USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1047 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 107 MET CE :methyl -130:sc= -3.98! (180deg=-3.53!) USER MOD Set 1.2: A 139 CYS SG : rot -61:sc= -1.2 USER MOD Set 2.1: A 133 LYS NZ :NH3+ 172:sc=-0.00353 (180deg=-0.0698) USER MOD Set 2.2: A 137 GLN :FLIP amide:sc= -1.01 F(o=-2.1!,f=-1) USER MOD Set 3.1: A 75 THR OG1 : rot 140:sc= 1.89 USER MOD Set 3.2: A 77 CYS SG : rot 1:sc= 2.28 USER MOD Set 4.1: A 58 ASN : amide:sc= -3.25! C(o=-2.6!,f=-8.2!) USER MOD Set 4.2: A 61 ASN : amide:sc= 0.623 K(o=-2.6,f=-8.2) USER MOD Set 5.1: A 46 ASN : amide:sc= -0.44! C(o=-0.4!,f=-1.9!) USER MOD Set 5.2: A 49 LYS NZ :NH3+ -128:sc= 0.042 (180deg=0) USER MOD Set 6.1: A 36 ASN : amide:sc= 0.395 K(o=0.92,f=-0.94) USER MOD Set 6.2: A 51 TYR OH : rot 12:sc= 0.528 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -175:sc= 0.0207 (180deg=0.0182) USER MOD Single : A 33 THR OG1 : rot 77:sc= 0.938 USER MOD Single : A 34 GLN : amide:sc= 1.12 K(o=1.1,f=-1.3!) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -122:sc= 0.972 (180deg=0.192) USER MOD Single : A 42 LYS NZ :NH3+ -129:sc= 0.693 (180deg=-0.0829) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 76:sc= 1.29 USER MOD Single : A 53 GLN : amide:sc= -1.36 X(o=-1.4,f=-1.2) USER MOD Single : A 60 SER OG : rot 180:sc=-0.00201 USER MOD Single : A 64 TYR OH : rot 35:sc= 0.0204 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN :FLIP amide:sc= -0.23 F(o=-1.4!,f=-0.23) USER MOD Single : A 69 SER OG : rot -15:sc= 1.33 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 86 THR OG1 : rot 65:sc= -0.144! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0158) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 28:sc= 0.309 USER MOD Single : A 100 TYR OH : rot -105:sc= 0.602 USER MOD Single : A 105 SER OG : rot 180:sc= -0.351 USER MOD Single : A 106 ASN : amide:sc= 0.0356 K(o=0.036,f=-1.9!) USER MOD Single : A 111 LYS NZ :NH3+ -167:sc=-0.00438 (180deg=-0.161) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 73:sc= 1.14 USER MOD Single : A 124 LYS NZ :NH3+ -148:sc= 1.25 (180deg=1.08) USER MOD Single : A 126 LYS NZ :NH3+ 157:sc= 1.12 (180deg=-0.459!) USER MOD Single : A 128 HIS : no HD1:sc= -0.0353 X(o=-0.035,f=0) USER MOD Single : A 130 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.109) USER MOD Single : A 134 MET CE :methyl -157:sc= -0.3 (180deg=-1.09) USER MOD Single : A 135 LYS NZ :NH3+ -118:sc= 0.614 (180deg=-0.0443) USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 146 LYS NZ :NH3+ 168:sc= -0.0161 (180deg=-0.205) USER MOD ----------------------------------------------------------------- ATOM 27 N PRO A 19 -18.455 -14.700 6.014 1.00 0.78 N ATOM 28 CA PRO A 19 -18.061 -13.566 5.205 1.00 0.70 C ATOM 29 C PRO A 19 -19.290 -12.773 4.815 1.00 0.65 C ATOM 30 O PRO A 19 -20.304 -13.364 4.427 1.00 0.70 O ATOM 31 CB PRO A 19 -17.436 -14.175 3.953 1.00 0.71 C ATOM 32 CG PRO A 19 -17.241 -15.634 4.229 1.00 0.75 C ATOM 33 CD PRO A 19 -17.758 -15.929 5.616 1.00 0.84 C ATOM 0 HA PRO A 19 -17.378 -12.899 5.731 1.00 0.70 H new ATOM 0 HB2 PRO A 19 -18.083 -14.029 3.088 1.00 0.71 H new ATOM 0 HB3 PRO A 19 -16.485 -13.695 3.724 1.00 0.71 H new ATOM 0 HG2 PRO A 19 -17.772 -16.234 3.490 1.00 0.75 H new ATOM 0 HG3 PRO A 19 -16.186 -15.897 4.154 1.00 0.75 H new ATOM 0 HD2 PRO A 19 -18.432 -16.786 5.615 1.00 0.84 H new ATOM 0 HD3 PRO A 19 -16.944 -16.164 6.302 1.00 0.84 H new ATOM 41 N PRO A 20 -19.240 -11.446 4.938 1.00 0.58 N ATOM 42 CA PRO A 20 -20.367 -10.599 4.587 1.00 0.54 C ATOM 43 C PRO A 20 -20.878 -10.938 3.199 1.00 0.55 C ATOM 44 O PRO A 20 -20.140 -11.460 2.360 1.00 0.58 O ATOM 45 CB PRO A 20 -19.796 -9.188 4.644 1.00 0.49 C ATOM 46 CG PRO A 20 -18.657 -9.291 5.602 1.00 0.50 C ATOM 47 CD PRO A 20 -18.088 -10.672 5.416 1.00 0.56 C ATOM 0 HA PRO A 20 -21.220 -10.725 5.253 1.00 0.54 H new ATOM 0 HB2 PRO A 20 -19.461 -8.854 3.662 1.00 0.49 H new ATOM 0 HB3 PRO A 20 -20.541 -8.471 4.987 1.00 0.49 H new ATOM 0 HG2 PRO A 20 -17.905 -8.528 5.399 1.00 0.50 H new ATOM 0 HG3 PRO A 20 -18.994 -9.142 6.628 1.00 0.50 H new ATOM 0 HD2 PRO A 20 -17.271 -10.677 4.694 1.00 0.56 H new ATOM 0 HD3 PRO A 20 -17.692 -11.074 6.349 1.00 0.56 H new ATOM 55 N ALA A 21 -22.138 -10.671 2.971 1.00 0.56 N ATOM 56 CA ALA A 21 -22.800 -11.140 1.777 1.00 0.63 C ATOM 57 C ALA A 21 -22.234 -10.508 0.505 1.00 0.60 C ATOM 58 O ALA A 21 -21.472 -9.548 0.553 1.00 0.60 O ATOM 59 CB ALA A 21 -24.289 -10.883 1.897 1.00 0.72 C ATOM 0 H ALA A 21 -22.731 -10.128 3.599 1.00 0.56 H new ATOM 0 HA ALA A 21 -22.619 -12.211 1.689 1.00 0.63 H new ATOM 0 HB1 ALA A 21 -24.793 -11.236 0.997 1.00 0.72 H new ATOM 0 HB2 ALA A 21 -24.681 -11.414 2.764 1.00 0.72 H new ATOM 0 HB3 ALA A 21 -24.465 -9.814 2.016 1.00 0.72 H new ATOM 65 N ASP A 22 -22.656 -11.084 -0.609 1.00 0.64 N ATOM 66 CA ASP A 22 -22.372 -10.625 -1.972 1.00 0.70 C ATOM 67 C ASP A 22 -22.410 -9.106 -2.083 1.00 0.67 C ATOM 68 O ASP A 22 -21.383 -8.479 -1.880 1.00 1.01 O ATOM 69 CB ASP A 22 -23.347 -11.277 -2.963 1.00 1.01 C ATOM 70 CG ASP A 22 -23.097 -10.876 -4.406 1.00 1.54 C ATOM 71 OD1 ASP A 22 -22.121 -11.367 -5.009 1.00 1.66 O ATOM 72 OD2 ASP A 22 -23.887 -10.074 -4.946 1.00 2.34 O ATOM 0 H ASP A 22 -23.234 -11.925 -0.594 1.00 0.64 H new ATOM 0 HA ASP A 22 -21.357 -10.933 -2.223 1.00 0.70 H new ATOM 0 HB2 ASP A 22 -23.271 -12.361 -2.876 1.00 1.01 H new ATOM 0 HB3 ASP A 22 -24.367 -11.006 -2.690 1.00 1.01 H new ATOM 77 N GLY A 23 -23.510 -8.556 -2.597 1.00 0.72 N ATOM 78 CA GLY A 23 -23.689 -7.103 -2.700 1.00 0.69 C ATOM 79 C GLY A 23 -22.843 -6.278 -1.728 1.00 0.61 C ATOM 80 O GLY A 23 -22.202 -5.321 -2.146 1.00 0.60 O ATOM 0 H GLY A 23 -24.298 -9.098 -2.952 1.00 0.72 H new ATOM 0 HA2 GLY A 23 -23.451 -6.794 -3.718 1.00 0.69 H new ATOM 0 HA3 GLY A 23 -24.740 -6.869 -2.533 1.00 0.69 H new ATOM 84 N ALA A 24 -22.834 -6.643 -0.445 1.00 0.59 N ATOM 85 CA ALA A 24 -21.991 -5.964 0.545 1.00 0.55 C ATOM 86 C ALA A 24 -20.504 -6.082 0.185 1.00 0.48 C ATOM 87 O ALA A 24 -19.802 -5.078 0.064 1.00 0.44 O ATOM 88 CB ALA A 24 -22.245 -6.534 1.936 1.00 0.56 C ATOM 0 H ALA A 24 -23.399 -7.403 -0.066 1.00 0.59 H new ATOM 0 HA ALA A 24 -22.255 -4.906 0.542 1.00 0.55 H new ATOM 0 HB1 ALA A 24 -21.613 -6.021 2.661 1.00 0.56 H new ATOM 0 HB2 ALA A 24 -23.292 -6.391 2.202 1.00 0.56 H new ATOM 0 HB3 ALA A 24 -22.012 -7.599 1.941 1.00 0.56 H new ATOM 94 N LEU A 25 -20.045 -7.314 -0.003 1.00 0.49 N ATOM 95 CA LEU A 25 -18.652 -7.600 -0.347 1.00 0.48 C ATOM 96 C LEU A 25 -18.243 -6.969 -1.667 1.00 0.51 C ATOM 97 O LEU A 25 -17.200 -6.322 -1.758 1.00 0.53 O ATOM 98 CB LEU A 25 -18.418 -9.115 -0.405 1.00 0.47 C ATOM 99 CG LEU A 25 -18.230 -9.787 0.950 1.00 0.48 C ATOM 100 CD1 LEU A 25 -17.150 -10.852 0.885 1.00 0.53 C ATOM 101 CD2 LEU A 25 -17.896 -8.752 1.998 1.00 0.49 C ATOM 0 H LEU A 25 -20.628 -8.147 0.078 1.00 0.49 H new ATOM 0 HA LEU A 25 -18.034 -7.161 0.436 1.00 0.48 H new ATOM 0 HB2 LEU A 25 -19.265 -9.580 -0.911 1.00 0.47 H new ATOM 0 HB3 LEU A 25 -17.536 -9.309 -1.016 1.00 0.47 H new ATOM 0 HG LEU A 25 -19.164 -10.277 1.225 1.00 0.48 H new ATOM 0 HD11 LEU A 25 -17.036 -11.315 1.865 1.00 0.53 H new ATOM 0 HD12 LEU A 25 -17.431 -11.611 0.155 1.00 0.53 H new ATOM 0 HD13 LEU A 25 -16.206 -10.395 0.588 1.00 0.53 H new ATOM 0 HD21 LEU A 25 -17.763 -9.241 2.963 1.00 0.49 H new ATOM 0 HD22 LEU A 25 -16.975 -8.239 1.722 1.00 0.49 H new ATOM 0 HD23 LEU A 25 -18.708 -8.028 2.067 1.00 0.49 H new ATOM 113 N LYS A 26 -19.065 -7.145 -2.689 1.00 0.55 N ATOM 114 CA LYS A 26 -18.759 -6.594 -4.002 1.00 0.59 C ATOM 115 C LYS A 26 -18.809 -5.069 -3.945 1.00 0.52 C ATOM 116 O LYS A 26 -18.223 -4.386 -4.780 1.00 0.53 O ATOM 117 CB LYS A 26 -19.746 -7.107 -5.048 1.00 0.68 C ATOM 118 CG LYS A 26 -20.914 -6.168 -5.261 1.00 0.73 C ATOM 119 CD LYS A 26 -22.113 -6.878 -5.865 1.00 0.82 C ATOM 120 CE LYS A 26 -23.272 -5.915 -6.066 1.00 0.93 C ATOM 121 NZ LYS A 26 -24.395 -6.540 -6.809 1.00 1.53 N ATOM 0 H LYS A 26 -19.943 -7.661 -2.637 1.00 0.55 H new ATOM 0 HA LYS A 26 -17.757 -6.914 -4.288 1.00 0.59 H new ATOM 0 HB2 LYS A 26 -19.224 -7.251 -5.994 1.00 0.68 H new ATOM 0 HB3 LYS A 26 -20.121 -8.083 -4.739 1.00 0.68 H new ATOM 0 HG2 LYS A 26 -21.199 -5.722 -4.308 1.00 0.73 H new ATOM 0 HG3 LYS A 26 -20.608 -5.352 -5.916 1.00 0.73 H new ATOM 0 HD2 LYS A 26 -21.834 -7.321 -6.821 1.00 0.82 H new ATOM 0 HD3 LYS A 26 -22.423 -7.695 -5.213 1.00 0.82 H new ATOM 0 HE2 LYS A 26 -23.628 -5.569 -5.096 1.00 0.93 H new ATOM 0 HE3 LYS A 26 -22.923 -5.037 -6.609 1.00 0.93 H new ATOM 0 HZ1 LYS A 26 -25.163 -5.848 -6.923 1.00 1.53 H new ATOM 0 HZ2 LYS A 26 -24.063 -6.847 -7.746 1.00 1.53 H new ATOM 0 HZ3 LYS A 26 -24.746 -7.363 -6.279 1.00 1.53 H new ATOM 135 N ARG A 27 -19.529 -4.545 -2.958 1.00 0.49 N ATOM 136 CA ARG A 27 -19.619 -3.110 -2.767 1.00 0.45 C ATOM 137 C ARG A 27 -18.368 -2.603 -2.070 1.00 0.39 C ATOM 138 O ARG A 27 -17.966 -1.461 -2.259 1.00 0.37 O ATOM 139 CB ARG A 27 -20.870 -2.741 -1.969 1.00 0.49 C ATOM 140 CG ARG A 27 -20.995 -1.259 -1.640 1.00 0.45 C ATOM 141 CD ARG A 27 -20.936 -0.409 -2.895 1.00 0.51 C ATOM 142 NE ARG A 27 -21.393 0.960 -2.667 1.00 1.11 N ATOM 143 CZ ARG A 27 -21.877 1.754 -3.623 1.00 1.29 C ATOM 144 NH1 ARG A 27 -21.971 1.317 -4.875 1.00 1.01 N ATOM 145 NH2 ARG A 27 -22.265 2.987 -3.321 1.00 2.11 N ATOM 0 H ARG A 27 -20.057 -5.096 -2.281 1.00 0.49 H new ATOM 0 HA ARG A 27 -19.697 -2.633 -3.744 1.00 0.45 H new ATOM 0 HB2 ARG A 27 -21.750 -3.050 -2.533 1.00 0.49 H new ATOM 0 HB3 