082 1.00 0.62 H new ATOM 0 HB3 LYS A 83 10.955 -7.069 10.130 1.00 0.62 H new ATOM 0 HG2 LYS A 83 11.776 -8.764 11.551 1.00 0.73 H new ATOM 0 HG3 LYS A 83 10.218 -9.392 11.054 1.00 0.73 H new ATOM 0 HD2 LYS A 83 11.662 -10.526 9.101 1.00 1.71 H new ATOM 0 HD3 LYS A 83 12.977 -10.303 10.238 1.00 1.71 H new ATOM 0 HE2 LYS A 83 11.621 -11.465 12.012 1.00 2.67 H new ATOM 0 HE3 LYS A 83 10.334 -11.716 10.849 1.00 2.67 H new ATOM 0 HZ1 LYS A 83 11.935 -13.602 11.187 1.00 4.47 H new ATOM 0 HZ2 LYS A 83 11.664 -13.137 9.576 1.00 4.47 H new ATOM 0 HZ3 LYS A 83 13.093 -12.670 10.366 1.00 4.47 H new ATOM 1224 N GLN A 84 9.925 -6.350 7.206 1.00 0.50 N ATOM 1225 CA GLN A 84 9.450 -5.075 6.704 1.00 0.49 C ATOM 1226 C GLN A 84 8.048 -5.276 6.163 1.00 0.42 C ATOM 1227 O GLN A 84 7.195 -4.422 6.355 1.00 0.42 O ATOM 1228 CB GLN A 84 10.415 -4.490 5.654 1.00 0.59 C ATOM 1229 CG GLN A 84 10.023 -4.723 4.187 1.00 2.83 C ATOM 1230 CD GLN A 84 8.867 -3.840 3.726 1.00 4.10 C ATOM 1231 OE1 GLN A 84 8.748 -2.705 4.155 1.00 3.33 O ATOM 1232 NE2 GLN A 84 8.020 -4.320 2.823 1.00 6.23 N ATOM 0 H GLN A 84 10.754 -6.697 6.723 1.00 0.50 H new ATOM 0 HA GLN A 84 9.416 -4.340 7.508 1.00 0.49 H new ATOM 0 HB2 GLN A 84 10.499 -3.416 5.823 1.00 0.59 H new ATOM 0 HB3 GLN A 84 11.404 -4.917 5.819 1.00 0.59 H new ATOM 0 HG2 GLN A 84 10.889 -4.537 3.552 1.00 2.83 H new ATOM 0 HG3 GLN A 84 9.748 -5.769 4.053 1.00 2.83 H new ATOM 0 HE21 GLN A 84 8.132 -5.272 2.473 1.00 6.23 H new ATOM 0 HE22 GLN A 84 7.257 -3.737 2.479 1.00 6.23 H new ATOM 1241 N LEU A 85 7.796 -6.384 5.462 1.00 0.42 N ATOM 1242 CA LEU A 85 6.490 -6.573 4.859 1.00 0.43 C ATOM 1243 C LEU A 85 5.463 -6.712 5.972 1.00 0.42 C ATOM 1244 O LEU A 85 4.374 -6.149 5.880 1.00 0.45 O ATOM 1245 CB LEU A 85 6.522 -7.766 3.894 1.00 0.49 C ATOM 1246 CG LEU A 85 5.218 -7.956 3.110 1.00 0.50 C ATOM 1247 CD1 LEU A 85 4.815 -6.670 2.380 1.00 0.81 C ATOM 1248 CD2 LEU A 85 5.415 -9.061 2.069 1.00 0.82 C ATOM 0 H LEU A 85 8.463 -7.140 5.305 1.00 0.42 H new ATOM 0 HA LEU A 85 6.204 -5.712 4.254 1.00 0.43 H new ATOM 0 HB2 LEU A 85 7.343 -7.631 3.190 1.00 0.49 H new ATOM 0 HB3 LEU A 85 6.732 -8.674 4.459 1.00 0.49 H new ATOM 0 HG LEU A 85 4.432 -8.221 3.818 1.00 0.50 H new ATOM 0 HD11 LEU A 85 3.887 -6.837 1.834 1.00 0.81 H new ATOM 0 HD12 LEU A 85 4.670 -5.870 3.106 1.00 0.81 H new ATOM 0 HD13 LEU A 85 5.602 -6.387 1.681 1.00 0.81 H new ATOM 0 HD21 LEU A 85 4.491 -9.201 1.508 1.00 0.82 H new ATOM 0 HD22 LEU A 85 6.215 -8.778 1.385 1.00 0.82 H new ATOM 0 HD23 LEU A 85 5.679 -9.991 2.572 1.00 0.82 H new ATOM 1260 N ALA A 86 5.822 -7.401 7.057 1.00 0.41 N ATOM 1261 CA ALA A 86 4.929 -7.509 8.196 1.00 0.41 C ATOM 1262 C ALA A 86 4.852 -6.203 8.975 1.00 0.38 C ATOM 1263 O ALA A 86 3.828 -5.946 9.579 1.00 0.40 O ATOM 1264 CB ALA A 86 5.396 -8.644 9.109 1.00 0.43 C ATOM 0 H ALA A 86 6.714 -7.884 7.164 1.00 0.41 H new ATOM 0 HA ALA A 86 3.928 -7.728 7.824 1.00 0.41 H new ATOM 0 HB1 ALA A 86 4.724 -8.723 9.964 1.00 0.43 H new ATOM 0 HB2 ALA A 86 5.390 -9.583 8.555 1.00 0.43 H new ATOM 0 HB3 ALA A 86 6.407 -8.436 9.460 1.00 0.43 H new ATOM 1270 N GLU A 87 5.889 -5.371 8.977 1.00 0.36 N ATOM 1271 CA GLU A 87 5.926 -4.109 9.703 1.00 0.35 C ATOM 1272 C GLU A 87 5.056 -3.082 8.996 1.00 0.36 C ATOM 1273 O GLU A 87 4.364 -2.295 9.639 1.00 0.36 O ATOM 1274 CB GLU A 87 7.372 -3.608 9.803 1.00 0.35 C ATOM 1275 CG GLU A 87 8.086 -4.206 11.019 1.00 0.41 C ATOM 1276 CD GLU A 87 9.077 -3.212 11.622 1.00 0.81 C ATOM 1277 OE1 GLU A 87 8.596 -2.243 12.254 1.00 2.39 O ATOM 1278 OE2 GLU A 87 10.295 -3.428 11.439 1.00 1.58 O ATOM 0 H GLU A 87 6.748 -5.562 8.460 1.00 0.36 H new ATOM 0 HA GLU A 87 5.539 -4.261 10.710 1.00 0.35 H new ATOM 0 HB2 GLU A 87 7.914 -3.871 8.895 1.00 0.35 H new ATOM 0 HB3 GLU A 87 7.378 -2.520 9.874 1.00 0.35 H new ATOM 0 HG2 GLU A 87 7.351 -4.492 11.771 1.00 0.41 H new ATOM 0 HG3 GLU A 87 8.612 -5.115 10.725 1.00 0.41 H new ATOM 1285 N ALA A 88 5.051 -3.115 7.668 1.00 0.38 N ATOM 1286 CA ALA A 88 4.195 -2.278 6.853 1.00 0.41 C ATOM 1287 C ALA A 88 2.760 -2.705 7.128 1.00 0.42 C ATOM 1288 O ALA A 88 1.928 -1.894 7.523 1.00 0.45 O ATOM 1289 CB ALA A 88 4.567 -2.432 5.375 1.00 0.41 C ATOM 0 H ALA A 88 5.652 -3.735 7.125 1.00 0.38 H new ATOM 0 HA ALA A 88 4.315 -1.222 7.097 1.00 0.41 H new ATOM 0 HB1 ALA A 88 3.919 -1.799 4.769 1.00 0.41 H new ATOM 0 HB2 ALA A 88 5.605 -2.134 5.228 1.00 0.41 H new ATOM 0 HB3 ALA A 88 4.442 -3.472 5.075 1.00 0.41 H new ATOM 1295 N TYR A 89 2.481 -3.998 6.965 1.00 0.42 N ATOM 1296 CA TYR A 89 1.179 -4.577 7.218 1.00 0.43 C ATOM 1297 C TYR A 89 0.738 -4.423 8.666 1.00 0.41 C ATOM 1298 O TYR A 89 -0.456 -4.334 8.910 1.00 0.43 O ATOM 1299 CB TYR A 89 1.205 -6.042 6.762 1.00 0.45 C ATOM 1300 CG TYR A 89 1.097 -6.241 5.257 1.00 0.50 C ATOM 1301 CD1 TYR A 89 0.319 -5.377 4.457 1.00 1.60 C ATOM 1302 CD2 TYR A 89 1.811 -7.288 4.643 1.00 1.79 C ATOM 1303 CE1 TYR A 89 0.323 -5.502 3.060 1.00 1.62 C ATOM 1304 CE2 TYR A 89 1.786 -7.442 3.246 1.00 1.81 C ATOM 1305 CZ TYR A 89 1.062 -6.530 2.450 1.00 0.60 C ATOM 1306 OH TYR A 89 1.050 -6.644 1.098 1.00 0.66 O ATOM 0 H TYR A 89 3.172 -4.678 6.647 1.00 0.42 H new ATOM 0 HA TYR A 89 0.428 -4.034 6.644 1.00 0.43 H new ATOM 0 HB2 TYR A 89 2.131 -6.500 7.110 1.00 0.45 H new ATOM 0 HB3 TYR A 89 0.385 -6.573 7.245 1.00 0.45 H new ATOM 0 HD1 TYR A 89 -0.285 -4.613 4.924 1.00 1.60 H new ATOM 0 HD2 TYR A 89 2.381 -7.977 5.249 1.00 1.79 H new ATOM 0 HE1 TYR A 89 -0.241 -4.809 2.454 1.00 1.62 H new ATOM 0 HE2 TYR A 89 2.321 -8.258 2.783 1.00 1.81 H new ATOM 0 HH TYR A 89 0.607 -7.481 0.844 1.00 0.66 H new ATOM 1316 N GLU A 90 1.647 -4.343 9.631 1.00 0.39 N ATOM 1317 CA GLU A 90 1.299 -4.138 11.022 1.00 0.40 C ATOM 1318 C GLU A 90 1.053 -2.673 11.300 1.00 0.34 C ATOM 1319 O GLU A 90 0.230 -2.344 12.151 1.00 0.36 O ATOM 1320 CB GLU A 90 2.410 -4.614 11.961 1.00 0.51 C ATOM 1321 CG GLU A 90 2.203 -6.071 12.371 1.00 1.45 C ATOM 1322 CD GLU A 90 2.861 -6.347 13.726 1.00 1.88 C ATOM 1323 OE1 GLU A 90 3.676 -7.291 13.801 1.00 3.14 O ATOM 1324 OE2 GLU A 90 2.531 -5.593 14.673 1.00 1.83 O ATOM 0 H GLU A 90 2.650 -4.420 9.464 1.00 0.39 H new ATOM 0 HA GLU A 90 0.395 -4.719 11.205 1.00 0.40 H new ATOM 0 HB2 GLU A 90 3.376 -4.506 11.469 1.00 0.51 H new ATOM 0 HB3 GLU A 90 2.433 -3.983 12.850 1.00 0.51 H new ATOM 0 HG2 GLU A 90 1.137 -6.291 12.427 1.00 1.45 H new ATOM 0 HG3 GLU A 90 2.626 -6.731 11.614 1.00 1.45 H new ATOM 1331 N SER A 91 1.777 -1.776 10.640 1.00 0.37 N ATOM 1332 CA SER A 91 1.485 -0.370 10.774 1.00 0.38 C ATOM 1333 C SER A 91 0.086 -0.144 10.227 1.00 0.40 C ATOM 1334 O SER A 91 -0.722 0.519 10.862 1.00 0.47 O ATOM 1335 CB SER A 91 2.512 0.494 10.035 1.00 0.47 C ATOM 1336 OG SER A 91 3.810 0.386 10.589 1.00 0.89 O ATOM 0 H SER A 91 2.555 -2.000 10.020 1.00 0.37 H new ATOM 0 HA SER A 91 1.539 -0.076 11.822 1.00 0.38 H new ATOM 0 HB2 SER A 91 2.542 0.199 8.986 1.00 0.47 H new ATOM 0 HB3 SER A 91 2.194 1.536 10.064 1.00 0.47 H new ATOM 0 HG SER A 91 4.193 -0.486 10.357 1.00 0.89 H new ATOM 1342 N ILE A 92 -0.226 -0.721 9.068 1.00 0.39 N ATOM 1343 CA ILE A 92 -1.477 -0.446 8.393 1.00 0.40 C ATOM 1344 C ILE A 92 -2.610 -1.147 9.138 1.00 0.43 C ATOM 1345 O ILE A 92 -3.660 -0.556 9.345 1.00 0.46 O ATOM 1346 CB ILE A 92 -1.349 -0.820 6.899 1.00 0.42 C ATOM 1347 CG1 ILE A 92 -0.995 0.422 6.064 1.00 0.50 C ATOM 1348 CG2 ILE A 92 -2.618 -1.415 6.309 1.00 0.47 C ATOM 1349 CD1 ILE A 92 0.500 0.705 6.121 1.00 0.74 C ATOM 0 H ILE A 92 0.378 -1.383 8.581 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.721 0.616 8.408 1.00 0.40 H new ATOM 0 HB ILE A 92 -0.562 -1.574 6.858 1.00 0.42 H new ATOM 0 HG12 ILE A 92 -1.301 0.269 5.029 1.00 0.50 H new ATOM 0 HG13 ILE A 92 -1.547 1.285 6.436 1.00 0.50 H new ATOM 0 HG21 ILE A 92 -2.454 -1.653 5.258 1.00 0.47 H new ATOM 0 HG22 ILE A 92 -2.879 -2.324 6.850 1.00 0.47 H new ATOM 0 HG23 ILE A 92 -3.432 -0.695 6.395 1.00 0.47 H new ATOM 0 HD11 ILE A 92 0.726 1.588 5.523 1.00 0.74 H new ATOM 0 HD12 ILE A 92 0.798 0.881 7.155 1.00 0.74 H new ATOM 0 HD13 ILE A 92 1.048 -0.151 5.726 1.00 0.74 H new ATOM 1361 N ALA A 93 -2.411 -2.392 9.565 1.00 0.46 N ATOM 1362 CA ALA A 93 -3.446 -3.180 10.217 1.00 0.49 C ATOM 1363 C ALA A 93 -3.754 -2.583 11.582 1.00 0.48 C ATOM 1364 O ALA A 93 -4.918 -2.384 11.929 1.00 0.50 O ATOM 1365 CB ALA A 93 -3.018 -4.645 10.340 1.00 0.59 C ATOM 0 H ALA A 93 -1.522 -2.882 9.466 1.00 0.46 H new ATOM 0 HA ALA A 93 -4.351 -3.154 9.609 1.00 0.49 H new ATOM 0 HB1 ALA A 93 -3.807 -5.215 10.830 1.00 0.59 H new ATOM 0 HB2 ALA A 93 -2.837 -5.056 9.347 1.00 0.59 H new ATOM 0 HB3 ALA A 93 -2.104 -4.709 10.931 1.00 0.59 H new ATOM 1371 N LYS A 94 -2.723 -2.256 12.368 1.00 0.49 N ATOM 1372 CA LYS A 94 -2.984 -1.597 13.636 1.00 0.52 C ATOM 1373 C LYS