ARG A 27 -20.872 -3.308 -1.038 1.00 0.49 H new ATOM 0 HG2 ARG A 27 -21.935 -1.078 -1.119 1.00 0.45 H new ATOM 0 HG3 ARG A 27 -20.194 -0.966 -0.962 1.00 0.45 H new ATOM 0 HD2 ARG A 27 -19.912 -0.389 -3.268 1.00 0.51 H new ATOM 0 HD3 ARG A 27 -21.549 -0.869 -3.670 1.00 0.51 H new ATOM 0 HE ARG A 27 -21.339 1.331 -1.718 1.00 1.11 H new ATOM 0 HH11 ARG A 27 -21.672 0.370 -5.108 1.00 1.01 H new ATOM 0 HH12 ARG A 27 -22.342 1.929 -5.602 1.00 1.01 H new ATOM 0 HH21 ARG A 27 -22.192 3.324 -2.361 1.00 2.11 H new ATOM 0 HH22 ARG A 27 -22.636 3.598 -4.049 1.00 2.11 H new ATOM 159 N ALA A 28 -17.747 -3.455 -1.265 1.00 0.39 N ATOM 160 CA ALA A 28 -16.460 -3.114 -0.686 1.00 0.37 C ATOM 161 C ALA A 28 -15.451 -2.970 -1.819 1.00 0.37 C ATOM 162 O ALA A 28 -14.639 -2.045 -1.848 1.00 0.36 O ATOM 163 CB ALA A 28 -16.016 -4.170 0.330 1.00 0.42 C ATOM 0 H ALA A 28 -18.108 -4.372 -1.003 1.00 0.39 H new ATOM 0 HA ALA A 28 -16.534 -2.172 -0.143 1.00 0.37 H new ATOM 0 HB1 ALA A 28 -15.049 -3.889 0.748 1.00 0.42 H new ATOM 0 HB2 ALA A 28 -16.752 -4.236 1.131 1.00 0.42 H new ATOM 0 HB3 ALA A 28 -15.930 -5.137 -0.165 1.00 0.42 H new ATOM 169 N GLU A 29 -15.566 -3.883 -2.771 1.00 0.43 N ATOM 170 CA GLU A 29 -14.799 -3.843 -4.007 1.00 0.47 C ATOM 171 C GLU A 29 -15.218 -2.654 -4.872 1.00 0.45 C ATOM 172 O GLU A 29 -14.422 -2.107 -5.638 1.00 0.48 O ATOM 173 CB GLU A 29 -15.022 -5.155 -4.752 1.00 0.55 C ATOM 174 CG GLU A 29 -13.900 -6.162 -4.547 1.00 0.84 C ATOM 175 CD GLU A 29 -12.555 -5.652 -5.019 1.00 1.52 C ATOM 176 OE1 GLU A 29 -12.286 -5.718 -6.235 1.00 1.83 O ATOM 177 OE2 GLU A 29 -11.771 -5.161 -4.177 1.00 2.41 O ATOM 0 H GLU A 29 -16.200 -4.680 -2.707 1.00 0.43 H new ATOM 0 HA GLU A 29 -13.740 -3.720 -3.778 1.00 0.47 H new ATOM 0 HB2 GLU A 29 -15.962 -5.597 -4.422 1.00 0.55 H new ATOM 0 HB3 GLU A 29 -15.124 -4.947 -5.817 1.00 0.55 H new ATOM 0 HG2 GLU A 29 -13.835 -6.416 -3.489 1.00 0.84 H new ATOM 0 HG3 GLU A 29 -14.142 -7.081 -5.081 1.00 0.84 H new ATOM 184 N GLU A 30 -16.471 -2.261 -4.726 1.00 0.43 N ATOM 185 CA GLU A 30 -17.029 -1.132 -5.454 1.00 0.44 C ATOM 186 C GLU A 30 -16.400 0.153 -4.956 1.00 0.41 C ATOM 187 O GLU A 30 -15.886 0.951 -5.729 1.00 0.48 O ATOM 188 CB GLU A 30 -18.531 -1.058 -5.216 1.00 0.47 C ATOM 189 CG GLU A 30 -19.373 -0.931 -6.463 1.00 0.64 C ATOM 190 CD GLU A 30 -18.796 0.024 -7.489 1.00 1.23 C ATOM 191 OE1 GLU A 30 -18.796 1.241 -7.223 1.00 1.52 O ATOM 192 OE2 GLU A 30 -18.375 -0.432 -8.572 1.00 1.72 O ATOM 0 H GLU A 30 -17.133 -2.716 -4.098 1.00 0.43 H new ATOM 0 HA GLU A 30 -16.827 -1.262 -6.517 1.00 0.44 H new ATOM 0 HB2 GLU A 30 -18.842 -1.953 -4.676 1.00 0.47 H new ATOM 0 HB3 GLU A 30 -18.739 -0.206 -4.568 1.00 0.47 H new ATOM 0 HG2 GLU A 30 -19.485 -1.915 -6.918 1.00 0.64 H new ATOM 0 HG3 GLU A 30 -20.371 -0.593 -6.185 1.00 0.64 H new ATOM 199 N LEU A 31 -16.449 0.329 -3.645 1.00 0.36 N ATOM 200 CA LEU A 31 -15.917 1.514 -2.999 1.00 0.36 C ATOM 201 C LEU A 31 -14.417 1.606 -3.205 1.00 0.37 C ATOM 202 O LEU A 31 -13.868 2.696 -3.316 1.00 0.41 O ATOM 203 CB LEU A 31 -16.254 1.485 -1.512 1.00 0.35 C ATOM 204 CG LEU A 31 -17.746 1.420 -1.197 1.00 0.37 C ATOM 205 CD1 LEU A 31 -17.958 1.212 0.286 1.00 0.37 C ATOM 206 CD2 LEU A 31 -18.456 2.681 -1.649 1.00 0.42 C ATOM 0 H LEU A 31 -16.859 -0.347 -3.001 1.00 0.36 H new ATOM 0 HA LEU A 31 -16.374 2.396 -3.447 1.00 0.36 H new ATOM 0 HB2 LEU A 31 -15.763 0.624 -1.059 1.00 0.35 H new ATOM 0 HB3 LEU A 31 -15.836 2.375 -1.041 1.00 0.35 H new ATOM 0 HG LEU A 31 -18.169 0.576 -1.742 1.00 0.37 H new ATOM 0 HD11 LEU A 31 -19.026 1.167 0.498 1.00 0.37 H new ATOM 0 HD12 LEU A 31 -17.488 0.278 0.593 1.00 0.37 H new ATOM 0 HD13 LEU A 31 -17.513 2.041 0.837 1.00 0.37 H new ATOM 0 HD21 LEU A 31 -19.517 2.606 -1.412 1.00 0.42 H new ATOM 0 HD22 LEU A 31 -18.029 3.543 -1.136 1.00 0.42 H new ATOM 0 HD23 LEU A 31 -18.333 2.802 -2.725 1.00 0.42 H new ATOM 218 N LYS A 32 -13.759 0.453 -3.268 1.00 0.37 N ATOM 219 CA LYS A 32 -12.346 0.403 -3.610 1.00 0.41 C ATOM 220 C LYS A 32 -12.147 1.019 -4.989 1.00 0.43 C ATOM 221 O LYS A 32 -11.229 1.805 -5.214 1.00 0.47 O ATOM 222 CB LYS A 32 -11.849 -1.043 -3.615 1.00 0.44 C ATOM 223 CG LYS A 32 -10.335 -1.167 -3.554 1.00 0.76 C ATOM 224 CD LYS A 32 -9.864 -2.590 -3.819 1.00 0.70 C ATOM 225 CE LYS A 32 -9.750 -2.876 -5.305 1.00 0.67 C ATOM 226 NZ LYS A 32 -9.094 -4.183 -5.562 1.00 1.15 N ATOM 0 H LYS A 32 -14.183 -0.457 -3.087 1.00 0.37 H new ATOM 0 HA LYS A 32 -11.777 0.962 -2.867 1.00 0.41 H new ATOM 0 HB2 LYS A 32 -12.283 -1.570 -2.765 1.00 0.44 H new ATOM 0 HB3 LYS A 32 -12.210 -1.539 -4.516 1.00 0.44 H new ATOM 0 HG2 LYS A 32 -9.887 -0.495 -4.287 1.00 0.76 H new ATOM 0 HG3 LYS A 32 -9.985 -0.847 -2.573 1.00 0.76 H new ATOM 0 HD2 LYS A 32 -8.896 -2.748 -3.343 