A 94 -3.662 -0.259 13.371 1.00 0.50 C ATOM 1374 O LYS A 94 -4.628 0.047 14.054 1.00 0.54 O ATOM 1375 CB LYS A 94 -1.727 -1.498 14.513 1.00 0.55 C ATOM 1376 CG LYS A 94 -1.381 -2.906 15.029 1.00 1.27 C ATOM 1377 CD LYS A 94 -0.211 -2.962 16.023 1.00 1.83 C ATOM 1378 CE LYS A 94 1.110 -3.327 15.342 1.00 2.62 C ATOM 1379 NZ LYS A 94 1.717 -2.198 14.614 1.00 3.87 N ATOM 0 H LYS A 94 -1.741 -2.431 12.155 1.00 0.49 H new ATOM 0 HA LYS A 94 -3.670 -2.204 14.226 1.00 0.52 H new ATOM 0 HB2 LYS A 94 -0.895 -1.090 13.939 1.00 0.55 H new ATOM 0 HB3 LYS A 94 -1.900 -0.820 15.349 1.00 0.55 H new ATOM 0 HG2 LYS A 94 -2.265 -3.329 15.506 1.00 1.27 H new ATOM 0 HG3 LYS A 94 -1.144 -3.542 14.176 1.00 1.27 H new ATOM 0 HD2 LYS A 94 -0.109 -1.995 16.516 1.00 1.83 H new ATOM 0 HD3 LYS A 94 -0.431 -3.694 16.800 1.00 1.83 H new ATOM 0 HE2 LYS A 94 1.812 -3.686 16.094 1.00 2.62 H new ATOM 0 HE3 LYS A 94 0.939 -4.149 14.647 1.00 2.62 H new ATOM 0 HZ1 LYS A 94 2.704 -2.427 14.379 1.00 3.87 H new ATOM 0 HZ2 LYS A 94 1.184 -2.023 13.738 1.00 3.87 H new ATOM 0 HZ3 LYS A 94 1.692 -1.347 15.211 1.00 3.87 H new ATOM 1393 N ILE A 95 -3.246 0.501 12.354 1.00 0.46 N ATOM 1394 CA ILE A 95 -3.888 1.779 12.031 1.00 0.45 C ATOM 1395 C ILE A 95 -5.348 1.569 11.631 1.00 0.47 C ATOM 1396 O ILE A 95 -6.194 2.408 11.913 1.00 0.49 O ATOM 1397 CB ILE A 95 -3.086 2.534 10.949 1.00 0.45 C ATOM 1398 CG1 ILE A 95 -1.852 3.181 11.611 1.00 0.62 C ATOM 1399 CG2 ILE A 95 -3.909 3.623 10.239 1.00 0.79 C ATOM 1400 CD1 ILE A 95 -0.822 3.693 10.596 1.00 0.58 C ATOM 0 H ILE A 95 -2.469 0.254 11.741 1.00 0.46 H new ATOM 0 HA ILE A 95 -3.890 2.404 12.924 1.00 0.45 H new ATOM 0 HB ILE A 95 -2.797 1.808 10.189 1.00 0.45 H new ATOM 0 HG12 ILE A 95 -2.177 4.010 12.239 1.00 0.62 H new ATOM 0 HG13 ILE A 95 -1.375 2.452 12.267 1.00 0.62 H new ATOM 0 HG21 ILE A 95 -3.290 4.117 9.490 1.00 0.79 H new ATOM 0 HG22 ILE A 95 -4.772 3.168 9.753 1.00 0.79 H new ATOM 0 HG23 ILE A 95 -4.249 4.357 10.970 1.00 0.79 H new ATOM 0 HD11 ILE A 95 0.021 4.137 11.126 1.00 0.58 H new ATOM 0 HD12 ILE A 95 -0.470 2.862 9.984 1.00 0.58 H new ATOM 0 HD13 ILE A 95 -1.284 4.444 9.956 1.00 0.58 H new ATOM 1412 N VAL A 96 -5.674 0.461 10.973 1.00 0.49 N ATOM 1413 CA VAL A 96 -7.026 0.170 10.527 1.00 0.51 C ATOM 1414 C VAL A 96 -7.915 -0.012 11.746 1.00 0.54 C ATOM 1415 O VAL A 96 -9.054 0.444 11.761 1.00 0.55 O ATOM 1416 CB VAL A 96 -7.003 -1.055 9.589 1.00 0.56 C ATOM 1417 CG1 VAL A 96 -8.330 -1.821 9.524 1.00 0.70 C ATOM 1418 CG2 VAL A 96 -6.649 -0.605 8.168 1.00 0.58 C ATOM 0 H VAL A 96 -4.999 -0.265 10.734 1.00 0.49 H new ATOM 0 HA VAL A 96 -7.442 0.994 9.948 1.00 0.51 H new ATOM 0 HB VAL A 96 -6.256 -1.731 10.005 1.00 0.56 H new ATOM 0 HG11 VAL A 96 -8.229 -2.666 8.844 1.00 0.70 H new ATOM 0 HG12 VAL A 96 -8.589 -2.184 10.518 1.00 0.70 H new ATOM 0 HG13 VAL A 96 -9.116 -1.157 9.164 1.00 0.70 H new ATOM 0 HG21 VAL A 96 -6.633 -1.471 7.506 1.00 0.58 H new ATOM 0 HG22 VAL A 96 -7.395 0.108 7.816 1.00 0.58 H new ATOM 0 HG23 VAL A 96 -5.667 -0.131 8.170 1.00 0.58 H new ATOM 1428 N ASN A 97 -7.401 -0.652 12.791 1.00 0.59 N ATOM 1429 CA ASN A 97 -8.194 -0.896 13.984 1.00 0.67 C ATOM 1430 C ASN A 97 -8.292 0.384 14.798 1.00 0.67 C ATOM 1431 O ASN A 97 -9.347 0.693 15.350 1.00 0.73 O ATOM 1432 CB ASN A 97 -7.546 -2.002 14.838 1.00 0.73 C ATOM 1433 CG ASN A 97 -8.463 -3.199 15.057 1.00 0.95 C ATOM 1434 OD1 ASN A 97 -9.653 -3.155 14.782 1.00 1.51 O ATOM 1435 ND2 ASN A 97 -7.917 -4.298 15.562 1.00 1.37 N ATOM 0 H ASN A 97 -6.446 -1.008 12.834 1.00 0.59 H new ATOM 0 HA ASN A 97 -9.192 -1.219 13.686 1.00 0.67 H new ATOM 0 HB2 ASN A 97 -6.629 -2.338 14.353 1.00 0.73 H new ATOM 0 HB3 ASN A 97 -7.262 -1.587 15.805 1.00 0.73 H new ATOM 0 HD21 ASN A 97 -8.492 -5.124 15.727 1.00 1.37 H new ATOM 0 HD22 ASN A 97 -6.922 -4.317 15.786 1.00 1.37 H new ATOM 1442 N ASP A 98 -7.177 1.117 14.853 1.00 0.63 N ATOM 1443 CA ASP A 98 -6.981 2.311 15.667 1.00 0.67 C ATOM 1444 C ASP A 98 -7.906 3.413 15.171 1.00 0.66 C ATOM 1445 O ASP A 98 -8.533 4.131 15.944 1.00 0.73 O ATOM 1446 CB ASP A 98 -5.513 2.753 15.569 1.00 0.69 C ATOM 1447 CG ASP A 98 -5.133 3.727 16.678 1.00 1.17 C ATOM 1448 OD1 ASP A 98 -5.367 3.360 17.851 1.00 2.08 O ATOM 1449 OD2 ASP A 98 -4.566 4.789 16.341 1.00 2.35 O ATOM 0 H ASP A 98 -6.350 0.880 14.304 1.00 0.63 H new ATOM 0 HA ASP A 98 -7.216 2.099 16.710 1.00 0.67 H new ATOM 0 HB2 ASP A 98 -4.867 1.877 15.619 1.00 0.69 H new ATOM 0 HB3 ASP A 98 -5.340 3.222 14.600 1.00 0.69 H new ATOM 1454 N ASN A 99 -8.025 3.512 13.847 1.00 0.58 N ATOM 1455 CA ASN A 99 -8.945 4.442 13.207 1.00 0.59 C ATOM 1456 C ASN A 99 -10.316 3.803 13.010 1.00 0.61 C ATOM 1457 O ASN A 99 -11.269 4.473 12.614 1.00 0.64 O ATOM 1458 CB ASN A 99 -8.380 4.876 11.858 1.00 0.55 C ATOM 1459 CG ASN A 99 -8.629 6.358 11.604 1.00 0.74 C ATOM 1460 OD1 ASN A 99 -7.728 7.097 11.227 1.00 0.90 O ATOM 1461 ND2 ASN A 99 -9.855 6.836 11.764 1.00 2.21 N ATOM 0 H ASN A 99 -7.485 2.948 13.191 1.00 0.58 H new ATOM 0 HA ASN A 99 -9.061 5.312 13.853 1.00 0.59 H new ATOM 0 HB2 ASN A 99 -7.309 4.675 11.828 1.00 0.55 H new ATOM 0 HB3 ASN A 99 -8.837 4.287 11.063 1.00 0.55 H new ATOM 0 HD21 ASN A 99 -10.048 7.819 11.573 1.00 2.21 H new ATOM 0 HD22 ASN A 99 -10.605 6.221 12.078 1.00 2.21 H new ATOM 1468 N ASN A 100 -10.401 2.502 13.274 1.00 0.64 N ATOM 1469 CA ASN A 100 -11.607 1.704 13.236 1.00 0.69 C ATOM 1470 C ASN A 100 -12.295 1.810 11.883 1.00 0.62 C ATOM 1471 O ASN A 100 -13.493 2.067 11.785 1.00 0.62 O ATOM 1472 CB ASN A 100 -12.504 2.102 14.412 1.00 0.82 C ATOM 1473 CG ASN A 100 -13.240 0.887 14.938 1.00 1.08 C ATOM 1474 OD1 ASN A 100 -14.451 0.769 14.805 1.00 1.36 O ATOM 1475 ND2 ASN A 100 -12.496 -0.036 15.537 1.00 2.27 N ATOM 0 H ASN A 100 -9.581 1.953 13.534 1.00 0.64 H new ATOM 0 HA ASN A 100 -11.362 0.648 13.350 1.00 0.69 H new ATOM 0 HB2 ASN A 100 -11.902 2.544 15.206 1.00 0.82 H new ATOM 0 HB3 ASN A 100 -13.219 2.861 14.094 1.00 0.82 H new ATOM 0 HD21 ASN A 100 -12.931 -0.881 15.906 1.00 2.27 H new ATOM 0 HD22 ASN A 100 -11.489 0.100 15.628 1.00 2.27 H new ATOM 1482 N TYR A 101 -11.520 1.646 10.817 1.00 0.60 N ATOM 1483 CA TYR A 101 -12.060 1.669 9.469 1.00 0.61 C ATOM 1484 C TYR A 101 -12.909 0.438 9.183 1.00 0.84 C ATOM 1485 O TYR A 101 -12.598 -0.673 9.599 1.00 1.14 O ATOM 1486 CB TYR A 101 -10.932 1.793 8.454 1.00 0.72 C ATOM 1487 CG TYR A 101 -10.099 3.058 8.569 1.00 0.57 C ATOM 1488 CD1 TYR A 101 -10.709 4.305 8.816 1.00 2.03 C ATOM 1489 CD2 TYR A 101 -8.709 2.995 8.370 1.00 1.98 C ATOM 1490 CE1 TYR A 101 -9.945 5.484 8.793 1.00 2.11 C ATOM 1491 CE2 TYR A 101 -7.936 4.167 8.362 1.00 2.03 C ATOM 1492 CZ TYR A 101 -8.554 5.422 8.550 1.00 0.87 C ATOM 1493 OH TYR A 101 -7.803 6.557 8.478 1.00 1.20 O ATOM 0 H TYR A 101 -10.512 1.495 10.864 1.00 0.60 H new ATOM 0 HA TYR A 101 -12.710 2.539 9.383 1.00 0.61 H new ATOM 0 HB2 TYR A 101 -10.273 0.931 8.559 1.00 0.72 H new ATOM 0 HB3 TYR A 101 -11.359 1.747 7.452 1.00 0.72 H new ATOM 0 HD1 TYR A 101 -11.768 4.354 9.024 1.00 2.03 H new ATOM 0 HD2 TYR A 101 -8.232 2.037 8.222 1.00 1.98 H new ATOM 0 HE1 TYR A 101 -10.421 6.439 8.961 1.00 2.11 H new ATOM 0 HE2 TYR A 101 -6.868 4.108 8.212 1.00 2.03 H new ATOM 0 HH TYR A 101 -7.635 6.896 9.382 1.00 1.20 H new ATOM 1503 N LYS A 102 -13.996 0.668 8.445 1.00 0.85 N ATOM 1504 CA LYS A 102 -14.907 -0.350 7.970 1.00 1.14 C ATOM 1505 C LYS A 102 -14.402 -0.896 6.641 1.00 0.94 C ATOM 1506 O LYS A 102 -14.575 -2.075 6.368 1.00 1.17 O ATOM 1507 CB LYS A 102 -16.318 0.234 7.796 1.00 1.49 C ATOM 1508 CG LYS A 102 -17.053 0.493 9.122 1.00 1.82 C ATOM 1509 CD LYS A 102 -17.068 1.956 9.588 1.00 2.51 C ATOM 1510 CE LYS A 102 -15.677 2.415 10.023 1.00 2.55 C ATOM 1511 NZ LYS A 102 -15.712 3.439 11.088 1.00 3.52 N ATOM 0 H LYS A 102 -14.268 1.608 8.156 1.00 0.85 H new ATOM 0 HA LYS A 102 -14.955 -1.157 8.701 1.00 1.14 H new ATOM 0 HB2 LYS A 102 -16.247 1.170 7.242 1.00 1.49 H new ATOM 0 HB3 LYS A 102 -16.912 -0.451 7.190 1.00 1.49 H new ATOM 0 HG2 LYS A 102 -18.083 0.150 9.021 1.00 1.82 H new ATOM 0 HG3 LYS A 102 -16.590 -0.114 9.900 1.00 1.82 H new ATOM 0 HD2 LYS A 102 -17.427 2.593 8.780 1.00 2.51 H new ATOM 0 HD3 LYS A 102 -17.766 2.068 10.417 1.00 2.51 H new ATOM 0 HE2 LYS A 102 -15.110 1.553 10.374 1.00 2.55 H new ATOM 0 HE3 LYS A 102 -15.146 2.815 9.159 1.00 2.55 H new ATOM 0 HZ1 LYS A 102 -14.906 3.300 11.730 1.00 3.52 H new ATOM 0 HZ2 LYS A 102 -15.655 4.386 10.661 1.00 3.52 H new ATOM 0 HZ3 LYS A 102 -16.600 3.353 11.623 1.00 3.52 H new ATOM 1525 N SER A 103 -13.783 -0.048 5.824 1.00 0.67 N ATOM 1526 CA SER A 103 -13.202 -0.413 4.542 1.00 0.55 C ATOM 1527 C SER A 103 -12.057 0.558 4.279 1.00 0.50 C ATOM 1528 O SER A 103 -12.103 1.682 4.785 1.00 0.64 O ATOM 1529 CB SER A 103 -14.277 -0.320 3.449 1.00 0.77 C ATOM 1530 OG SER A 103 -14.949 0.924 3.500 1.00 1.31 O ATOM 0 H SER A 103 -13.670 0.941 6.046 1.00 0.67 H new ATOM 0 HA SER A 103 -12.826 -1.436 4.545 1.00 0.55 H new ATOM 0 HB2 SER A 103 -13.816 -0.448 2.470 1.00 0.77 H new ATOM 0 HB3 SER A 103 -14.996 -1.130 3.571 1.00 0.77 H new ATOM 0 HG SER A 103 -14.678 1.474 2.735 1.00 1.31 H new ATOM 1536 N VAL A 104 -11.029 0.134 3.542 1.00 0.44 N ATOM 1537 CA VAL A 104 -10.005 1.032 3.029 1.00 0.51 C ATOM 1538 C VAL A 104 -9.521 0.495 1.692 1.00 0.48 C ATOM 1539 O VAL A 104 -9.367 -0.718 1.514 1.00 0.51 O ATOM 1540 CB VAL A 104 -8.830 1.173 4.018 1.00 0.69 C ATOM 1541 CG1 VAL A 104 -7.580 1.782 3.367 1.00 1.52 C ATOM 1542 CG2 VAL A 104 -9.222 2.058 5.202 1.00 1.81 C ATOM 0 H VAL A 104 -10.887 -0.843 3.286 1.00 0.44 H new ATOM 0 HA VAL A 104 -10.431 2.027 2.900 1.00 0.51 H new ATOM 0 HB VAL A 104 -8.597 0.162 4.351 1.00 0.69 H new ATOM 0 HG11 VAL A 104 -6.784 1.858 4.108 1.00 1.52 H new ATOM 0 HG12 VAL A 104 -7.251 1.146 2.545 1.00 1.52 H new ATOM 0 HG13 VAL A 104 -7.816 2.775 2.985 1.00 1.52 H new ATOM 0 HG21 VAL A 104 -8.379 2.144 5.887 1.00 1.81 H new ATOM 0 HG22 VAL A 104 -9.498 3.048 4.840 1.00 1.81 H new ATOM 0 HG23 VAL A 104 -10.069 1.613 5.724 1.00 1.81 H new ATOM 1552 N ALA A 105 -9.187 1.415 0.784 1.00 0.53 N ATOM 1553 CA ALA A 105 -8.557 1.075 -0.466 1.00 0.53 C ATOM 1554 C ALA A 105 -7.049 0.997 -0.234 1.00 0.54 C ATOM 1555 O ALA A 105 -6.377 2.019 -0.107 1.00 0.65 O ATOM 1556 CB ALA A 105 -8.950 2.109 -1.521 1.00 0.65 C ATOM 0 H ALA A 105 -9.352 2.414 0.908 1.00 0.53 H new ATOM 0 HA ALA A 105 -8.887 0.105 -0.837 1.00 0.53 H new ATOM 0 HB1 ALA A 105 -8.477 1.858 -2.470 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -10.033 2.109 -1.644 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -8.621 3.098 -1.202 1.00 0.65 H new ATOM 1562 N ILE A 106 -6.517 -0.222 -0.180 1.00 0.59 N ATOM 1563 CA ILE A 106 -5.121 -0.529 0.068 1.00 0.70 C ATOM 1564 C ILE A 106 -4.571 -1.245 -1.168 1.00 0.72 C ATOM 1565 O ILE A 106 -4.974 -2.368 -1.459 1.00 0.99 O ATOM 1566 CB ILE A 106 -5.000 -1.330 1.386 1.00 0.98 C ATOM 1567 CG1 ILE A 106 -3.608 -1.943 1.604 1.00 1.86 C ATOM 1568 CG2 ILE A 106 -6.046 -2.452 1.507 1.00 1.24 C ATOM 1569 CD1 ILE A 106 -2.496 -0.908 1.766 1.00 3.15 C ATOM 0 H ILE A 106 -7.081 -1.061 -0.316 1.00 0.59 H new ATOM 0 HA ILE A 106 -4.515 0.365 0.214 1.00 0.70 H new ATOM 0 HB ILE A 106 -5.181 -0.583 2.159 1.00 0.98 H new ATOM 0 HG12 ILE A 106 -3.635 -2.575 2.491 1.00 1.86 H new ATOM 0 HG13 ILE A 106 -3.370 -2.589 0.759 1.00 1.86 H new ATOM 0 HG21 ILE A 106 -5.909 -2.977 2.452 1.00 1.24 H new ATOM 0 HG22 ILE A 106 -7.047 -2.022 1.473 1.00 1.24 H new ATOM 0 HG23 ILE A 106 -5.924 -3.154 0.682 1.00 1.24 H new ATOM 0 HD11 ILE A 106 -1.544 -1.417 1.916 1.00 3.15 H new ATOM 0 HD12 ILE A 106 -2.440 -0.291 0.869 1.00 3.15 H new ATOM 0 HD13 ILE A 106 -2.709 -0.277 2.629 1.00 3.15 H new ATOM 1581 N PRO A 107 -3.679 -0.606 -1.940 1.00 0.68 N ATOM 1582 CA PRO A 107 -3.090 -1.240 -3.100 1.00 0.74 C ATOM 1583 C PRO A 107 -2.051 -2.276 -2.667 1.00 0.84 C ATOM 1584 O PRO A 107 -1.766 -2.464 -1.486 1.00 1.04 O ATOM 1585 CB PRO A 107 -2.481 -0.098 -3.918 1.00 0.80 C ATOM 1586 CG PRO A 107 -2.089 0.915 -2.846 1.00 0.93 C ATOM 1587 CD PRO A 107 -3.191 0.756 -1.798 1.00 0.87 C ATOM 0 HA PRO A 107 -3.817 -1.790 -3.697 1.00 0.74 H new ATOM 0 HB2 PRO A 107 -1.618 -0.430 -4.496 1.00 0.80 H new ATOM 0 HB3 PRO A 107 -3.197 0.319 -4.626 1.00 0.80 H new ATOM 0 HG2 PRO A 107 -1.104 0.701 -2.431 1.00 0.93 H new ATOM 0 HG3 PRO A 107 -2.054 1.929 -3.244 1.00 0.93 H new ATOM 0 HD2 PRO A 107 -2.804 0.930 -0.794 1.00 0.87 H new ATOM 0 HD3 PRO A 107 -3.992 1.477 -1.960 1.00 0.87 H new ATOM 1595 N LEU A 108 -1.479 -2.962 -3.651 1.00 0.91 N ATOM 1596 CA LEU A 108 -0.567 -4.066 -3.446 1.00 1.00 C ATOM 1597 C LEU A 108 0.853 -3.559 -3.620 1.00 0.96 C ATOM 1598 O LEU A 108 1.212 -3.055 -4.681 1.00 0.95 O ATOM 1599 CB LEU A 108 -0.909 -5.156 -4.466 1.00 1.17 C ATOM 1600 CG LEU A 108 -1.840 -6.187 -3.815 1.00 1.54 C ATOM 1601 CD1 LEU A 108 -2.870 -6.727 -4.807 1.00 1.95 C ATOM 1602 CD2 LEU A 108 -0.969 -7.296 -3.232 1.00 1.96 C ATOM 0 H LEU A 108 -1.645 -2.755 -4.636 1.00 0.91 H new ATOM 0 HA LEU A 108 -0.656 -4.485 -2.444 1.00 1.00 H new ATOM 0 HB2 LEU A 108 -1.390 -4.715 -5.339 1.00 1.17 H new ATOM 0 HB3 LEU A 108 0.002 -5.642 -4.816 1.00 1.17 H new ATOM 0 HG LEU A 108 -2.419 -5.718 -3.020 1.00 1.54 H new ATOM 0 HD11 LEU A 108 -3.510 -7.454 -4.307 1.00 1.95 H new ATOM 0 HD12 LEU A 108 -3.479 -5.905 -5.183 1.00 1.95 H new ATOM 0 HD13 LEU A 108 -2.356 -7.208 -5.640 1.00 1.95 H new ATOM 0 HD21 LEU A 108 -1.603 -8.047 -2.761 1.00 1.96 H new ATOM 0 HD22 LEU A 108 -0.389 -7.760 -4.029 1.00 1.96 H new ATOM 0 HD23 LEU A 108 -0.292 -6.874 -2.489 1.00 1.96 H new ATOM 1614 N LEU A 109 1.655 -3.702 -2.569 1.00 1.15 N ATOM 1615 CA LEU A 109 3.044 -3.278 -2.551 1.00 1.20 C ATOM 1616 C LEU A 109 3.932 -4.524 -2.535 1.00 1.24 C ATOM 1617 O LEU A 109 3.435 -5.653 -2.536 1.00 1.31 O ATOM 1618 CB LEU A 109 3.317 -2.345 -1.355 1.00 1.49 C ATOM 1619 CG LEU A 109 2.324 -1.169 -1.270 1.00 1.40 C ATOM 1620 CD1 LEU A 109 1.203 -1.456 -0.266 1.00 2.09 C ATOM 1621 CD2 LEU A 109 3.041 0.107 -0.823 1.00 1.59 C ATOM 0 H LEU A 109 1.349 -4.124 -1.692 1.00 1.15 H new ATOM 0 HA LEU A 109 3.274 -2.699 -3.446 1.00 1.20 H new ATOM 0 HB2 LEU A 109 3.268 -2.923 -0.432 1.00 1.49 H new ATOM 0 HB3 LEU A 109 4.331 -1.952 -1.431 1.00 1.49 H new ATOM 0 HG LEU A 109 1.899 -1.039 -2.265 1.00 1.40 H new ATOM 0 HD11 LEU A 109 0.520 -0.607 -0.230 1.00 2.09 H new ATOM 0 HD12 LEU A 109 0.657 -2.348 -0.575 1.00 2.09 H new ATOM 0 HD13 LEU A 109 1.633 -1.618 0.723 1.00 2.09 H new ATOM 0 HD21 LEU A 109 2.325 0.927 -0.769 1.00 1.59 H new ATOM 0 HD22 LEU A 109 3.487 -0.051 0.159 1.00 1.59 H new ATOM 0 HD23 LEU A 109 3.823 0.355 -1.541 1.00 1.59 H new ATOM 1633 N SER A 110 5.252 -4.328 -2.552 1.00 1.30 N ATOM 1634 CA SER A 110 6.233 -5.404 -2.654 1.00 1.40 C ATOM 1635 C SER A 110 5.866 -6.449 -3.712 1.00 1.56 C ATOM 1636 O SER A 110 6.056 -7.640 -3.504 1.00 1.94 O ATOM 1637 CB SER A 110 6.465 -6.037 -1.285 1.00 1.72 C ATOM 1638 OG SER A 110 6.633 -5.022 -0.313 1.00 2.47 O ATOM 0 H SER A 110 5.674 -3.401 -2.494 1.00 1.30 H new ATOM 0 HA SER A 110 7.169 -4.961 -2.994 1.00 1.40 H new ATOM 0 HB2 SER A 110 5.620 -6.672 -1.019 1.00 1.72 H new ATOM 0 HB3 SER A 110 7.348 -6.676 -1.314 1.00 1.72 H new ATOM 0 HG SER A 110 7.340 -5.283 0.313 1.00 2.47 H new ATOM 1644 N THR A 111 5.357 -6.006 -4.861 1.00 1.51 N ATOM 1645 CA THR A 111 4.904 -6.848 -5.936 1.00 1.80 C ATOM 1646 C THR A 111 5.747 -6.461 -7.142 1.00 1.90 C ATOM 1647 O THR A 111 5.471 -5.436 -7.756 1.00 2.37 O ATOM 1648 CB THR A 111 3.424 -6.507 -6.134 1.00 1.82 C ATOM 1649 OG1 THR A 111 2.664 -7.024 -5.061 1.00 2.97 O ATOM 1650 CG2 THR A 111 2.870 -7.040 -7.442 1.00 1.39 C ATOM 0 H THR A 111 5.251 -5.012 -5.063 1.00 1.51 H new ATOM 0 HA THR A 111 5.002 -7.919 -5.760 1.00 1.80 H new ATOM 0 HB THR A 111 3.351 -5.420 -6.165 1.00 1.82 H new ATOM 0 HG1 THR A 111 2.910 -6.561 -4.233 1.00 2.97 H new ATOM 0 HG21 THR A 111 1.818 -6.769 -7.529 1.00 1.39 H new ATOM 0 HG22 THR A 111 3.426 -6.609 -8.275 1.00 1.39 H new ATOM 0 HG23 THR A 111 2.968 -8.125 -7.463 1.00 1.39 H new ATOM 1658 N GLY A 112 6.789 -7.232 -7.459 1.00 2.65 N ATOM 1659 CA GLY A 112 7.698 -6.967 -8.568 1.00 3.07 C ATOM 1660 C GLY A 112 8.487 -5.677 -8.350 1.00 2.41 C ATOM 1661 O GLY A 112 9.631 -5.712 -7.917 1.00 3.29 O ATOM 0 H GLY A 112 7.027 -8.076 -6.938 1.00 2.65 H new ATOM 0 HA2 GLY A 112 8.389 -7.802 -8.681 1.00 3.07 H new ATOM 0 HA3 GLY A 112 7.130 -6.895 -9.496 1.00 3.07 H new ATOM 1665 N ILE A 113 7.850 -4.534 -8.608 1.00 1.86 N ATOM 1666 CA ILE A 113 8.372 -3.175 -8.539 1.00 1.66 C ATOM 1667 C ILE A 113 9.309 -2.937 -7.346 1.00 1.35 C ATOM 1668 O ILE A 113 10.271 -2.184 -7.470 1.00 1.61 O ATOM 1669 CB ILE A 113 7.168 -2.208 -8.580 1.00 2.59 C ATOM 1670 CG1 ILE A 113 7.546 -0.779 -8.995 1.00 2.28 C ATOM 1671 CG2 ILE A 113 6.435 -2.155 -7.233 1.00 3.53 C ATOM 1672 CD1 ILE A 113 7.986 -0.709 -10.460 1.00 3.33 C ATOM 0 H ILE A 113 6.871 -4.540 -8.895 1.00 1.86 H new ATOM 0 HA ILE A 113 9.017 -2.990 -9.398 1.00 1.66 H new ATOM 0 HB ILE A 113 6.507 -2.617 -9.344 1.00 2.59 H new ATOM 0 HG12 ILE A 113 6.693 -0.118 -8.840 1.00 2.28 H new ATOM 0 HG13 ILE A 113 8.351 -0.416 -8.356 1.00 2.28 H new ATOM 0 HG21 ILE A 113 5.595 -1.464 -7.303 1.00 3.53 H new ATOM 0 HG22 ILE A 113 6.067 -3.149 -6.980 1.00 3.53 H new ATOM 0 HG23 ILE A 113 7.122 -1.814 -6.458 1.00 3.53 H new ATOM 0 HD11 ILE A 113 8.245 0.319 -10.713 1.00 3.33 H new ATOM 0 HD12 ILE A 113 8.855 -1.349 -10.610 1.00 3.33 H new ATOM 0 HD13 ILE A 113 7.172 -1.047 -11.101 1.00 3.33 H new ATOM 1684 N