1.00 0.70 H new ATOM 0 HD3 LYS A 32 -10.561 -3.294 -3.365 1.00 0.70 H new ATOM 0 HE2 LYS A 32 -10.743 -2.872 -5.754 1.00 0.67 H new ATOM 0 HE3 LYS A 32 -9.180 -2.081 -5.786 1.00 0.67 H new ATOM 0 HZ1 LYS A 32 -8.956 -4.307 -6.585 1.00 1.15 H new ATOM 0 HZ2 LYS A 32 -8.171 -4.208 -5.083 1.00 1.15 H new ATOM 0 HZ3 LYS A 32 -9.694 -4.950 -5.198 1.00 1.15 H new ATOM 240 N THR A 33 -13.053 0.679 -5.892 1.00 0.43 N ATOM 241 CA THR A 33 -13.021 1.170 -7.256 1.00 0.47 C ATOM 242 C THR A 33 -13.365 2.659 -7.296 1.00 0.47 C ATOM 243 O THR A 33 -12.699 3.445 -7.971 1.00 0.52 O ATOM 244 CB THR A 33 -14.009 0.370 -8.133 1.00 0.49 C ATOM 245 OG1 THR A 33 -13.633 -1.015 -8.141 1.00 0.50 O ATOM 246 CG2 THR A 33 -14.049 0.901 -9.557 1.00 0.57 C ATOM 0 H THR A 33 -13.833 0.052 -5.696 1.00 0.43 H new ATOM 0 HA THR A 33 -12.013 1.037 -7.650 1.00 0.47 H new ATOM 0 HB THR A 33 -15.006 0.481 -7.707 1.00 0.49 H new ATOM 0 HG1 THR A 33 -13.902 -1.432 -7.296 1.00 0.50 H new ATOM 0 HG21 THR A 33 -14.755 0.314 -10.145 1.00 0.57 H new ATOM 0 HG22 THR A 33 -14.365 1.944 -9.548 1.00 0.57 H new ATOM 0 HG23 THR A 33 -13.056 0.826 -10.001 1.00 0.57 H new ATOM 254 N GLN A 34 -14.401 3.041 -6.556 1.00 0.44 N ATOM 255 CA GLN A 34 -14.788 4.443 -6.436 1.00 0.46 C ATOM 256 C GLN A 34 -13.668 5.273 -5.835 1.00 0.46 C ATOM 257 O GLN A 34 -13.453 6.417 -6.224 1.00 0.51 O ATOM 258 CB GLN A 34 -16.037 4.574 -5.575 1.00 0.48 C ATOM 259 CG GLN A 34 -17.202 3.792 -6.125 1.00 0.50 C ATOM 260 CD GLN A 34 -18.524 4.172 -5.496 1.00 0.75 C ATOM 261 OE1 GLN A 34 -18.719 5.309 -5.065 1.00 1.50 O ATOM 262 NE2 GLN A 34 -19.449 3.231 -5.469 1.00 1.31 N ATOM 0 H GLN A 34 -14.990 2.397 -6.028 1.00 0.44 H new ATOM 0 HA GLN A 34 -14.996 4.817 -7.438 1.00 0.46 H new ATOM 0 HB2 GLN A 34 -15.816 4.228 -4.565 1.00 0.48 H new ATOM 0 HB3 GLN A 34 -16.313 5.626 -5.499 1.00 0.48 H new ATOM 0 HG2 GLN A 34 -17.261 3.949 -7.202 1.00 0.50 H new ATOM 0 HG3 GLN A 34 -17.024 2.728 -5.967 1.00 0.50 H new ATOM 0 HE21 GLN A 34 -19.243 2.303 -5.838 1.00 1.31 H new ATOM 0 HE22 GLN A 34 -20.370 3.432 -5.080 1.00 1.31 H new ATOM 271 N ALA A 35 -12.955 4.693 -4.891 1.00 0.43 N ATOM 272 CA ALA A 35 -11.835 5.370 -4.267 1.00 0.44 C ATOM 273 C ALA A 35 -10.680 5.510 -5.248 1.00 0.48 C ATOM 274 O ALA A 35 -9.906 6.456 -5.163 1.00 0.50 O ATOM 275 CB ALA A 35 -11.402 4.633 -3.022 1.00 0.42 C ATOM 0 H ALA A 35 -13.131 3.752 -4.538 1.00 0.43 H new ATOM 0 HA ALA A 35 -12.152 6.371 -3.976 1.00 0.44 H new ATOM 0 HB1 ALA A 35 -10.560 5.154 -2.565 1.00 0.42 H new ATOM 0 HB2 ALA A 35 -12.231 4.594 -2.316 1.00 0.42 H new ATOM 0 HB3 ALA A 35 -11.101 3.619 -3.285 1.00 0.42 H new ATOM 281 N ASN A 36 -10.576 4.574 -6.187 1.00 0.53 N ATOM 282 CA ASN A 36 -9.597 4.690 -7.267 1.00 0.61 C ATOM 283 C ASN A 36 -9.990 5.839 -8.182 1.00 0.63 C ATOM 284 O ASN A 36 -9.141 6.516 -8.764 1.00 0.67 O ATOM 285 CB ASN A 36 -9.501 3.393 -8.080 1.00 0.69 C ATOM 286 CG ASN A 36 -8.987 2.217 -7.273 1.00 1.28 C ATOM 287 OD1 ASN A 36 -8.242 2.383 -6.312 1.00 1.88 O ATOM 288 ND2 ASN A 36 -9.379 1.014 -7.667 1.00 2.01 N ATOM 0 H ASN A 36 -11.152 3.733 -6.224 1.00 0.53 H new ATOM 0 HA ASN A 36 -8.620 4.881 -6.823 1.00 0.61 H new ATOM 0 HB2 ASN A 36 -10.485 3.149 -8.479 1.00 0.69 H new ATOM 0 HB3 ASN A 36 -8.842 3.555 -8.933 1.00 0.69 H new ATOM 0 HD21 ASN A 36 -9.061 0.184 -7.166 1.00 2.01 H new ATOM 0 HD22 ASN A 36 -9.999 0.918 -8.471 1.00 2.01 H new ATOM 295 N ASP A 37 -11.296 6.057 -8.288 1.00 0.63 N ATOM 296 CA ASP A 37 -11.840 7.169 -9.054 1.00 0.68 C ATOM 297 C ASP A 37 -11.508 8.479 -8.358 1.00 0.65 C ATOM 298 O ASP A 37 -11.171 9.462 -9.004 1.00 0.68 O ATOM 299 CB ASP A 37 -13.358 7.012 -9.211 1.00 0.73 C ATOM 300 CG ASP A 37 -13.982 8.098 -10.066 1.00 0.90 C ATOM 301 OD1 ASP A 37 -13.792 8.070 -11.299 1.00 1.05 O ATOM 302 OD2 ASP A 37 -14.656 8.988 -9.505 1.00 1.04 O ATOM 0 H ASP A 37 -12.004 5.470 -7.847 1.00 0.63 H new ATOM 0 HA ASP A 37 -11.392 7.174 -10.048 1.00 0.68 H new ATOM 0 HB2 ASP A 37 -13.573 6.040 -9.655 1.00 0.73 H new ATOM 0 HB3 ASP A 37 -13.822 7.022 -8.225 1.00 0.73 H new ATOM 307 N TYR A 38 -11.566 8.470 -7.032 1.00 0.60 N ATOM 308 CA TYR A 38 -11.207 9.642 -6.246 1.00 0.58 C ATOM 309 C TYR A 38 -9.692 9.826 -6.197 1.00 0.57 C ATOM 310 O TYR A 38 -9.201 10.952 -6.133 1.00 0.57 O ATOM 311 CB TYR A 38 -11.789 9.546 -4.835 1.00 0.54 C ATOM 312 CG TYR A 38 -13.256 9.911 -4.770 1.00 0.56 C ATOM 313 CD1 TYR A 38 -13.649 11.236 -4.641 1.00 0.59 C ATOM 314 CD2 TYR A 38 -14.246 8.937 -4.850 1.00 0.63 C ATOM 315 CE1 TYR A 38 -14.985 11.581 -4.590 1.00 0.63 C ATOM 316 CE2 TYR A 38 -15.583 9.276 -4.804 1.00 0.67 C ATOM 317 CZ TYR A 38 -15.948 10.597 -4.672 1.00 0.65 C ATOM 318 OH TYR A 38 -17.281 10.940 -4.629 1.00 0.71 O ATOM 0 H TYR A 38 -11.858 7.664 -6.479 1.00 0.60 H new ATOM 0 HA TYR A 38 -11.635 10.518 -6.733 1.00 0.58 H new ATOM 0 HB2 TYR A 38 -11.657 8.530 -4.463 1.00 0.54 H new ATOM 0 HB3 TYR A 38 -11.228 10.204 -4.172 1.00 0.54 H new ATOM 0 HD1 TYR A 38 -12.898 12.009 -4.580 1.00 0.59 H new ATOM 0 HD2 TYR A 38 -13.964 7.899 -4.950 1.00 0.63 H new ATOM 0 HE1 TYR A 38 -15.275 12.616 -4.486 1.00 0.63 H new ATOM 0 HE2 TYR A 38 -16.340 8.508 -4.871 1.00 0.67 H new ATOM 0 HH TYR A 38 -17.829 10.131 -4.700 1.00 0.71 H new ATOM 328 N PHE A 39 -8.959 8.719 -6.243 1.00 0.57 N ATOM 329 CA PHE A 39 -7.508 8.751 -6.304 1.00 0.57 C ATOM 330 C PHE A 39 -7.049 9.570 -7.504 1.00 0.63 C ATOM 331 O PHE A 39 -6.252 10.502 -7.370 1.00 0.67 O ATOM 332 CB PHE A 39 -6.965 7.321 -6.393 1.00 0.58 C ATOM 333 CG PHE A 39 -5.481 7.247 -6.586 1.00 0.58 C ATOM 334 CD1 PHE A 39 -4.625 7.275 -5.501 1.00 0.55 C ATOM 335 CD2 PHE A 39 -4.943 7.154 -7.858 1.00 0.70 C ATOM 336 CE1 PHE A 39 -3.259 7.215 -5.681 1.00 0.59 C ATOM 337 CE2 PHE A 39 -3.579 7.091 -8.044 1.00 0.73 C ATOM 338 CZ PHE A 39 -2.734 7.122 -6.954 1.00 0.65 C ATOM 0 H PHE A 39 -9.355 7.779 -6.239 1.00 0.57 H new ATOM 0 HA PHE A 39 -7.122 9.221 -5.400 1.00 0.57 H new ATOM 0 HB2 PHE A 39 -7.230 6.785 -5.482 1.00 0.58 H new ATOM 0 HB3 PHE A 39 -7.455 6.807 -7.220 1.00 0.58 H new ATOM 0 HD1 PHE A 39 -5.030 7.345 -4.502 1.00 0.55 H new ATOM 0 HD2 PHE A 39 -5.600 7.131 -8.715 1.00 0.70 H new ATOM 0 HE1 PHE A 39 -2.600 7.241 -4.826 1.00 0.59 H new ATOM 0 HE2 PHE A 39 -3.172 7.017 -9.042 1.00 0.73 H new ATOM 0 HZ PHE A 39 -1.665 7.074 -7.096 1.00 0.65 H new ATOM 348 N LYS A 40 -7.570 9.230 -8.674 1.00 0.66 N ATOM 349 CA LYS A 40 -7.231 9.946 -9.893 1.00 0.74 C ATOM 350 C LYS A 40 -7.945 11.294 -9.933 1.00 0.73 C ATOM 351 O LYS A 40 -7.500 12.222 -10.609 1.00 0.79 O ATOM 352 CB LYS A 40 -7.570 9.103 -11.127 1.00 0.82 C ATOM 353 CG LYS A 40 -9.024 8.687 -11.204 1.00 1.18 C ATOM 354 CD LYS A 40 -9.278 7.759 -12.376 1.00 1.09 C ATOM 355 CE LYS A 40 -10.738 7.347 -12.442 1.00 1.56 C ATOM 356 NZ LYS A 40 -11.627 8.509 -12.697 1.00 2.26 N ATOM 0 H LYS A 40 -8.229 8.462 -8.804 1.00 0.66 H new ATOM 0 HA LYS A 40 -6.157 10.131 -9.901 1.00 0.74 H new ATOM 0 HB2 LYS A 40 -7.316 9.669 -12.023 1.00 0.82 H new ATOM 0 HB3 LYS A 40 -6.946 8.209 -11.127 1.00 0.82 H new ATOM 0 HG2 LYS A 40 -9.310 8.190 -10.277 1.00 1.18 H new ATOM 0 HG3 LYS A 40 -9.652 9.573 -11.298 1.00 1.18 H new ATOM 0 HD2 LYS A 40 -8.995 8.255 -13.304 1.00 1.09 H new ATOM 0 HD3 LYS A 40 -8.651 6.872 -12.284 1.00 1.09 H new ATOM 0 HE2 LYS A 40 -10.872 6.607 -13.231 1.00 1.56 H new ATOM 0 HE3 LYS A 40 -11.024 6.869 -11.505 1.00 1.56 H new ATOM 0 HZ1 LYS A 40 -12.321 8.591 -11.926 1.00 2.26 H new ATOM 0 HZ2 LYS A 40 -11.058 9.378 -12.744 1.00 2.26 H new ATOM 0 HZ3 LYS A 40 -12.126 8.373 -13.599 1.00 2.26 H new ATOM 370 N ALA A 41 -9.037 11.403 -9.178 1.00 0.68 N ATOM 371 CA ALA A 41 -9.753 12.666 -9.046 1.00 0.70 C ATOM 372 C ALA A 41 -8.976 13.630 -8.160 1.00 0.71 C ATOM 373 O ALA A 41 -9.347 14.798 -8.023 1.00 0.78 O ATOM 374 CB ALA A 41 -11.135 12.450 -8.465 1.00 0.68 C ATOM 0 H ALA A 41 -9.443 10.631 -8.649 1.00 0.68 H new ATOM 0 HA ALA A 41 -9.854 13.094 -10.043 1.00 0.70 H new ATOM 0 HB1 ALA A 41 -11.647 13.408 -8.377 1.00 0.68 H new ATOM 0 HB2 ALA A 41 -11.706 11.792 -9.120 1.00 0.68 H new ATOM 0 HB3 ALA A 41 -11.048 11.994 -7.479 1.00 0.68 H new ATOM 380 N LYS A 42 -7.922 13.100 -7.529 1.00 0.68 N ATOM 381 CA LYS A 42 -6.996 13.880 -6.707 1.00 0.70 C ATOM 382 C LYS A 42 -7.586 14.155 -5.327 1.00 0.66 C ATOM 383 O LYS A 42 -7.140 15.059 -4.615 1.00 0.70 O ATOM 384 CB LYS A 42 -6.608 15.191 -7.402 1.00 0.82 C ATOM 385 CG LYS A 42 -5.971 15.003 -8.775 1.00 0.96 C ATOM 386 CD LYS A 42 -4.724 14.138 -8.710 1.00 1.41 C ATOM 387 CE LYS A 42 -4.031 14.064 -10.062 1.00 1.57 C ATOM 388 NZ LYS A 42 -4.888 13.435 -11.106 1.00 2.30 N ATOM 0 H LYS A 42 -7.688 12.108 -7.576 1.00 0.68 H new ATOM 0 HA LYS A 42 -6.091 13.287 -6.577 1.00 0.70 H new ATOM 0 HB2 LYS A 42 -7.498 15.811 -7.508 1.00 0.82 H new ATOM 0 HB3 LYS A 42 -5.914 15.737 -6.763 1.00 0.82 H new ATOM 0 HG2 LYS A 42 -6.694 14.546 -9.451 1.00 0.96 H new ATOM 0 HG3 LYS A 42 -5.715 15.977 -9.193 1.00 0.96 H new ATOM 0 HD2 LYS A 42 -4.036 14.543 -7.968 1.00 1.41 H new ATOM 0 HD3 LYS A 42 -4.992 13.134 -8.381 1.00 1.41 H new ATOM 0 HE2 LYS A 42 -3.754 15.069 -10.380 1.00 1.57 H new ATOM 0 HE3 LYS A 42 -3.107 13.495 -9.963 1.00 1.57 H new ATOM 0 HZ1 LYS A 42 -4.356 12.679 -11.583 1.00 2.30 H new ATOM 0 HZ2 LYS A 42 -5.738 13.033 -10.662 1.00 2.30 H new ATOM 0 HZ3 LYS A 42 -5.169 14.153 -11.804 1.00 2.30 H new ATOM 402 N ASP A 43 -8.574 13.358 -4.946 1.00 0.61 N ATOM 403 CA ASP A 43 -9.167 13.455 -3.621 1.00 0.58 C ATOM 404 C ASP A 43 -8.833 12.200 -2.832 1.00 0.52 C ATOM 405 O ASP A 43 -9.557 11.202 -2.882 1.00 0.54 O ATOM 406 CB ASP A 43 -10.684 13.624 -3.708 1.00 0.61 C ATOM 407 CG ASP A 43 -11.288 14.132 -2.412 1.00 0.61 C ATOM 408 OD1 ASP A 43 -11.077 13.502 -1.354 1.00 0.60 O ATOM 409 OD2 ASP A 43 -11.993 15.164 -2.449 1.00 0.73 O ATOM 0 H ASP A 43 -8.983 12.635 -5.538 1.00 0.61 H new ATOM 0 HA ASP A 43 -8.758 14.332 -3.118 1.00 0.58 H new ATOM 0 HB2 ASP A 43 -10.923 14.319 -4.513 1.00 0.61 H new ATOM 0 HB3 ASP A 43 -11.139 12.668 -3.966 1.00 0.61 H new ATOM 414 N TYR A 44 -7.722 12.242 -2.123 1.00 0.48 N ATOM 415 CA TYR A 44 -7.222 11.077 -1.421 1.00 0.45 C ATOM 416 C TYR A 44 -7.904 10.915 -0.078 1.00 0.44 C ATOM 417 O TYR A 44 -7.822 9.862 0.542 1.00 0.43 O ATOM 418 CB TYR A 44 -5.707 11.187 -1.273 1.00 0.45 C ATOM 419 CG TYR A 44 -5.023 11.373 -2.607 1.00 0.48 C ATOM 420 CD1 TYR A 44 -4.973 10.334 -3.526 1.00 0.49 C ATOM 421 CD2 TYR A 44 -4.443 12.589 -2.960 1.00 0.57 C ATOM 422 CE1 TYR A 44 -4.373 10.497 -4.756 1.00 0.57 C ATOM 423 CE2 TYR A 44 -3.836 12.758 -4.192 1.00 0.65 C ATOM 424 CZ TYR A 44 -3.805 11.706 -5.084 1.00 0.64 C ATOM 425 OH TYR A 44 -3.211 11.863 -6.317 1.00 0.75 O ATOM 0 H TYR A 44 -7.145 13.077 -2.018 1.00 0.48 H new ATOM 0 HA TYR A 44 -7.451 10.183 -2.001 1.00 0.45 H new ATOM 0 HB2 TYR A 44 -5.466 12.027 -0.621 1.00 0.45 H new ATOM 0 HB3 TYR A 44 -5.323 10.288 -0.790 1.00 0.45 H new ATOM 0 HD1 TYR A 44 -5.412 9.380 -3.273 1.00 0.49 H new ATOM 0 HD2 TYR A 44 -4.467 13.412 -2.262 1.00 0.57 H new ATOM 0 HE1 TYR A 44 -4.349 9.678 -5.460 1.00 0.57 H new ATOM 0 HE2 TYR A 44 -3.390 13.706 -4.453 1.00 0.65 H new ATOM 0 HH TYR A 44 -2.858 12.774 -6.396 1.00 0.75 H new ATOM 435 N GLU A 45 -8.604 11.949 0.345 1.00 0.48 N ATOM 436 CA GLU A 45 -9.347 11.908 1.593 1.00 0.50 C ATOM 437 C GLU A 45 -10.610 11.122 1.428 1.00 0.46 C ATOM 438 O GLU A 45 -10.937 10.265 2.249 1.00 0.43 O ATOM 439 CB GLU A 45 -9.687 13.306 2.040 1.00 0.61 C ATOM 440 CG GLU A 45 -8.450 14.098 2.271 1.00 0.76 C ATOM 441 CD GLU A 45 -8.723 15.542 2.621 1.00 0.87 C ATOM 442 OE1 GLU A 45 -9.539 15.790 3.534 1.00 1.47 O ATOM 443 OE2 GLU A 45 -8.118 16.436 1.995 1.00 1.17 O ATOM 0 H GLU A 45 -8.675 12.833 -0.159 1.00 0.48 H new ATOM 0 HA GLU A 45 -8.723 11.426 2.345 1.00 0.50 H new ATOM 0 HB2 GLU A 45 -10.303 13.795 1.285 1.00 0.61 H new ATOM 0 HB3 GLU A 45 -10.277 13.267 2.956 1.00 0.61 H new ATOM 0 HG2 GLU A 45 -7.877 13.638 3.076 1.00 0.76 H new ATOM 0 HG3 GLU A 45 -7.829 14.059 1.376 1.00 0.76 H new ATOM 450 N ASN A 46 -11.334 11.413 0.370 1.00 0.48 N ATOM 451 CA ASN A 46 -12.530 10.678 0.112 1.00 0.48 C ATOM 452 C ASN A 46 -12.175 9.264 -0.299 1.00 0.43 C ATOM 453 O ASN A 46 -12.913 8.323 -0.027 1.00 0.43 O ATOM 454 CB ASN A 46 -13.413 11.355 -0.935 1.00 0.53 C ATOM 455 CG ASN A 46 -14.224 12.491 -0.350 1.00 0.60 C ATOM 456 OD1 ASN A 46 -15.345 12.288 0.115 1.00 0.66 O ATOM 457 ND2 ASN A 46 -13.665 13.688 -0.362 1.00 0.63 N ATOM 0 H ASN A 46 -11.113 12.142 -0.309 1.00 0.48 H new ATOM 0 HA ASN A 46 -13.116 10.649 1.031 1.00 0.48 H new ATOM 0 HB2 ASN A 46 -12.789 11.735 -1.744 1.00 0.53 H new ATOM 0 HB3 ASN A 46 -14.086 10.617 -1.372 1.00 0.53 H new ATOM 0 HD21 ASN A 46 -14.165 14.488 0.024 1.00 0.63 H new ATOM 0 HD22 ASN A 46 -12.733 13.812 -0.758 1.00 0.63 H new ATOM 464 N ALA A 47 -11.019 9.122 -0.937 1.00 0.41 N ATOM 465 CA ALA A 47 -10.467 7.807 -1.216 1.00 0.38 C ATOM 466 C ALA A 47 -10.272 7.046 0.094 1.00 0.34 C ATOM 467 O ALA A 47 -10.737 5.918 0.238 1.00 0.32 O ATOM 468 CB ALA A 47 -9.156 7.934 -1.976 1.00 0.40 C ATOM 0 H ALA A 47 -10.449 9.900 -1.269 1.00 0.41 H new ATOM 0 HA ALA A 47 -11.162 7.248 -1.843 1.00 0.38 H new ATOM 0 HB1 ALA A 47 -8.755 6.941 -2.178 1.00 0.40 H new ATOM 0 HB2 ALA A 47 -9.331 8.453 -2.918 1.00 0.40 H new ATOM 0 HB3 ALA A 47 -8.442 8.499 -1.377 1.00 0.40 H new ATOM 474 N ILE A 48 -9.607 7.697 1.054 1.00 0.34 N ATOM 475 CA ILE A 48 -9.460 7.167 2.411 1.00 0.32 C ATOM 476 C ILE A 48 -10.817 6.742 2.975 1.00 0.29 C ATOM 477 O ILE A 48 -10.954 5.656 3.547 1.00 0.28 O ATOM 478 CB ILE A 48 -8.816 8.223 3.349 1.00 0.35 C ATOM 479 CG1 ILE A 48 -7.325 8.368 3.050 1.00 0.37 C ATOM 480 CG2 ILE A 48 -9.029 7.877 4.815 1.00 0.39 C ATOM 481 CD1 ILE A 48 -6.652 9.475 3.832 1.00 0.42 C ATOM 0 H ILE A 48 -9.158 8.602 0.912 1.00 0.34 H new ATOM 0 HA ILE A 48 -8.807 6.296 2.358 1.00 0.32 H new ATOM 0 HB ILE A 48 -9.310 9.176 3.157 1.00 0.35 H new ATOM 0 HG12 ILE A 48 -6.826 7.424 3.271 1.00 0.37 H new ATOM 0 HG13 ILE A 48 -7.194 8.557 1.984 1.00 0.37 H new ATOM 0 HG21 ILE A 48 -8.564 8.639 5.440 1.00 0.39 H new ATOM 0 HG22 ILE A 48 -10.097 7.835 5.028 1.00 0.39 H new ATOM 0 HG23 ILE A 48 -8.579 6.908 5.029 1.00 0.39 H new ATOM 0 HD11 ILE A 48 -5.596 9.517 3.567 1.00 