PHE A 114 9.052 -3.577 -6.199 1.00 1.09 N ATOM 1685 CA PHE A 114 9.934 -3.544 -5.051 1.00 0.87 C ATOM 1686 C PHE A 114 10.570 -4.925 -4.836 1.00 0.85 C ATOM 1687 O PHE A 114 11.755 -5.020 -4.535 1.00 0.87 O ATOM 1688 CB PHE A 114 9.159 -3.036 -3.829 1.00 0.85 C ATOM 1689 CG PHE A 114 9.051 -1.524 -3.730 1.00 0.86 C ATOM 1690 CD1 PHE A 114 10.170 -0.768 -3.345 1.00 2.10 C ATOM 1691 CD2 PHE A 114 7.830 -0.869 -3.980 1.00 1.69 C ATOM 1692 CE1 PHE A 114 10.084 0.627 -3.222 1.00 2.51 C ATOM 1693 CE2 PHE A 114 7.741 0.530 -3.865 1.00 1.67 C ATOM 1694 CZ PHE A 114 8.867 1.278 -3.480 1.00 1.60 C ATOM 0 H PHE A 114 8.212 -4.136 -6.051 1.00 1.09 H new ATOM 0 HA PHE A 114 10.757 -2.850 -5.220 1.00 0.87 H new ATOM 0 HB2 PHE A 114 8.154 -3.458 -3.852 1.00 0.85 H new ATOM 0 HB3 PHE A 114 9.642 -3.412 -2.927 1.00 0.85 H new ATOM 0 HD1 PHE A 114 11.107 -1.266 -3.141 1.00 2.10 H new ATOM 0 HD2 PHE A 114 6.959 -1.443 -4.261 1.00 1.69 H new ATOM 0 HE1 PHE A 114 10.952 1.199 -2.929 1.00 2.51 H new ATOM 0 HE2 PHE A 114 6.807 1.030 -4.073 1.00 1.67 H new ATOM 0 HZ PHE A 114 8.796 2.351 -3.383 1.00 1.60 H new ATOM 1704 N SER A 115 9.834 -6.027 -4.986 1.00 0.87 N ATOM 1705 CA SER A 115 10.385 -7.344 -4.698 1.00 0.95 C ATOM 1706 C SER A 115 11.488 -7.791 -5.676 1.00 0.97 C ATOM 1707 O SER A 115 12.013 -8.892 -5.538 1.00 1.31 O ATOM 1708 CB SER A 115 9.254 -8.369 -4.651 1.00 1.20 C ATOM 1709 OG SER A 115 8.727 -8.565 -5.944 1.00 2.24 O ATOM 0 H SER A 115 8.864 -6.031 -5.302 1.00 0.87 H new ATOM 0 HA SER A 115 10.873 -7.275 -3.726 1.00 0.95 H new ATOM 0 HB2 SER A 115 9.625 -9.314 -4.253 1.00 1.20 H new ATOM 0 HB3 SER A 115 8.469 -8.026 -3.977 1.00 1.20 H new ATOM 0 HG SER A 115 8.119 -9.333 -5.936 1.00 2.24 H new ATOM 1715 N GLY A 116 11.808 -7.002 -6.703 1.00 0.90 N ATOM 1716 CA GLY A 116 12.699 -7.415 -7.770 1.00 1.00 C ATOM 1717 C GLY A 116 11.925 -8.278 -8.752 1.00 1.30 C ATOM 1718 O GLY A 116 11.083 -7.785 -9.498 1.00 2.38 O ATOM 0 H GLY A 116 11.450 -6.053 -6.812 1.00 0.90 H new ATOM 0 HA2 GLY A 116 13.109 -6.542 -8.278 1.00 1.00 H new ATOM 0 HA3 GLY A 116 13.542 -7.972 -7.362 1.00 1.00 H new ATOM 1722 N ASN A 117 12.198 -9.581 -8.770 1.00 1.24 N ATOM 1723 CA ASN A 117 11.496 -10.483 -9.666 1.00 1.69 C ATOM 1724 C ASN A 117 11.449 -11.864 -9.030 1.00 1.63 C ATOM 1725 O ASN A 117 12.360 -12.667 -9.210 1.00 2.23 O ATOM 1726 CB ASN A 117 12.190 -10.510 -11.034 1.00 2.65 C ATOM 1727 CG ASN A 117 11.291 -11.180 -12.059 1.00 3.34 C ATOM 1728 OD1 ASN A 117 11.333 -12.386 -12.258 1.00 3.41 O ATOM 1729 ND2 ASN A 117 10.436 -10.403 -12.712 1.00 4.50 N ATOM 0 H ASN A 117 12.896 -10.029 -8.177 1.00 1.24 H new ATOM 0 HA ASN A 117 10.474 -10.139 -9.828 1.00 1.69 H new ATOM 0 HB2 ASN A 117 12.424 -9.494 -11.352 1.00 2.65 H new ATOM 0 HB3 ASN A 117 13.136 -11.047 -10.961 1.00 2.65 H new ATOM 0 HD21 ASN A 117 9.797 -10.809 -13.395 1.00 4.50 H new ATOM 0 HD22 ASN A 117 10.418 -9.399 -12.531 1.00 4.50 H new ATOM 1736 N LYS A 118 10.415 -12.122 -8.228 1.00 1.78 N ATOM 1737 CA LYS A 118 10.214 -13.421 -7.606 1.00 2.00 C ATOM 1738 C LYS A 118 8.767 -13.487 -7.143 1.00 2.03 C ATOM 1739 O LYS A 118 7.954 -14.198 -7.731 1.00 3.16 O ATOM 1740 CB LYS A 118 11.219 -13.640 -6.450 1.00 2.57 C ATOM 1741 CG LYS A 118 11.778 -15.067 -6.454 1.00 3.15 C ATOM 1742 CD LYS A 118 12.764 -15.264 -7.611 1.00 3.65 C ATOM 1743 CE LYS A 118 13.349 -16.676 -7.578 1.00 4.21 C ATOM 1744 NZ LYS A 118 14.363 -16.853 -8.640 1.00 4.63 N ATOM 0 H LYS A 118 9.698 -11.435 -7.995 1.00 1.78 H new ATOM 0 HA LYS A 118 10.400 -14.227 -8.316 1.00 2.00 H new ATOM 0 HB2 LYS A 118 12.039 -12.927 -6.539 1.00 2.57 H new ATOM 0 HB3 LYS A 118 10.728 -13.443 -5.497 1.00 2.57 H new ATOM 0 HG2 LYS A 118 12.278 -15.269 -5.507 1.00 3.15 H new ATOM 0 HG3 LYS A 118 10.960 -15.782 -6.542 1.00 3.15 H new ATOM 0 HD2 LYS A 118 12.258 -15.095 -8.561 1.00 3.65 H new ATOM 0 HD3 LYS A 118 13.566 -14.529 -7.543 1.00 3.65 H new ATOM 0 HE2 LYS A 118 13.800 -16.864 -6.604 1.00 4.21 H new ATOM 0 HE3 LYS A 118 12.551 -17.407 -7.706 1.00 4.21 H new ATOM 0 HZ1 LYS A 118 14.745 -17.819 -8.597 1.00 4.63 H new ATOM 0 HZ2 LYS A 118 13.924 -16.695 -9.569 1.00 4.63 H new ATOM 0 HZ3 LYS A 118 15.134 -16.169 -8.501 1.00 4.63 H new ATOM 1758 N ASP A 119 8.451 -12.710 -6.112 1.00 1.74 N ATOM 1759 CA ASP A 119 7.126 -12.681 -5.528 1.00 1.60 C ATOM 1760 C ASP A 119 6.162 -11.959 -6.447 1.00 1.11 C ATOM 1761 O ASP A 119 6.562 -11.262 -7.382 1.00 1.41 O ATOM 1762 CB ASP A 119 7.178 -12.008 -4.160 1.00 2.15 C ATOM 1763 CG ASP A 119 8.084 -12.846 -3.280 1.00 3.04 C ATOM 1764 OD1 ASP A 119 7.577 -13.892 -2.821 1.00 4.13 O ATOM 1765 OD2 ASP A 119 9.281 -12.490 -3.218 1.00 3.75 O ATOM 0 H ASP A 119 9.115 -12.081 -5.660 1.00 1.74 H new ATOM 0 HA ASP A 119 6.770 -13.703 -5.399 1.00 1.60 H new ATOM 0 HB2 ASP A 119 7.560 -10.991 -4.246 1.00 2.15 H new ATOM 0 HB3 ASP A 119 6.180 -11.938 -3.728 1.00 2.15 H new ATOM 1770 N ARG A 120 4.870 -12.136 -6.176 1.00 0.99 N ATOM 1771 CA ARG A 120 3.816 -11.554 -6.979 1.00 1.18 C ATOM 1772 C ARG A 120 2.740 -11.020 -6.057 1.00 1.02 C ATOM 1773 O ARG A 120 2.805 -11.160 -4.837 1.00 0.95 O ATOM 1774 CB ARG A 120 3.239 -12.584 -7.959 1.00 1.83 C ATOM 1775 CG ARG A 120 4.329 -13.287 -8.770 1.00 2.08 C ATOM 1776 CD ARG A 120 3.698 -13.959 -9.989 1.00 2.89 C ATOM 1777 NE ARG A 120 4.704 -14.707 -10.753 1.00 3.27 N ATOM 1778 CZ ARG A 120 4.605 -15.038 -12.046 1.00 4.16 C ATOM 1779 NH1 ARG A 120 5.592 -15.712 -12.636 1.00 4.71 N ATOM 1780 NH2 ARG A 120 3.523 -14.696 -12.749 1.00 4.85 N ATOM 0 H ARG A 120 4.532 -12.690 -5.389 1.00 0.99 H new ATOM 0 HA ARG A 120 4.222 -10.736 -7.574 1.00 1.18 H new ATOM 0 HB2 ARG A 120 2.665 -13.327 -7.406 1.00 1.83 H new ATOM 0 HB3 ARG A 120 2.547 -12.087 -8.639 1.00 1.83 H new ATOM 0 HG2 ARG A 120 5.084 -12.567 -9.087 1.00 2.08 H new ATOM 0 HG3 ARG A 120 4.836 -14.029 -8.153 1.00 2.08 H new ATOM 0 HD2 ARG A 120 2.904 -14.633 -9.668 1.00 2.89 H new ATOM 0 HD3 ARG A 120 3.237 -13.205 -10.627 1.00 2.89 H new ATOM 0 HE ARG A 120 5.547 -14.998 -10.258 1.00 3.27 H new ATOM 0 HH11 ARG A 120 6.421 -15.974 -12.102 1.00 4.71 H new ATOM 0 HH12 ARG A 120 5.519 -15.965 -13.621 1.00 4.71 H new ATOM 0 HH21 ARG A 120 2.766 -14.180 -12.301 1.00 4.85 H new ATOM 0 HH22 ARG A 120 3.453 -14.951 -13.734 1.00 4.85 H new ATOM 1794 N LEU A 121 1.709 -10.448 -6.660 1.00 1.02 N ATOM 1795 CA LEU A 121 0.681 -9.764 -5.913 1.00 0.92 C ATOM 1796 C LEU A 121 -0.160 -10.752 -5.161 1.00 0.95 C ATOM 1797 O LEU A 121 -0.634 -10.433 -4.091 1.00 0.92 O ATOM 1798 CB LEU A 121 -0.203 -8.902 -6.803 1.00 1.00 C ATOM 1799 CG LEU A 121 -0.958 -9.646 -7.917 1.00 1.16 C ATOM 1800 CD1 LEU A 121 -2.419 -9.881 -7.532 1.00 1.73 C ATOM 1801 CD2 LEU A 121 -0.897 -8.808 -9.195 1.00 1.71 C ATOM 0 H LEU A 121 1.568 -10.448 -7.670 1.00 1.02 H new ATOM 0 HA LEU A 121 1.184 -9.101 -5.209 1.00 0.92 H new ATOM 0 HB2 LEU A 121 -0.932 -8.392 -6.174 1.00 1.00 H new ATOM 0 HB3 LEU A 121 0.417 -8.132 -7.262 1.00 1.00 H new ATOM 0 HG LEU A 121 -0.488 -10.617 -8.073 1.00 1.16 H new ATOM 0 HD11 LEU A 121 -2.927 -10.409 -8.339 1.00 1.73 H new ATOM 0 HD12 LEU A 121 -2.464 -10.479 -6.622 1.00 1.73 H new ATOM 0 HD13 LEU A 121 -2.909 -8.922 -7.360 1.00 1.73 H new ATOM 0 HD21 LEU A 121 -1.429 -9.324 -9.994 1.00 1.71 H new ATOM 0 HD22 LEU A 121 -1.362 -7.838 -9.017 1.00 1.71 H new ATOM 0 HD23 LEU A 121 0.143 -8.663 -9.486 1.00 1.71 H new ATOM 1813 N THR A 122 -0.323 -11.958 -5.686 1.00 1.03 N ATOM 1814 CA THR A 122 -0.981 -13.045 -5.010 1.00 1.06 C ATOM 1815 C THR A 122 -0.359 -13.278 -3.635 1.00 1.00 C ATOM 1816 O THR A 122 -1.078 -13.607 -2.693 1.00 1.05 O ATOM 1817 CB THR A 122 -0.843 -14.238 -5.951 1.00 1.17 C ATOM 1818 OG1 THR A 122 -1.495 -13.899 -7.156 1.00 1.28 O ATOM 1819 CG2 THR A 122 -1.440 -15.516 -5.373 1.00 1.32 C ATOM 0 H THR A 122 0.010 -12.204 -6.618 1.00 1.03 H new ATOM 0 HA THR A 122 -2.033 -12.847 -4.805 1.00 1.06 H new ATOM 0 HB THR A 122 0.215 -14.444 -6.110 1.00 1.17 H new ATOM 0 HG1 THR A 122 -1.424 -14.645 -7.787 1.00 1.28 H new ATOM 0 HG21 THR A 122 -1.313 -16.331 -6.085 1.00 1.32 H new ATOM 0 HG22 THR A 122 -0.932 -15.766 -4.441 1.00 1.32 H new ATOM 0 HG23 THR A 122 -2.502 -15.366 -5.179 1.00 1.32 H new ATOM 1827 N GLN A 123 0.959 -13.091 -3.505 1.00 0.94 N ATOM 1828 CA GLN A 123 1.622 -13.297 -2.226 1.00 0.89 C ATOM 1829 C GLN A 123 1.331 -12.105 -1.322 1.00 0.78 C ATOM 1830 O GLN A 123 0.838 -12.272 -0.210 1.00 0.74 O ATOM 1831 CB GLN A 123 3.134 -13.518 -2.392 1.00 0.95 C ATOM 1832 CG GLN A 123 3.448 -14.805 -3.175 1.00 1.43 C ATOM 1833 CD GLN A 123 4.188 -15.841 -2.330 1.00 1.50 C ATOM 1834 OE1 GLN A 123 3.565 -16.718 -1.745 1.00 2.78 O ATOM 1835 NE2 GLN A 123 5.512 -15.786 -2.265 1.00 1.79 N ATOM 0 H GLN A 123 1.576 -12.801 -4.264 1.00 0.94 H