0.42 H new ATOM 0 HD12 ILE A 48 -7.124 10.428 3.594 1.00 0.42 H new ATOM 0 HD13 ILE A 48 -6.751 9.278 4.900 1.00 0.42 H new ATOM 493 N LYS A 49 -11.811 7.603 2.796 1.00 0.31 N ATOM 494 CA LYS A 49 -13.163 7.334 3.260 1.00 0.32 C ATOM 495 C LYS A 49 -13.734 6.072 2.614 1.00 0.27 C ATOM 496 O LYS A 49 -14.173 5.162 3.312 1.00 0.27 O ATOM 497 CB LYS A 49 -14.074 8.528 2.968 1.00 0.39 C ATOM 498 CG LYS A 49 -15.528 8.279 3.327 1.00 0.44 C ATOM 499 CD LYS A 49 -16.390 9.508 3.093 1.00 0.63 C ATOM 500 CE LYS A 49 -16.712 9.697 1.619 1.00 1.02 C ATOM 501 NZ LYS A 49 -17.765 10.726 1.410 1.00 1.50 N ATOM 0 H LYS A 49 -11.702 8.502 2.327 1.00 0.31 H new ATOM 0 HA LYS A 49 -13.117 7.173 4.337 1.00 0.32 H new ATOM 0 HB2 LYS A 49 -13.714 9.395 3.523 1.00 0.39 H new ATOM 0 HB3 LYS A 49 -14.006 8.777 1.909 1.00 0.39 H new ATOM 0 HG2 LYS A 49 -15.911 7.449 2.733 1.00 0.44 H new ATOM 0 HG3 LYS A 49 -15.597 7.981 4.373 1.00 0.44 H new ATOM 0 HD2 LYS A 49 -17.317 9.415 3.659 1.00 0.63 H new ATOM 0 HD3 LYS A 49 -15.874 10.391 3.469 1.00 0.63 H new ATOM 0 HE2 LYS A 49 -15.808 9.989 1.084 1.00 1.02 H new ATOM 0 HE3 LYS A 49 -17.042 8.749 1.195 1.00 1.02 H new ATOM 0 HZ1 LYS A 49 -18.521 10.333 0.814 1.00 1.50 H new ATOM 0 HZ2 LYS A 49 -18.161 11.009 2.329 1.00 1.50 H new ATOM 0 HZ3 LYS A 49 -17.351 11.557 0.941 1.00 1.50 H new ATOM 515 N PHE A 50 -13.712 6.017 1.287 1.00 0.27 N ATOM 516 CA PHE A 50 -14.284 4.886 0.559 1.00 0.27 C ATOM 517 C PHE A 50 -13.541 3.591 0.859 1.00 0.23 C ATOM 518 O PHE A 50 -14.151 2.524 0.919 1.00 0.25 O ATOM 519 CB PHE A 50 -14.308 5.160 -0.946 1.00 0.35 C ATOM 520 CG PHE A 50 -15.440 6.056 -1.368 1.00 0.43 C ATOM 521 CD1 PHE A 50 -15.299 7.432 -1.364 1.00 0.71 C ATOM 522 CD2 PHE A 50 -16.651 5.516 -1.762 1.00 0.56 C ATOM 523 CE1 PHE A 50 -16.343 8.252 -1.741 1.00 0.81 C ATOM 524 CE2 PHE A 50 -17.700 6.330 -2.143 1.00 0.65 C ATOM 525 CZ PHE A 50 -17.546 7.699 -2.132 1.00 0.66 C ATOM 0 H PHE A 50 -13.306 6.740 0.693 1.00 0.27 H new ATOM 0 HA PHE A 50 -15.311 4.764 0.902 1.00 0.27 H new ATOM 0 HB2 PHE A 50 -13.363 5.616 -1.241 1.00 0.35 H new ATOM 0 HB3 PHE A 50 -14.385 4.213 -1.480 1.00 0.35 H new ATOM 0 HD1 PHE A 50 -14.359 7.870 -1.062 1.00 0.71 H new ATOM 0 HD2 PHE A 50 -16.778 4.444 -1.772 1.00 0.56 H new ATOM 0 HE1 PHE A 50 -16.219 9.325 -1.730 1.00 0.81 H new ATOM 0 HE2 PHE A 50 -18.639 5.894 -2.449 1.00 0.65 H new ATOM 0 HZ PHE A 50 -18.365 8.338 -2.429 1.00 0.66 H new ATOM 535 N TYR A 51 -12.234 3.677 1.062 1.00 0.23 N ATOM 536 CA TYR A 51 -11.464 2.508 1.459 1.00 0.25 C ATOM 537 C TYR A 51 -11.893 2.042 2.848 1.00 0.21 C ATOM 538 O TYR A 51 -12.082 0.848 3.083 1.00 0.23 O ATOM 539 CB TYR A 51 -9.962 2.793 1.441 1.00 0.31 C ATOM 540 CG TYR A 51 -9.376 2.974 0.055 1.00 0.43 C ATOM 541 CD1 TYR A 51 -9.702 2.107 -0.981 1.00 0.53 C ATOM 542 CD2 TYR A 51 -8.491 4.010 -0.212 1.00 0.51 C ATOM 543 CE1 TYR A 51 -9.162 2.268 -2.246 1.00 0.67 C ATOM 544 CE2 TYR A 51 -7.944 4.178 -1.471 1.00 0.65 C ATOM 545 CZ TYR A 51 -8.282 3.306 -2.485 1.00 0.72 C ATOM 546 OH TYR A 51 -7.728 3.464 -3.735 1.00 0.88 O ATOM 0 H TYR A 51 -11.690 4.534 0.960 1.00 0.23 H new ATOM 0 HA TYR A 51 -11.663 1.717 0.736 1.00 0.25 H new ATOM 0 HB2 TYR A 51 -9.768 3.693 2.025 1.00 0.31 H new ATOM 0 HB3 TYR A 51 -9.443 1.973 1.938 1.00 0.31 H new ATOM 0 HD1 TYR A 51 -10.388 1.294 -0.796 1.00 0.53 H new ATOM 0 HD2 TYR A 51 -8.225 4.697 0.578 1.00 0.51 H new ATOM 0 HE1 TYR A 51 -9.427 1.586 -3.041 1.00 0.67 H new ATOM 0 HE2 TYR A 51 -7.255 4.988 -1.659 1.00 0.65 H new ATOM 0 HH TYR A 51 -8.197 2.890 -4.376 1.00 0.88 H new ATOM 556 N SER A 52 -12.071 2.991 3.760 1.00 0.20 N ATOM 557 CA SER A 52 -12.528 2.675 5.104 1.00 0.22 C ATOM 558 C SER A 52 -13.935 2.094 5.058 1.00 0.22 C ATOM 559 O SER A 52 -14.254 1.153 5.785 1.00 0.23 O ATOM 560 CB SER A 52 -12.496 3.923 5.984 1.00 0.25 C ATOM 561 OG SER A 52 -11.186 4.464 6.045 1.00 0.56 O ATOM 0 H SER A 52 -11.906 3.983 3.592 1.00 0.20 H new ATOM 0 HA SER A 52 -11.857 1.931 5.535 1.00 0.22 H new ATOM 0 HB2 SER A 52 -13.184 4.670 5.589 1.00 0.25 H new ATOM 0 HB3 SER A 52 -12.838 3.674 6.988 1.00 0.25 H new ATOM 0 HG SER A 52 -10.986 4.933 5.208 1.00 0.56 H new ATOM 567 N GLN A 53 -14.761 2.645 4.178 1.00 0.24 N ATOM 568 CA GLN A 53 -16.118 2.158 3.978 1.00 0.27 C ATOM 569 C GLN A 53 -16.111 0.706 3.497 1.00 0.26 C ATOM 570 O GLN A 53 -16.983 -0.085 3.859 1.00 0.30 O ATOM 571 CB GLN A 53 -16.857 3.055 2.986 1.00 0.31 C ATOM 572 CG GLN A 53 -17.289 4.385 3.576 1.00 0.37 C ATOM 573 CD GLN A 53 -18.143 5.196 2.620 1.00 0.49 C ATOM 574 OE1 GLN A 53 -18.820 4.648 1.753 1.00 1.12 O ATOM 575 NE2 GLN A 53 -18.152 6.504 2.801 1.00 0.94 N ATOM 0 H GLN A 53 -14.511 3.437 3.586 1.00 0.24 H new ATOM 0 HA GLN A 53 -16.642 2.190 4.933 1.00 