new ATOM 0 HA GLN A 123 1.230 -14.205 -1.768 1.00 0.89 H new ATOM 0 HB2 GLN A 123 3.570 -12.664 -2.910 1.00 0.95 H new ATOM 0 HB3 GLN A 123 3.603 -13.569 -1.409 1.00 0.95 H new ATOM 0 HG2 GLN A 123 2.518 -15.239 -3.542 1.00 1.43 H new ATOM 0 HG3 GLN A 123 4.051 -14.557 -4.049 1.00 1.43 H new ATOM 0 HE21 GLN A 123 6.017 -15.049 -2.758 1.00 1.79 H new ATOM 0 HE22 GLN A 123 6.025 -16.480 -1.722 1.00 1.79 H new ATOM 1844 N SER A 124 1.584 -10.885 -1.798 1.00 0.76 N ATOM 1845 CA SER A 124 1.403 -9.700 -0.972 1.00 0.72 C ATOM 1846 C SER A 124 -0.052 -9.556 -0.529 1.00 0.68 C ATOM 1847 O SER A 124 -0.317 -9.102 0.578 1.00 0.67 O ATOM 1848 CB SER A 124 1.904 -8.463 -1.718 1.00 0.76 C ATOM 1849 OG SER A 124 3.309 -8.509 -1.790 1.00 1.16 O ATOM 0 H SER A 124 1.912 -10.696 -2.745 1.00 0.76 H new ATOM 0 HA SER A 124 1.997 -9.806 -0.064 1.00 0.72 H new ATOM 0 HB2 SER A 124 1.477 -8.429 -2.720 1.00 0.76 H new ATOM 0 HB3 SER A 124 1.583 -7.557 -1.204 1.00 0.76 H new ATOM 0 HG SER A 124 3.652 -7.630 -2.056 1.00 1.16 H new ATOM 1855 N LEU A 125 -1.002 -9.965 -1.363 1.00 0.70 N ATOM 1856 CA LEU A 125 -2.420 -9.967 -1.061 1.00 0.72 C ATOM 1857 C LEU A 125 -2.671 -10.984 0.014 1.00 0.69 C ATOM 1858 O LEU A 125 -3.410 -10.716 0.944 1.00 0.66 O ATOM 1859 CB LEU A 125 -3.230 -10.256 -2.337 1.00 0.84 C ATOM 1860 CG LEU A 125 -4.620 -10.889 -2.227 1.00 1.33 C ATOM 1861 CD1 LEU A 125 -4.599 -12.415 -2.064 1.00 0.84 C ATOM 1862 CD2 LEU A 125 -5.512 -10.232 -1.176 1.00 2.51 C ATOM 0 H LEU A 125 -0.794 -10.315 -2.298 1.00 0.70 H new ATOM 0 HA LEU A 125 -2.741 -8.991 -0.698 1.00 0.72 H new ATOM 0 HB2 LEU A 125 -3.343 -9.313 -2.871 1.00 0.84 H new ATOM 0 HB3 LEU A 125 -2.624 -10.908 -2.966 1.00 0.84 H new ATOM 0 HG LEU A 125 -5.073 -10.687 -3.198 1.00 1.33 H new ATOM 0 HD11 LEU A 125 -5.621 -12.787 -1.993 1.00 0.84 H new ATOM 0 HD12 LEU A 125 -4.107 -12.866 -2.926 1.00 0.84 H new ATOM 0 HD13 LEU A 125 -4.054 -12.677 -1.157 1.00 0.84 H new ATOM 0 HD21 LEU A 125 -6.480 -10.733 -1.155 1.00 2.51 H new ATOM 0 HD22 LEU A 125 -5.040 -10.313 -0.197 1.00 2.51 H new ATOM 0 HD23 LEU A 125 -5.653 -9.180 -1.425 1.00 2.51 H new ATOM 1874 N ASN A 126 -2.031 -12.137 -0.078 1.00 0.72 N ATOM 1875 CA ASN A 126 -2.177 -13.155 0.945 1.00 0.71 C ATOM 1876 C ASN A 126 -1.807 -12.577 2.300 1.00 0.67 C ATOM 1877 O ASN A 126 -2.540 -12.730 3.271 1.00 0.68 O ATOM 1878 CB ASN A 126 -1.327 -14.390 0.624 1.00 0.76 C ATOM 1879 CG ASN A 126 -2.181 -15.634 0.743 1.00 1.07 C ATOM 1880 OD1 ASN A 126 -2.115 -16.374 1.712 1.00 1.22 O ATOM 1881 ND2 ASN A 126 -3.036 -15.868 -0.242 1.00 2.78 N ATOM 0 H ASN A 126 -1.409 -12.390 -0.846 1.00 0.72 H new ATOM 0 HA ASN A 126 -3.218 -13.476 0.971 1.00 0.71 H new ATOM 0 HB2 ASN A 126 -0.918 -14.312 -0.383 1.00 0.76 H new ATOM 0 HB3 ASN A 126 -0.480 -14.450 1.308 1.00 0.76 H new ATOM 0 HD21 ASN A 126 -3.654 -16.678 -0.199 1.00 2.78 H new ATOM 0 HD22 ASN A 126 -3.076 -15.238 -1.043 1.00 2.78 H new ATOM 1888 N HIS A 127 -0.681 -11.874 2.353 1.00 0.65 N ATOM 1889 CA HIS A 127 -0.167 -11.318 3.592 1.00 0.64 C ATOM 1890 C HIS A 127 -1.037 -10.150 4.043 1.00 0.60 C ATOM 1891 O HIS A 127 -1.235 -9.948 5.237 1.00 0.61 O ATOM 1892 CB HIS A 127 1.289 -10.901 3.388 1.00 0.72 C ATOM 1893 CG HIS A 127 2.187 -12.065 3.051 1.00 0.85 C ATOM 1894 ND1 HIS A 127 2.357 -13.205 3.806 1.00 1.11 N ATOM 1895 CD2 HIS A 127 2.954 -12.195 1.925 1.00 0.83 C ATOM 1896 CE1 HIS A 127 3.209 -14.004 3.140 1.00 1.20 C ATOM 1897 NE2 HIS A 127 3.596 -13.432 1.988 1.00 1.01 N ATOM 0 H HIS A 127 -0.102 -11.676 1.537 1.00 0.65 H new ATOM 0 HA HIS A 127 -0.199 -12.068 4.382 1.00 0.64 H new ATOM 0 HB2 HIS A 127 1.342 -10.163 2.588 1.00 0.72 H new ATOM 0 HB3 HIS A 127 1.654 -10.416 4.294 1.00 0.72 H new ATOM 0 HD2 HIS A 127 3.046 -11.470 1.130 1.00 0.83 H new ATOM 0 HE1 HIS A 127 3.537 -14.974 3.484 1.00 1.20 H new ATOM 0 HE2 HIS A 127 4.234 -13.825 1.296 1.00 1.01 H new ATOM 1905 N LEU A 128 -1.602 -9.409 3.091 1.00 0.60 N ATOM 1906 CA LEU A 128 -2.434 -8.247 3.369 1.00 0.62 C ATOM 1907 C LEU A 128 -3.717 -8.696 4.040 1.00 0.65 C ATOM 1908 O LEU A 128 -4.106 -8.169 5.071 1.00 0.70 O ATOM 1909 CB LEU A 128 -2.732 -7.511 2.052 1.00 0.67 C ATOM 1910 CG LEU A 128 -3.749 -6.366 2.166 1.00 0.79 C ATOM 1911 CD1 LEU A 128 -3.192 -5.207 2.986 1.00 1.71 C ATOM 1912 CD2 LEU A 128 -4.102 -5.884 0.757 1.00 1.07 C ATOM 0 H LEU A 128 -1.492 -9.603 2.096 1.00 0.60 H new ATOM 0 HA LEU A 128 -1.914 -7.564 4.040 1.00 0.62 H new ATOM 0 HB2 LEU A 128 -1.798 -7.110 1.658 1.00 0.67 H new ATOM 0 HB3 LEU A 128 -3.101 -8.234 1.324 1.00 0.67 H new ATOM 0 HG LEU A 128 -4.639 -6.734 2.677 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -3.937 -4.414 3.047 1.00 1.71 H new ATOM 0 HD12 LEU A 128 -2.949 -5.555 3.990 1.00 1.71 H new ATOM 0 HD13 LEU A 128 -2.291 -4.823 2.508 1.00 1.71 H new ATOM 0 HD21 LEU A 128 -4.824 -5.070 0.821 1.00 1.07 H new ATOM 0 HD22 LEU A 128 -3.200 -5.531 0.257 1.00 1.07 H new ATOM 0 HD23 LEU A 128 -4.533 -6.708 0.188 1.00 1.07 H new ATOM 1924 N LEU A 129 -4.356 -9.691 3.445 1.00 0.68 N ATOM 1925 CA LEU A 129 -5.539 -10.366 3.935 1.00 0.74 C ATOM 1926 C LEU A 129 -5.198 -11.047 5.243 1.00 0.70 C ATOM 1927 O LEU A 129 -6.029 -11.075 6.129 1.00 0.77 O ATOM 1928 CB LEU A 129 -6.023 -11.326 2.833 1.00 0.81 C ATOM 1929 CG LEU A 129 -6.946 -12.503 3.187 1.00 2.00 C ATOM 1930 CD1 LEU A 129 -6.192 -13.687 3.801 1.00 3.13 C ATOM 1931 CD2 LEU A 129 -8.167 -12.124 4.030 1.00 3.10 C ATOM 0 H LEU A 129 -4.040 -10.069 2.552 1.00 0.68 H new ATOM 0 HA LEU A 129 -6.360 -9.682 4.149 1.00 0.74 H new ATOM 0 HB2 LEU A 129 -6.538 -10.725 2.083 1.00 0.81 H new ATOM 0 HB3 LEU A 129 -5.137 -11.742 2.354 1.00 0.81 H new ATOM 0 HG LEU A 129 -7.341 -12.824 2.223 1.00 2.00 H new ATOM 0 HD11 LEU A 129 -6.896 -14.487 4.030 1.00 3.13 H new ATOM 0 HD12 LEU A 129 -5.447 -14.050 3.093 1.00 3.13 H new ATOM 0 HD13 LEU A 129 -5.696 -13.367 4.717 1.00 3.13 H new ATOM 0 HD21 LEU A 129 -8.761 -13.016 4.232 1.00 3.10 H new ATOM 0 HD22 LEU A 129 -7.837 -11.687 4.972 1.00 3.10 H new ATOM 0 HD23 LEU A 129 -8.774 -11.399 3.487 1.00 3.10 H new ATOM 1943 N THR A 130 -3.987 -11.564 5.423 1.00 0.67 N ATOM 1944 CA THR A 130 -3.674 -12.236 6.676 1.00 0.72 C ATOM 1945 C THR A 130 -3.639 -11.213 7.804 1.00 0.77 C ATOM 1946 O THR A 130 -4.160 -11.461 8.887 1.00 0.89 O ATOM 1947 CB THR A 130 -2.378 -13.043 6.535 1.00 0.80 C ATOM 1948 OG1 THR A 130 -2.624 -14.140 5.685 1.00 0.81 O ATOM 1949 CG2 THR A 130 -1.868 -13.615 7.855 1.00 0.93 C ATOM 0 H THR A 130 -3.229 -11.533 4.741 1.00 0.67 H new ATOM 0 HA THR A 130 -4.451 -12.958 6.928 1.00 0.72 H new ATOM 0 HB THR A 130 -1.626 -12.356 6.147 1.00 0.80 H new ATOM 0 HG1 THR A 130 -2.635 -13.836 4.753 1.00 0.81 H new ATOM 0 HG21 THR A 130 -0.949 -14.173 7.679 1.00 0.93 H new ATOM 0 HG22 THR A 130 -1.670 -12.801 8.552 1.00 0.93 H new ATOM 0 HG23 THR A 130 -2.621 -14.280 8.278 1.00 0.93 H new ATOM 1957 N ALA A 131 -3.060 -10.040 7.561 1.00 0.73 N ATOM 1958 CA ALA A 131 -3.022 -9.023 8.601 1.00 0.83 C ATOM 1959 C ALA A 131 -4.391 -8.378 8.798 1.00 0.86 C ATOM 1960 O ALA A 131 -4.767 -8.041 9.918 1.00 0.93 O ATOM 1961 CB ALA A 131 -1.953 -7.989 8.242 1.00 0.93 C ATOM 0 H ALA A 131 -2.623 -9.777 6.678 1.00 0.73 H new ATOM 0 HA ALA A 131 -2.762 -9.487 9.553 1.00 0.83 H new ATOM 0 HB1 ALA A 131 -1.915 -7.221 9.015 1.00 0.93 H new ATOM 0 HB2 ALA A 131 -0.982 -8.479 8.170 1.00 0.93 H new ATOM 0 HB3 ALA A 131 -2.199 -7.529 7.285 1.00 0.93 H new ATOM 1967 N LEU A 132 -5.142 -8.198 7.715 1.00 0.83 N ATOM 1968 CA LEU A 132 -6.441 -7.546 7.768 1.00 0.88 C ATOM 1969 C LEU A 132 -7.532 -8.523 8.184 1.00 0.85 C ATOM 1970 O LEU A 132 -8.608 -8.065 8.543 1.00 0.89 O ATOM 1971 CB LEU A 132 -6.803 -6.896 6.425 1.00 0.92 C ATOM 1972 CG LEU A 132 -5.978 -5.651 6.072 1.00 1.50 C ATOM 1973 CD1 LEU A 132 -6.510 -5.093 4.750 1.00 1.94 C ATOM 1974 CD2 LEU A 132 -6.094 -4.556 7.136 1.00 2.32 C ATOM 0 H LEU A 132 -4.866 -8.500 6.781 1.00 0.83 H new ATOM 0 HA LEU A 132 -6.371 -6.760 8.520 1.00 0.88 H new ATOM 0 HB2 LEU A 132 -6.677 -7.635 5.634 1.00 0.92 H new ATOM 0 HB3 LEU A 132 -7.858 -6.623 6.442 1.00 0.92 H new ATOM 0 HG LEU A 132 -4.930 -5.944 6.005 1.00 1.50 H new ATOM 0 HD11 LEU A 132 -5.941 -4.205 4.474 1.00 1.94 H new ATOM 0 HD12 LEU A 132 -6.408 -5.847 3.969 1.00 1.94 H new ATOM 0 HD13 LEU A 132 -7.561 -4.829 4.863 1.00 1.94 H new ATOM 0 HD21 LEU A 132 -5.493 -3.696 6.840 1.00 2.32 H new ATOM 0 HD22 LEU A 132 -7.136 -4.253 7.234 1.00 2.32 H new ATOM 0 HD23 LEU A 132 -5.736 -4.938 8.092 1.00 2.32 H new ATOM 1986 N ASP A 133 -7.282 -9.836 8.176 1.00 0.79 N ATOM 1987 CA ASP A 133 -8.222 -10.856 8.653 1.00 0.76 C ATOM 1988 C ASP A 133 -8.554 -10.590 10.115 1.00 0.72 C ATOM 1989 O ASP A 133 -9.691 -10.748 10.552 1.00 0.71 O ATOM 1990 CB ASP A 133 -7.636 -12.263 8.503 1.00 0.85 C ATOM 1991 CG ASP A 133 -8.556 -13.307 9.130 1.00 1.66 C ATOM 1992 OD1 ASP A 133 -8.121 -13.937 10.119 1.00 3.29 O ATOM 1993 OD2 ASP A 133 -9.679 -13.461 8.600 1.00 2.09 O ATOM 0 H ASP A 133 -6.405 -10.227 7.832 1.00 0.79 H new ATOM 0 HA ASP A 133 -9.128 -10.801 8.049 1.00 0.76 H new ATOM 0 HB2 ASP A 133 -7.489 -12.489 7.447 1.00 0.85 H new ATOM 0 HB3 ASP A 133 -6.655 -12.305 8.977 1.00 0.85 H new ATOM 1998 N THR A 134 -7.552 -10.082 10.835 1.00 0.80 N ATOM 1999 CA THR A 134 -7.632 -9.638 12.216 1.00 0.84 C ATOM 2000 C THR A 134 -8.715 -8.555 12.428 1.00 0.81 C ATOM 2001 O THR A 134 -9.030 -8.220 13.569 1.00 0.92 O ATOM 2002 CB THR A 134 -6.199 -9.272 12.670 1.00 0.97 C ATOM 2003 OG1 THR A 134 -5.856 -10.035 13.805 1.00 1.32 O ATOM 2004 CG2 THR A 134 -5.994 -7.800 12.999 1.00 1.34 C ATOM 0 H THR A 134 -6.617 -9.966 10.444 1.00 0.80 H new ATOM 0 HA THR A 134 -7.986 -10.434 12.871 1.00 0.84 H new ATOM 0 HB THR A 134 -5.557 -9.494 11.818 1.00 0.97 H new ATOM 0 HG1 THR A 134 -4.948 -9.805 14.092 1.00 1.32 H new ATOM 0 HG21 THR A 134 -4.961 -7.637 13.308 1.00 1.34 H new ATOM 0 HG22 THR A 134 -6.209 -7.197 12.117 1.00 1.34 H new ATOM 0 HG23 THR A 134 -6.665 -7.511 13.808 1.00 1.34 H new ATOM 2012 N THR A 135 -9.333 -8.027 11.363 1.00 0.75 N ATOM 2013 CA THR A 135 -10.438 -7.089 11.427 1.00 0.78 C ATOM 2014 C THR A 135 -11.532 -7.520 10.444 1.00 0.81 C ATOM 2015 O THR A 135 -11.257 -7.837 9.290 1.00 1.71 O ATOM 2016 CB THR A 135 -9.926 -5.679 11.101 1.00 1.01 C ATOM 2017 OG1 THR A 135 -9.510 -5.559 9.754 1.00 1.21 O ATOM 2018 CG2 THR A 135 -8.736 -5.292 11.981 1.00 1.42 C ATOM 0 H THR A 135 -9.061 -8.255 10.407 1.00 0.75 H new ATOM 0 HA THR A 135 -10.864 -7.079 12.430 1.00 0.78 H new ATOM 0 HB THR A 135 -10.770 -5.015 11.289 1.00 1.01 H new ATOM 0 HG1 THR A 135 -9.223 -6.435 9.421 1.00 1.21 H new ATOM 0 HG21 THR A 135 -8.402 -4.288 11.720 1.00 1.42 H new ATOM 0 HG22 THR A 135 -9.036 -5.314 13.029 1.00 1.42 H new ATOM 0 HG23 THR A 135 -7.921 -5.998 11.822 1.00 1.42 H new ATOM 2026 N ASP A 136 -12.798 -7.484 10.841 1.00 0.93 N ATOM 2027 CA ASP A 136 -13.931 -7.631 9.940 1.00 0.96 C ATOM 2028 C ASP A 136 -14.287 -6.273 9.342 1.00 1.03 C ATOM 2029 O ASP A 136 -15.414 -5.801 9.440 1.00 1.32 O ATOM 2030 CB ASP A 136 -15.110 -8.312 10.657 1.00 1.37 C ATOM 2031 CG ASP A 136 -15.675 -7.530 11.848 1.00 1.83 C ATOM 2032 OD1 ASP A 136 -14.856 -6.915 12.571 1.00 2.41 O ATOM 2033 OD2 ASP A 136 -16.899 -7.645 12.072 1.00 2.78 O ATOM 0 H ASP A 136 -13.069 -7.349 11.815 1.00 0.93 H new ATOM 0 HA ASP A 136 -13.667 -8.287 9.111 1.00 0.96 H new ATOM 0 HB2 ASP A 136 -15.910 -8.476 9.935 1.00 1.37 H new ATOM 0 HB3 ASP A 136 -14.788 -9.294 11.005 1.00 1.37 H new ATOM 2038 N ALA A 137 -13.295 -5.664 8.688 1.00 1.05 N ATOM 2039 CA ALA A 137 -13.453 -4.449 7.919 1.00 1.36 C ATOM 2040 C ALA A 137 -13.685 -4.856 6.462 1.00 1.21 C ATOM 2041 O ALA A 137 -14.628 -5.582 6.160 1.00 1.26 O ATOM 2042 CB ALA A 137 -12.204 -3.581 8.136 1.00 1.71 C ATOM 0 H ALA A 137 -12.339 -6.020 8.685 1.00 1.05 H new ATOM 0 HA ALA A 137 -14.308 -3.849 8.229 1.00 1.36 H new ATOM 0 HB1 ALA A 137 -12.299 -2.657 7.565 1.00 1.71 H new ATOM 0 HB2 ALA A 137 -12.105 -3.344 9.195 1.00 1.71 H new ATOM 0 HB3 ALA A 137 -11.320 -4.125 7.801 1.00 1.71 H new ATOM 2048 N ASP A 138 -12.799 -4.439 5.561 1.00 1.19 N ATOM 2049 CA ASP A 138 -12.875 -4.714 4.136 1.00 1.10 C ATOM 2050 C ASP A 138 -11.494 -4.451 3.550 1.00 1.10 C ATOM 2051 O ASP A 138 -10.680 -3.761 4.167 1.00 1.27 O ATOM 2052 CB ASP A 138 -13.922 -3.822 3.451 1.00 1.19 C ATOM 2053 CG ASP A 138 -14.768 -4.640 2.485 1.00 1.11 C ATOM 2054 OD1 ASP A 138 -14.785 -4.299 1.282 1.00 1.83 O ATOM 2055 OD2 ASP A 138 -15.391 -5.605 2.978 1.00 2.24 O ATOM 0 H ASP A 138 -11.983 -3.882 5.815 1.00 1.19 H new ATOM 0 HA ASP A 138 -13.180 -5.748 3.971 1.00 1.10 H new ATOM 0 HB2 ASP A 138 -14.562 -3.359 4.202 1.00 1.19 H new ATOM 0 HB3 ASP A 138 -13.425 -3.014 2.914 1.00 1.19 H new ATOM 2060 N VAL A 139 -11.221 -4.993 2.368 1.00 0.97 N ATOM 2061 CA VAL A 139 -9.971 -4.792 1.661 1.00 0.99 C ATOM 2062 C VAL A 139 -10.322 -4.429 0.224 1.00 0.88 C ATOM 2063 O VAL A 139 -10.869 -5.247 -0.515 1.00 0.93 O ATOM 2064 CB VAL A 139 -9.058 -6.024 1.826 1.00 1.01 C ATOM 2065 CG1 VAL A 139 -9.595 -7.331 1.236 1.00 1.23 C ATOM 2066 CG2 VAL A 139 -7.671 -5.765 1.237 1.00 1.44 C ATOM 0 H VAL A 139 -11.877 -5.594 1.869 1.00 0.97 H new ATOM 0 HA VAL A 139 -9.383 -3.971 2.071 1.00 0.99 H new ATOM 0 HB VAL A 139 -9.014 -6.165 2.906 1.00 1.01 H new ATOM 0 HG11 VAL A 139 -8.875 -8.131 1.408 1.00 1.23 H new ATOM 0 HG12 VAL A 139 -10.541 -7.585 1.715 1.00 1.23 H new ATOM 0 HG13 VAL A 139 -9.753 -7.209 0.164 1.00 1.23 H new ATOM 0 HG21 VAL A 139 -7.049 -6.651 1.368 1.00 1.44 H new ATOM 0 HG22 VAL A 139 -7.763 -5.540 0.174 1.00 1.44 H new ATOM 0 HG23 VAL A 139 -7.211 -4.920 1.748 1.00 1.44 H new ATOM 2076 N ALA A 140 -10.023 -3.191 -0.172 1.00 0.77 N ATOM 2077 CA ALA A 140 -10.322 -2.717 -1.510 1.00 0.67 C ATOM 2078 C ALA A 140 -9.001 -2.535 -2.249 1.00 0.70 C ATOM 2079 O ALA A 140 -8.173 -1.719 -1.867 1.00 0.89 O ATOM 2080 CB ALA A 140 -11.176 -1.445 -1.454 1.00 0.63 C ATOM 0 H ALA A 140 -9.571 -2.499 0.425 1.00 0.77 H new ATOM 0 HA ALA A 140 -10.922 -3.441 -2.062 1.00 0.67 H new ATOM 0 HB1 ALA A 140 -11.390 -1.105 -2.467 1.00 0.63 H new ATOM 0 HB2 ALA A 140 -12.112 -1.658 -0.938 1.00 0.63 H new ATOM 0 HB3 ALA A 140 -10.634 -0.666 -0.917 1.00 0.63 H new ATOM 2086 N ILE A 141 -8.779 -3.312 -3.302 1.00 0.66 N ATOM 2087 CA ILE A 141 -7.528 -3.339 -4.038 1.00 0.68 C ATOM 2088 C ILE A 141 -7.823 -2.772 -5.418 1.00 0.76 C ATOM 2089 O ILE A 141 -8.773 -3.184 -6.076 1.00 0.95 O ATOM 2090 CB ILE A 141 -6.944 -4.768 -4.100 1.00 0.74 C ATOM 2091 CG1 ILE A 141 -7.988 -5.902 -4.081 1.00 1.64 C ATOM 2092 CG2 ILE A 141 -5.901 -4.964 -2.995 1.00 1.90 C ATOM 2093 CD1 ILE A 141 -8.442 -6.361 -2.690 1.00 1.43 C ATOM 0 H ILE A 141 -9.480 -3.953 -3.673 1.00 0.66 H new ATOM 0 HA ILE A 141 -6.765 -2.739 -3.542 1.00 0.68 H new ATOM 0 HB ILE A 141 -6.470 -4.846 -5.079 1.00 0.74 H new ATOM 0 HG12 ILE A 141 -8.865 -5.574 -4.640 1.00 1.64 H new ATOM 0 HG13 ILE A 141 -7.575 -6.761 -4.611 1.00 1.64 H new ATOM 0 HG21 ILE A 141 -5.498 -5.975 -3.050 1.00 1.90 H new ATOM 0 HG22 ILE A 141 -5.093 -4.244 -3.125 1.00 1.90 H new ATOM 0 HG23 ILE A 141 -6.369 -4.813 -2.022 1.00 1.90 H new ATOM 0 HD11 ILE A 141 -9.176 -7.161 -2.792 1.00 1.43 H new ATOM 0 HD12 ILE A 141 -7.582 -6.727 -2.129 1.00 1.43 H new ATOM 0 HD13 ILE A 141 -8.891 -5.522 -2.159 1.00 1.43 H new ATOM 2105 N TYR A 142 -7.027 -1.812 -5.874 1.00 0.76 N ATOM 2106 CA TYR A 142 -7.263 -1.114 -7.123 1.00 0.92 C ATOM 2107 C TYR A 142 -5.950 -0.974 -7.882 1.00 0.85 C ATOM 2108 O TYR A 142 -4.921 -0.621 -7.309 1.00 0.92 O ATOM 2109 CB TYR A 142 -7.923 0.239 -6.842 1.00 1.19 C ATOM 2110 CG TYR A 142 -7.094 1.125 -5.939 1.00 1.52 C ATOM 2111 CD1 TYR A 142 -7.089 0.913 -4.547 1.00 2.40 C ATOM 2112 CD2 TYR A 142 -6.257 2.101 -6.505 1.00 2.65 C ATOM 2113 CE1 TYR A 142 -6.242 1.672 -3.725 1.00 3.86 C ATOM 2114 CE2 TYR A 142 -5.412 2.857 -5.681 1.00 4.08 C ATOM 2115 CZ TYR A 142 -5.404 2.656 -4.283 1.00 4.59 C ATOM 2116 OH TYR A 142 -4.597 3.390 -3.467 1.00 6.16 O ATOM 0 H TYR A 142 -6.193 -1.496 -5.379 1.00 0.76 H new ATOM 0 HA TYR A 142 -7.947 -1.683 -7.752 1.00 0.92 H new ATOM 0 HB2 TYR A 142 -8.098 0.755 -7.786 1.00 1.19 H new ATOM 0 HB3 TYR A 142 -8.898 0.073 -6.384 1.00 1.19 H new ATOM 0 HD1 TYR A 142 -7.737 0.166 -4.112 1.00 2.40 H new ATOM 0 HD2 TYR A 142 -6.265 2.268 -7.572 1.00 2.65 H new ATOM 0 HE1 TYR A 142 -6.233 1.500 -2.659 1.00 3.86 H new ATOM 0 HE2 TYR A 142 -4.761 3.600 -6.119 1.00 4.08 H new ATOM 0 HH TYR A 142 -5.018 3.482 -2.587 1.00 6.16 H new ATOM 2126 N CYS A 143 -5.975 -1.312 -9.171 1.00 0.82 N ATOM 2127 CA CYS A 143 -4.855 -1.105 -10.066 1.00 0.82 C ATOM 2128 C CYS A 143 -5.367 -1.175 -11.497 1.00 0.86 C ATOM 2129 O CYS A 143 -6.433 -1.735 -11.766 1.00 0.84 O ATOM 2130 CB CYS A 143 -3.760 -2.155 -9.848 1.00 0.88 C ATOM 2131 SG CYS A 143 -2.150 -1.332 -9.789 1.00 2.36 S ATOM 0 H CYS A 143 -6.784 -1.741 -9.620 1.00 0.82 H new ATOM 0 HA CYS A 143 -4.414 -0.129 -9.864 1.00 0.82 H new ATOM 0 HB2 CYS A 143 -3.939 -2.697 -8.919 1.00 0.88 H new ATOM 0 HB3 CYS A 143 -3.777 -2.889 -10.654 1.00 0.88 H new ATOM 0 HG CYS A 143 -1.217 -2.217 -9.602 1.00 2.36 H new ATOM 2137 N ARG A 144 -4.603 -0.589 -12.413 1.00 1.08 N ATOM 2138 CA ARG A 144 -4.888 -0.625 -13.834 1.00 1.17 C ATOM 2139 C ARG A 144 -4.192 -1.829 -14.447 1.00 1.19 C ATOM 2140 O ARG A 144 -2.973 -1.832 -14.573 1.00 1.45 O ATOM 2141 CB ARG A 144 -4.428 0.710 -14.436 1.00 1.38 C ATOM 2142 CG ARG A 144 -5.455 1.326 -15.389 1.00 2.53 C ATOM 2143 CD ARG A 144 -5.642 2.802 -15.019 1.00 2.89 C ATOM 2144 NE ARG A 144 -6.169 3.582 -16.145 1.00 3.57 N ATOM 2145 CZ ARG A 144 -5.431 3.997 -17.185 1.00 3.74 C ATOM 2146 NH1 ARG A 144 -5.992 4.704 -18.166 1.00 4.60 N ATOM 2147 NH2 ARG A 144 -4.132 3.696 -17.247 1.00 3.65 N ATOM 0 H ARG A 144 -3.757 -0.069 -12.180 1.00 1.08 H new ATOM 0 HA ARG A 144 -5.952 -0.739 -14.040 1.00 1.17 H new ATOM 0 HB2 ARG A 144 -4.222 1.414 -13.629 1.00 1.38 H new ATOM 0 HB3 ARG A 144 -3.491 0.556 -14.971 1.00 1.38 H new ATOM 0 HG2 ARG A 144 -5.116 1.235 -16.421 1.00 2.53 H new ATOM 0 HG3 ARG A 144 -6.404 0.795 -15.317 1.00 2.53 H new ATOM 0 HD2 ARG A 144 -6.323 2.881 -14.171 1.00 2.89 H new ATOM 0 HD3 ARG A 144 -4.687 3.221 -14.701 1.00 2.89 H new ATOM 0 HE ARG A 144 -7.160 3.824 -16.136 1.00 3.57 H new ATOM 0 HH11 ARG A 144 -6.986 4.931 -18.127 1.00 4.60 H new ATOM 0 HH12 ARG A 144 -5.428 5.018 -18.955 1.00 4.60 H new ATOM 0 HH21 ARG A 144 -3.699 3.149 -16.503 1.00 3.65 H new ATOM 0 HH22 ARG A 144 -3.572 4.013 -18.039 1.00 3.65 H new ATOM 2161 N ASP A 145 -4.966 -2.846 -14.814 1.00 1.08 N ATOM 2162 CA ASP A 145 -4.428 -4.078 -15.380 1.00 1.20 C ATOM 2163 C ASP A 145 -5.553 -4.868 -16.039 1.00 1.18 C ATOM 2164 O ASP A 145 -5.440 -5.320 -17.174 1.00 1.45 O ATOM 2165 CB ASP A 145 -3.785 -4.912 -14.267 1.00 1.27 C ATOM 2166 CG ASP A 145 -3.169 -6.189 -14.828 1.00 1.88 C ATOM 2167 OD1 ASP A 145 -1.926 -6.280 -14.857 1.00 1.88 O ATOM 2168 OD2 ASP A 145 -3.977 -7.072 -15.192 1.00 3.30 O ATOM 0 H ASP A 145 -5.982 -2.839 -14.727 1.00 1.08 H new ATOM 0 HA ASP A 145 -3.673 -3.839 -16.129 1.00 1.20 H new ATOM 0 HB2 ASP A 145 -3.017 -4.324 -13.764 1.00 1.27 H new ATOM 0 HB3 ASP A 145 -4.535 -5.165 -13.517 1.00 1.27 H new ATOM 2173 N LYS A 146 -6.661 -5.021 -15.306 1.00 1.02 N ATOM 2174 CA LYS A 146 -7.842 -5.793 -15.693 1.00 1.01 C ATOM 2175 C LYS A 146 -7.636 -7.288 -15.490 1.00 1.05 C ATOM 2176 O LYS A 146 -8.393 -7.904 -14.744 1.00 1.01 O ATOM 2177 CB LYS A 146 -8.292 -5.483 -17.128 1.00 1.11 C ATOM 2178 CG LYS A 146 -9.789 -5.770 -17.292 1.00 1.20 C ATOM 2179 CD LYS A 146 -10.607 -4.490 -17.107 1.00 1.78 C ATOM 2180 CE LYS A 146 -10.513 -3.642 -18.381 1.00 2.59 C ATOM 2181 NZ LYS A 146 -11.561 -2.600 -18.441 1.00 3.45 N ATOM 0 H LYS A 146 -6.761 -4.590 -14.387 1.00 1.02 H new ATOM 0 HA LYS A 146 -8.647 -5.480 -15.028 1.00 1.01 H new ATOM 0 HB2 LYS A 146 -8.088 -4.438 -17.362 1.00 1.11 H new ATOM 0 HB3 LYS A 146 -7.720 -6.086 -17.834 1.00 1.11 H new ATOM 0 HG2 LYS A 146 -9.978 -6.189 -18.280 1.00 1.20 H new ATOM 0 HG3 LYS A 146 -10.103 -6.517 -16.563 1.00 1.20 H new ATOM 0 HD2 LYS A 146 -11.648 -4.737 -16.896 1.00 1.78 H new ATOM 0 HD3 LYS A 146 -10.234 -3.926 -16.252 1.00 1.78 H new ATOM 0 HE2 LYS A 146 -9.532 -3.170 -18.429 1.00 2.59 H new ATOM 0 HE3 LYS A 146 -10.598 -4.290 -19.253 1.00 2.59 H new ATOM 0 HZ1 LYS A 146 -11.457 -2.053 -19.319 1.00 3.45 H new ATOM 0 HZ2 LYS A 146 -12.499 -3.049 -18.422 1.00 3.45 H new ATOM 0 HZ3 LYS A 146 -11.465 -1.964 -17.624 1.00 3.45 H new ATOM 2195 N LYS A 147 -6.600 -7.885 -16.074 1.00 1.17 N ATOM 2196 CA LYS A 147 -6.283 -9.280 -15.777 1.00 1.22 C ATOM 2197 C LYS A 147 -6.082 -9.479 -14.278 1.00 1.11 C ATOM 2198 O LYS A 147 -6.318 -10.574 -13.766 1.00 1.10 O ATOM 2199 CB LYS A 147 -5.062 -9.734 -16.589 1.00 1.38 C ATOM 2200 CG LYS A 147 -5.551 -10.512 -17.812 1.00 1.79 C ATOM 2201 CD LYS A 147 -4.439 -10.680 -18.846 1.00 2.13 C ATOM 2202 CE LYS A 147 -4.981 -11.544 -19.987 1.00 3.05 C ATOM 2203 NZ LYS A 147 -4.046 -11.600 -21.131 1.00 3.32 N ATOM 0 H LYS A 147 -5.976 -7.435 -16.744 1.00 1.17 H new ATOM 0 HA LYS A 147 -7.124 -9.906 -16.074 1.00 1.22 H new ATOM 0 HB2 LYS A 147 -4.473 -8.871 -16.900 1.00 1.38 H new ATOM 0 HB3 LYS A 147 -4.412 -10.360 -15.977 1.00 1.38 H new ATOM 0 HG2 LYS A 147 -5.912 -11.492 -17.501 1.00 1.79 H new ATOM 0 HG3 LYS A 147 -6.395 -9.990 -18.264 1.00 1.79 H new ATOM 0 HD2 LYS A 147 -4.119 -9.709 -19.223 1.00 2.13 H new ATOM 0 HD3 LYS A 147 -3.566 -11.150 -18.394 1.00 2.13 H new ATOM 0 HE2 LYS A 147 -5.167 -12.554 -19.621 1.00 3.05 H new ATOM 0 HE3 LYS A 147 -5.939 -11.145 -20.321 1.00 3.05 H new ATOM 0 HZ1 LYS A 147 -4.451 -12.195 -21.882 1.00 3.32 H new ATOM 0 HZ2 LYS A 147 -3.888 -10.640 -21.498 1.00 3.32 H new ATOM 0 HZ3 LYS A 147 -3.140 -12.005 -20.819 1.00 3.32 H new ATOM 2217 N TRP A 148 -5.697 -8.433 -13.548 1.00 1.05 N ATOM 2218 CA TRP A 148 -5.459 -8.576 -12.129 1.00 0.98 C ATOM 2219 C TRP A 148 -6.774 -8.710 -11.380 1.00 0.95 C ATOM 2220 O TRP A 148 -6.827 -9.402 -10.374 1.00 0.88 O ATOM 2221 CB TRP A 148 -4.521 -7.484 -11.585 1.00 1.01 C ATOM 2222 CG TRP A 148 -5.173 -6.310 -10.929 1.00 2.11 C ATOM 2223 CD1 TRP A 148 -6.273 -5.675 -11.371 1.00 3.54 C ATOM 2224 CD2 TRP A 148 -4.836 -5.676 -9.664 1.00 2.86 C ATOM 2225 NE1 TRP A 148 -6.734 -4.806 -10.403 1.00 5.17 N ATOM 2226 CE2 TRP A 148 -5.912 -4.824 -9.296 1.00 4.84 C ATOM 2227 CE3 TRP A 148 -3.745 -5.751 -8.780 1.00 2.28 C ATOM 2228 CZ2 TRP A 148 -5.966 -4.196 -8.048 1.00 6.07 C ATOM 2229 CZ3 TRP A 148 -3.736 -5.027 -7.577 1.00 3.41 C ATOM 2230 CH2 TRP A 148 -4.858 -4.276 -7.189 1.00 5.29 C ATOM 0 H TRP A 148 -5.547 -7.494 -13.917 1.00 1.05 H new ATOM 0 HA TRP A 148 -4.916 -9.505 -11.955 1.00 0.98 H new ATOM 0 HB2 TRP A 148 -3.843 -7.944 -10.866 1.00 1.01 H new ATOM 0 HB3 TRP A 148 -3.910 -7.118 -12.410 1.00 1.01 H new ATOM 0 HD1 TRP A 148 -6.728 -5.823 -12.339 1.00 3.54 H new ATOM 0 HE1 TRP A 148 -7.570 -4.228 -10.494 1.00 5.17 H new ATOM 0 HE3 TRP A 148 -2.900 -6.376 -9.030 1.00 2.28 H new ATOM 0 HZ2 TRP A 148 -6.851 -3.655 -7.748 1.00 6.07 H new ATOM 0 HZ3 TRP A 148 -2.860 -5.048 -6.945 1.00 3.41 H new ATOM 0 HH2 TRP A 148 -4.868 -3.764 -6.238 1.00 5.29 H new ATOM 2241 N GLU A 149 -7.849 -8.084 -11.865 1.00 1.04 N ATOM 2242 CA GLU A 149 -9.119 -8.160 -11.176 1.00 1.06 C ATOM 2243 C GLU A 149 -9.798 -9.462 -11.528 1.00 1.06 C ATOM 2244 O GLU A 149 -10.546 -9.987 -10.716 1.00 1.08 O ATOM 2245 CB GLU A 149 -10.027 -6.961 -11.466 1.00 1.17 C ATOM 2246 CG GLU A 149 -10.610 -6.907 -12.887 1.00 2.03 C ATOM 2247 CD GLU A 149 -12.045 -6.377 -12.958 1.00 2.62 C ATOM 2248 OE1 GLU A 149 -12.493 -6.131 -14.098 1.00 3.77 O ATOM 2249 OE2 GLU A 149 -12.661 -6.081 -11.903 1.00 2.85 O ATOM 0 H GLU A 149 -7.857 -7.529 -12.721 1.00 1.04 H new ATOM 0 HA GLU A 149 -8.923 -8.128 -10.104 1.00 1.06 H new ATOM 0 HB2 GLU A 149 -10.851 -6.970 -10.753 1.00 1.17 H new ATOM 0 HB3 GLU A 149 -9.461 -6.046 -11.288 1.00 1.17 H new ATOM 0 HG2 GLU A 149 -9.971 -6.277 -13.506 1.00 2.03 H new ATOM 0 HG3 GLU A 149 -10.583 -7.908 -13.317 1.00 2.03 H new ATOM 2256 N MET A 150 -9.532 -9.991 -12.724 1.00 1.10 N ATOM 2257 CA MET A 150 -10.037 -11.285 -13.113 1.00 1.19 C ATOM 2258 C MET A 150 -9.471 -12.288 -12.129 1.00 1.15 C ATOM 2259 O MET A 150 -10.219 -12.882 -11.364 1.00 1.14 O ATOM 2260 CB MET A 150 -9.644 -11.566 -14.564 1.00 1.26 C ATOM 2261 CG MET A 150 -10.711 -10.974 -15.487 1.00 1.29 C ATOM 2262 SD MET A 150 -10.207 -10.787 -17.215 1.00 1.92 S ATOM 2263 CE MET A 150 -11.801 -10.254 -17.895 1.00 3.04 C ATOM 0 H MET A 150 -8.965 -9.530 -13.436 1.00 1.10 H new ATOM 0 HA MET A 150 -11.125 -11.342 -13.080 1.00 1.19 H new ATOM 0 HB2 MET A 150 -8.670 -11.128 -14.783 1.00 1.26 H new ATOM 0 HB3 MET A 150 -9.555 -12.640 -14.730 1.00 1.26 H new ATOM 0 HG2 MET A 150 -11.596 -11.609 -15.449 1.00 1.29 H new ATOM 0 HG3 MET A 150 -11.003 -9.997 -15.101 1.00 1.29 H new ATOM 0 HE1 MET A 150 -11.701 -10.084 -18.967 1.00 3.04 H new ATOM 0 HE2 MET A 150 -12.549 -11.027 -17.719 1.00 3.04 H new ATOM 0 HE3 MET A 150 -12.113 -9.330 -17.408 1.00 3.04 H new ATOM 2273 N THR A 151 -8.147 -12.408 -12.070 1.00 1.17 N ATOM 2274 CA THR A 151 -7.497 -13.374 -11.210 1.00 1.19 C ATOM 2275 C THR A 151 -7.846 -13.163 -9.744 1.00 1.05 C ATOM 2276 O THR A 151 -8.167 -14.115 -9.038 1.00 1.09 O ATOM 2277 CB THR A 151 -5.984 -13.298 -11.448 1.00 1.27 C ATOM 2278 OG1 THR A 151 -5.690 -13.252 -12.830 1.00 1.36 O ATOM 2279 CG2 THR A 151 -5.297 -14.528 -10.875 1.00 1.41 C ATOM 0 H THR A 151 -7.503 -11.837 -12.618 1.00 1.17 H new ATOM 0 HA THR A 151 -7.857 -14.372 -11.460 1.00 1.19 H new ATOM 0 HB THR A 151 -5.625 -12.392 -10.959 1.00 1.27 H new ATOM 0 HG1 THR A 151 -5.740 -12.325 -13.144 1.00 1.36 H new ATOM 0 HG21 THR A 151 -4.223 -14.460 -11.051 1.00 1.41 H new ATOM 0 HG22 THR A 151 -5.486 -14.584 -9.803 1.00 1.41 H new ATOM 0 HG23 THR A 151 -5.689 -15.422 -11.360 1.00 1.41 H new ATOM 2287 N LEU A 152 -7.805 -11.921 -9.268 1.00 0.92 N ATOM 2288 CA LEU A 152 -8.142 -11.633 -7.884 1.00 0.81 C ATOM 2289 C LEU A 152 -9.593 -11.991 -7.608 1.00 0.80 C ATOM 2290 O LEU A 152 -9.886 -12.464 -6.519 1.00 0.78 O ATOM 2291 CB LEU A 152 -7.875 -10.162 -7.536 1.00 0.78 C ATOM 2292 CG LEU A 152 -6.383 -9.829 -7.365 1.00 1.00 C ATOM 2293 CD1 LEU A 152 -6.199 -8.308 -7.336 1.00 1.79 C ATOM 2294 CD2 LEU A 152 -5.840 -10.408 -6.053 1.00 1.91 C ATOM 0 H LEU A 152 -7.543 -11.104 -9.820 1.00 0.92 H new ATOM 0 HA LEU A 152 -7.501 -12.245 -7.249 1.00 0.81 H new ATOM 0 HB2 LEU A 152 -8.292 -9.531 -8.321 1.00 0.78 H new ATOM 0 HB3 LEU A 152 -8.402 -9.914 -6.614 1.00 0.78 H new ATOM 0 HG LEU A 152 -5.839 -10.266 -8.202 1.00 1.00 H new ATOM 0 HD11 LEU A 152 -5.142 -8.072 -7.215 1.00 1.79 H new ATOM 0 HD12 LEU A 152 -6.562 -7.880 -8.270 1.00 1.79 H new ATOM 0 HD13 LEU A 152 -6.762 -7.889 -6.502 1.00 1.79 H new ATOM 0 HD21 LEU A 152 -4.783 -10.159 -5.955 1.00 1.91 H new ATOM 0 HD22 LEU A 152 -6.392 -9.986 -5.213 1.00 1.91 H new ATOM 0 HD23 LEU A 152 -5.959 -11.492 -6.057 1.00 1.91 H new ATOM 2306 N LYS A 153 -10.512 -11.802 -8.557 1.00 0.88 N ATOM 2307 CA LYS A 153 -11.904 -12.169 -8.310 1.00 0.98 C ATOM 2308 C LYS A 153 -12.056 -13.678 -8.382 1.00 1.08 C ATOM 2309 O LYS A 153 -12.903 -14.242 -7.701 1.00 1.14 O ATOM 2310 CB LYS A 153 -12.870 -11.475 -9.279 1.00 1.14 C ATOM 2311 CG LYS A 153 -13.117 -10.024 -8.842 1.00 1.36 C ATOM 2312 CD LYS A 153 -14.161 -9.362 -9.750 1.00 2.09 C ATOM 2313 CE LYS A 153 -14.442 -7.907 -9.347 1.00 3.26 C ATOM 2314 NZ LYS A 153 -15.024 -7.800 -7.989 1.00 4.43 N ATOM 0 H LYS A 153 -10.324 -11.408 -9.479 1.00 0.88 H new ATOM 0 HA LYS A 153 -12.167 -11.827 -7.309 1.00 0.98 H new ATOM 0 HB2 LYS A 153 -12.458 -11.492 -10.288 1.00 1.14 H new ATOM 0 HB3 LYS A 153 -13.815 -12.018 -9.311 1.00 1.14 H new ATOM 0 HG2 LYS A 153 -13.460 -10.002 -7.807 1.00 1.36 H new ATOM 0 HG3 LYS A 153 -12.184 -9.462 -8.880 1.00 1.36 H new ATOM 0 HD2 LYS A 153 -13.812 -9.390 -10.782 1.00 2.09 H new ATOM 0 HD3 LYS A 153 -15.088 -9.933 -9.711 1.00 2.09 H new ATOM 0 HE2 LYS A 153 -13.515 -7.336 -9.388 1.00 3.26 H new ATOM 0 HE3 LYS A 153 -15.125 -7.458 -10.068 1.00 3.26 H new ATOM 0 HZ1 LYS A 153 -15.305 -6.815 -7.808 1.00 4.43 H new ATOM 0 HZ2 LYS A 153 -15.858 -8.417 -7.919 1.00 4.43 H new ATOM 0 HZ3 LYS A 153 -14.317 -8.093 -7.284 1.00 4.43 H new ATOM 2328 N GLU A 154 -11.233 -14.346 -9.183 1.00 1.15 N ATOM 2329 CA GLU A 154 -11.296 -15.781 -9.375 1.00 1.28 C ATOM 2330 C GLU A 154 -10.867 -16.457 -8.080 1.00 1.24 C ATOM 2331 O GLU A 154 -11.475 -17.427 -7.647 1.00 1.32 O ATOM 2332 CB GLU A 154 -10.401 -16.170 -10.562 1.00 1.40 C ATOM 2333 CG GLU A 154 -11.208 -16.883 -11.650 1.00 1.74 C ATOM 2334 CD GLU A 154 -10.399 -16.980 -12.944 1.00 2.41 C ATOM 2335 OE1 GLU A 154 -10.619 -16.117 -13.824 1.00 3.61 O ATOM 2336 OE2 GLU A 154 -9.561 -17.903 -13.025 1.00 2.83 O ATOM 0 H GLU A 154 -10.494 -13.895 -9.723 1.00 1.15 H new ATOM 0 HA GLU A 154 -12.309 -16.108 -9.610 1.00 1.28 H new ATOM 0 HB2 GLU A 154 -9.934 -15.277 -10.977 1.00 1.40 H new ATOM 0 HB3 GLU A 154 -9.596 -16.819 -10.217 1.00 1.40 H new ATOM 0 HG2 GLU A 154 -11.483 -17.882 -11.311 1.00 1.74 H new ATOM 0 HG3 GLU A 154 -12.136 -16.343 -11.835 1.00 1.74 H new ATOM 2343 N ALA A 155 -9.834 -15.921 -7.434 1.00 1.15 N ATOM 2344 CA ALA A 155 -9.302 -16.444 -6.190 1.00 1.14 C ATOM 2345 C ALA A 155 -10.153 -16.018 -5.010 1.00 1.02 C ATOM 2346 O ALA A 155 -10.326 -16.797 -4.081 1.00 1.07 O ATOM 2347 CB ALA A 155 -7.858 -15.972 -6.009 1.00 1.14 C ATOM 0 H ALA A 155 -9.338 -15.096 -7.771 1.00 1.15 H new ATOM 0 HA ALA A 155 -9.320 -17.533 -6.235 1.00 1.14 H new ATOM 0 HB1 ALA A 155 -7.461 -16.366 -5.074 1.00 1.14 H new ATOM 0 HB2 ALA A 155 -7.251 -16.330 -6.841 1.00 1.14 H new ATOM 0 HB3 ALA A 155 -7.832 -14.883 -5.984 1.00 1.14 H new ATOM 2353 N VAL A 156 -10.705 -14.808 -5.038 1.00 0.90 N ATOM 2354 CA VAL A 156 -11.677 -14.395 -4.042 1.00 0.87 C ATOM 2355 C VAL A 156 -12.884 -15.324 -4.124 1.00 1.01 C ATOM 2356 O VAL A 156 -13.456 -15.686 -3.105 1.00 1.07 O ATOM 2357 CB VAL A 156 -12.035 -12.919 -4.273 1.00 0.80 C ATOM 2358 CG1 VAL A 156 -13.375 -12.520 -3.663 1.00 0.84 C ATOM 2359 CG2 VAL A 156 -10.927 -12.040 -3.682 1.00 0.73 C ATOM 0 H VAL A 156 -10.493 -14.100 -5.741 1.00 0.90 H new ATOM 0 HA VAL A 156 -11.274 -14.471 -3.032 1.00 0.87 H new ATOM 0 HB VAL A 156 -12.124 -12.774 -5.350 1.00 0.80 H new ATOM 0 HG11 VAL A 156 -13.566 -11.466 -3.863 1.00 0.84 H new ATOM 0 HG12 VAL A 156 -14.169 -13.123 -4.104 1.00 0.84 H new ATOM 0 HG13 VAL A 156 -13.348 -12.686 -2.586 1.00 0.84 H new ATOM 0 HG21 VAL A 156 -11.172 -10.990 -3.841 1.00 0.73 H new ATOM 0 HG22 VAL A 156 -10.840 -12.234 -2.613 1.00 0.73 H new ATOM 0 HG23 VAL A 156 -9.980 -12.270 -4.171 1.00 0.73 H new ATOM 2369 N ALA A 157 -13.256 -15.754 -5.327 1.00 1.13 N ATOM 2370 CA ALA A 157 -14.412 -16.622 -5.474 1.00 1.31 C ATOM 2371 C ALA A 157 -14.057 -17.989 -4.914 1.00 1.37 C ATOM 2372 O ALA A 157 -14.769 -18.545 -4.091 1.00 1.46 O ATOM 2373 CB ALA A 157 -14.828 -16.693 -6.945 1.00 1.46 C ATOM 0 H ALA A 157 -12.781 -15.519 -6.198 1.00 1.13 H new ATOM 0 HA ALA A 157 -15.265 -16.229 -4.921 1.00 1.31 H new ATOM 0 HB1 ALA A 157 -15.695 -17.346 -7.047 1.00 1.46 H new ATOM 0 HB2 ALA A 157 -15.082 -15.694 -7.300 1.00 1.46 H new ATOM 0 HB3 ALA A 157 -14.004 -17.090 -7.537 1.00 1.46 H new ATOM 2379 N ARG A 158 -12.913 -18.526 -5.333 1.00 1.36 N ATOM 2380 CA ARG A 158 -12.440 -19.824 -4.889 1.00 1.45 C ATOM 2381 C ARG A 158 -12.047 -19.823 -3.412 1.00 1.37 C ATOM 2382 O ARG A 158 -11.785 -20.889 -2.861 1.00 1.46 O ATOM 2383 CB ARG A 158 -11.282 -20.274 -5.788 1.00 1.54 C ATOM 2384 CG ARG A 158 -11.511 -21.681 -6.340 1.00 1.82 C ATOM 2385 CD ARG A 158 -10.501 -21.929 -7.468 1.00 1.85 C ATOM 2386 NE ARG A 158 -9.982 -23.302 -7.463 1.00 2.08 N ATOM 2387 CZ ARG A 158 -9.067 -23.761 -6.599 1.00 2.86 C ATOM 2388 NH1 ARG A 158 -8.587 -24.999 -6.725 1.00 3.59 N ATOM 2389 NH2 ARG A 158 -8.634 -22.979 -5.609 1.00 3.71 N ATOM 0 H ARG A 158 -12.288 -18.065 -5.994 1.00 1.36 H new ATOM 0 HA ARG A 158 -13.257 -20.540 -4.977 1.00 1.45 H new ATOM 0 HB2 ARG A 158 -11.169 -19.572 -6.614 1.00 1.54 H new ATOM 0 HB3 ARG A 158 -10.351 -20.252 -5.221 1.00 1.54 H new ATOM 0 HG2 ARG A 158 -11.388 -22.423 -5.551 1.00 1.82 H new ATOM 0 HG3 ARG A 158 -12.530 -21.780 -6.715 1.00 1.82 H new ATOM 0 HD2 ARG A 158 -10.976 -21.727 -8.428 1.00 1.85 H new ATOM 0 HD3 ARG A 158 -9.671 -21.229 -7.369 1.00 1.85 H new ATOM 0 HE ARG A 158 -10.342 -23.950 -8.164 1.00 2.08 H new ATOM 0 HH11 ARG A 158 -8.917 -25.599 -7.481 1.00 3.59 H new ATOM 0 HH12 ARG A 158 -7.890 -25.345 -6.065 1.00 3.59 H new ATOM 0 HH21 ARG A 158 -9.000 -22.032 -5.510 1.00 3.71 H new ATOM 0 HH22 ARG A 158 -7.937 -23.328 -4.951 1.00 3.71 H new ATOM 2403 N ARG A 159 -11.945 -18.652 -2.776 1.00 1.25 N ATOM 2404 CA ARG A 159 -11.709 -18.574 -1.340 1.00 1.20 C ATOM 2405 C ARG A 159 -12.920 -19.029 -0.536 1.00 1.31 C ATOM 2406 O ARG A 159 -12.717 -19.483 0.589 1.00 1.56 O ATOM 2407 CB ARG A 159 -11.303 -17.151 -0.919 1.00 1.33 C ATOM 2408 CG ARG A 159 -9.782 -17.019 -0.892 1.00 1.70 C ATOM 2409 CD ARG A 159 -9.213 -17.701 0.363 1.00 2.24 C ATOM 2410 NE ARG A 159 -7.986 -18.458 0.073 1.00 2.98 N ATOM 2411 CZ ARG A 159 -6.853 -17.953 -0.430 1.00 3.38 C ATOM 2412 NH1 ARG A 159 -5.861 -18.775 -0.780 1.00 4.45 N ATOM 2413 NH2 ARG A 159 -6.723 -16.636 -0.593 1.00 3.84 N ATOM 0 H ARG A 159 -12.023 -17.746 -3.238 1.00 1.25 H new ATOM 0 HA ARG A 159 -10.886 -19.254 -1.122 1.00 1.20 H new ATOM 0 HB2 ARG A 159 -11.725 -16.425 -1.613 1.00 1.33 H new ATOM 0 HB3 ARG A 159 -11.712 -16.925 0.066 1.00 1.33 H new ATOM 0 HG2 ARG A 159 -9.354 -17.472 -1.787 1.00 1.70 H new ATOM 0 HG3 ARG A 159 -9.501 -15.966 -0.902 1.00 1.70 H new ATOM 0 HD2 ARG A 159 -9.002 -16.947 1.121 1.00 2.24 H new ATOM 0 HD3 ARG A 159 -9.963 -18.373 0.781 1.00 2.24 H new ATOM 0 HE ARG A 159 -8.000 -19.458 0.273 1.00 2.98 H new ATOM 0 HH11 ARG A 159 -5.969 -19.783 -0.664 1.00 4.45 H new ATOM 0 HH12 ARG A 159 -4.996 -18.395 -1.164 1.00 4.45 H new ATOM 0 HH21 ARG A 159 -7.487 -16.012 -0.334 1.00 3.84 H new ATOM 0 HH22 ARG A 159 -5.859 -16.252 -0.976 1.00 3.84 H new ATOM 2427 N GLU A 160 -14.144 -18.866 -1.040 1.00 1.36 N ATOM 2428 CA GLU A 160 -15.339 -19.088 -0.243 1.00 1.58 C ATOM 2429 C GLU A 160 -16.493 -19.559 -1.125 1.00 2.45 C ATOM 2430 O GLU A 160 -17.632 -19.098 -0.907 1.00 3.46 O ATOM 2431 CB GLU A 160 -15.630 -17.824 0.591 1.00 3.03 C ATOM 2432 CG GLU A 160 -15.883 -16.547 -0.241 1.00 3.66 C ATOM 2433 CD GLU A 160 -15.271 -15.263 0.354 1.00 5.86 C ATOM 2434 OE1 GLU A 160 -15.312 -14.224 -0.346 1.00 6.66 O ATOM 2435 OE2 GLU A 160 -14.751 -15.298 1.496 1.00 7.26 O ATOM 0 H GLU A 160 -14.328 -18.580 -2.001 1.00 1.36 H new ATOM 0 HA GLU A 160 -15.190 -19.898 0.471 1.00 1.58 H new ATOM 0 HB2 GLU A 160 -16.502 -18.011 1.218 1.00 3.03 H new ATOM 0 HB3 GLU A 160 -14.788 -17.645 1.260 1.00 3.03 H new ATOM 0 HG2 GLU A 160 -15.480 -16.696 -1.243 1.00 3.66 H new ATOM 0 HG3 GLU A 160 -16.959 -16.406 -0.348 1.00 3.66 H new