0.27 H new ATOM 0 HB2 GLN A 53 -16.213 3.240 2.126 1.00 0.31 H new ATOM 0 HB3 GLN A 53 -17.737 2.528 2.617 1.00 0.31 H new ATOM 0 HG2 GLN A 53 -17.848 4.207 4.495 1.00 0.37 H new ATOM 0 HG3 GLN A 53 -16.405 4.962 3.847 1.00 0.37 H new ATOM 0 HE21 GLN A 53 -17.576 6.922 3.532 1.00 0.94 H new ATOM 0 HE22 GLN A 53 -18.735 7.097 2.210 1.00 0.94 H new ATOM 584 N ALA A 54 -15.112 0.353 2.697 1.00 0.23 N ATOM 585 CA ALA A 54 -14.938 -1.024 2.255 1.00 0.24 C ATOM 586 C ALA A 54 -14.608 -1.930 3.443 1.00 0.23 C ATOM 587 O ALA A 54 -14.975 -3.101 3.465 1.00 0.25 O ATOM 588 CB ALA A 54 -13.848 -1.104 1.198 1.00 0.25 C ATOM 0 H ALA A 54 -14.410 1.002 2.341 1.00 0.23 H new ATOM 0 HA ALA A 54 -15.873 -1.369 1.813 1.00 0.24 H new ATOM 0 HB1 ALA A 54 -13.728 -2.139 0.876 1.00 0.25 H new ATOM 0 HB2 ALA A 54 -14.125 -0.488 0.343 1.00 0.25 H new ATOM 0 HB3 ALA A 54 -12.908 -0.743 1.616 1.00 0.25 H new ATOM 594 N ILE A 55 -13.938 -1.354 4.437 1.00 0.22 N ATOM 595 CA ILE A 55 -13.583 -2.068 5.667 1.00 0.22 C ATOM 596 C ILE A 55 -14.783 -2.122 6.609 1.00 0.24 C ATOM 597 O ILE A 55 -14.782 -2.814 7.629 1.00 0.27 O ATOM 598 CB ILE A 55 -12.410 -1.373 6.384 1.00 0.23 C ATOM 599 CG1 ILE A 55 -11.291 -1.093 5.389 1.00 0.24 C ATOM 600 CG2 ILE A 55 -11.895 -2.226 7.537 1.00 0.27 C ATOM 601 CD1 ILE A 55 -10.265 -0.128 5.914 1.00 0.28 C ATOM 0 H ILE A 55 -13.625 -0.383 4.416 1.00 0.22 H new ATOM 0 HA ILE A 55 -13.284 -3.080 5.394 1.00 0.22 H new ATOM 0 HB ILE A 55 -12.765 -0.429 6.797 1.00 0.23 H new ATOM 0 HG12 ILE A 55 -10.800 -2.031 5.130 1.00 0.24 H new ATOM 0 HG13 ILE A 55 -11.721 -0.693 4.470 1.00 0.24 H new ATOM 0 HG21 ILE A 55 -11.067 -1.714 8.027 1.00 0.27 H new ATOM 0 HG22 ILE A 55 -12.698 -2.389 8.256 1.00 0.27 H new ATOM 0 HG23 ILE A 55 -11.551 -3.187 7.154 1.00 0.27 H new ATOM 0 HD11 ILE A 55 -9.495 0.030 5.159 1.00 0.28 H new ATOM 0 HD12 ILE A 55 -10.745 0.822 6.147 1.00 0.28 H new ATOM 0 HD13 ILE A 55 -9.810 -0.536 6.817 1.00 0.28 H new ATOM 613 N GLU A 56 -15.801 -1.361 6.270 1.00 0.27 N ATOM 614 CA GLU A 56 -17.061 -1.425 6.982 1.00 0.31 C ATOM 615 C GLU A 56 -17.925 -2.521 6.378 1.00 0.31 C ATOM 616 O GLU A 56 -18.817 -3.063 7.030 1.00 0.34 O ATOM 617 CB GLU A 56 -17.772 -0.077 6.880 1.00 0.34 C ATOM 618 CG GLU A 56 -16.911 1.091 7.324 1.00 0.36 C ATOM 619 CD GLU A 56 -16.858 1.234 8.827 1.00 0.45 C ATOM 620 OE1 GLU A 56 -17.860 1.699 9.412 1.00 0.78 O ATOM 621 OE2 GLU A 56 -15.821 0.892 9.429 1.00 0.81 O ATOM 0 H GLU A 56 -15.781 -0.688 5.503 1.00 0.27 H new ATOM 0 HA GLU A 56 -16.881 -1.652 8.033 1.00 0.31 H new ATOM 0 HB2 GLU A 56 -18.086 0.083 5.848 1.00 0.34 H new ATOM 0 HB3 GLU A 56 -18.677 -0.104 7.488 1.00 0.34 H new ATOM 0 HG2 GLU A 56 -15.900 0.959 6.939 1.00 0.36 H new ATOM 0 HG3 GLU A 56 -17.300 2.011 6.888 1.00 0.36 H new ATOM 628 N LEU A 57 -17.648 -2.836 5.121 1.00 0.31 N ATOM 629 CA LEU A 57 -18.381 -3.869 4.409 1.00 0.33 C ATOM 630 C LEU A 57 -17.727 -5.235 4.605 1.00 0.33 C ATOM 631 O LEU A 57 -18.402 -6.197 4.960 1.00 0.40 O ATOM 632 CB LEU A 57 -18.479 -3.503 2.933 1.00 0.34 C ATOM 633 CG LEU A 57 -19.050 -2.106 2.677 1.00 0.35 C ATOM 634 CD1 LEU A 57 -19.035 -1.786 1.206 1.00 0.37 C ATOM 635 CD2 LEU A 57 -20.459 -1.986 3.228 1.00 0.40 C ATOM 0 H LEU A 57 -16.916 -2.387 4.571 1.00 0.31 H new ATOM 0 HA LEU A 57 -19.390 -3.935 4.816 1.00 0.33 H new ATOM 0 HB2 LEU A 57 -17.487 -3.567 2.486 1.00 0.34 H new ATOM 0 HB3 LEU A 57 -19.104 -4.239 2.427 1.00 0.34 H new ATOM 0 HG LEU A 57 -18.417 -1.386 3.195 1.00 0.35 H new ATOM 0 HD11 LEU A 57 -19.445 -0.789 1.046 1.00 0.37 H new ATOM 0 HD12 LEU A 57 -18.010 -1.820 0.837 1.00 0.37 H new ATOM 0 HD13 LEU A 57 -19.639 -2.517 0.668 1.00 0.37 H new ATOM 0 HD21 LEU A 57 -20.842 -0.984 3.033 1.00 0.40 H new ATOM 0 HD22 LEU A 57 -21.103 -2.721 2.744 1.00 0.40 H new ATOM 0 HD23 LEU A 57 -20.446 -2.167 4.303 1.00 0.40 H new ATOM 647 N ASN A 58 -16.418 -5.327 4.376 1.00 0.29 N ATOM 648 CA ASN A 58 -15.684 -6.526 4.757 1.00 0.30 C ATOM 649 C ASN A 58 -14.628 -6.095 5.777 1.00 0.30 C ATOM 650 O ASN A 58 -14.445 -4.905 5.967 1.00 0.34 O ATOM 651 CB ASN A 58 -15.030 -7.129 3.501 1.00 0.35 C ATOM 652 CG ASN A 58 -14.882 -8.638 3.553 1.00 0.59 C ATOM 653 OD1 ASN A 58 -15.701 -9.340 4.139 1.00 1.53 O ATOM 654 ND2 ASN A 58 -13.824 -9.147 2.956 1.00 0.57 N ATOM 0 H ASN A 58 -15.855 -4.599 3.937 1.00 0.29 H new ATOM 0 HA ASN A 58 -16.334 -7.284 5.194 1.00 0.30 H new ATOM 0 HB2 ASN A 58 -15.626 -6.861 2.628 1.00 0.35 H new ATOM 0 HB3 ASN A 58 -14.046 -6.681 3.364 1.00 0.35 H new ATOM 0 HD21 ASN A 58 -13.665 -10.154 2.971 1.00 0.57 H new ATOM 0 HD22 ASN A 58 -13.164 -8.534 2.478 1.00 0.57 H new ATOM 661 N PRO A 59 -13.910 -7.003 6.446 1.00 0.31 N ATOM 662 CA PRO A 59 -12.864 -6.621 7.380 1.00 0.35 C ATOM 663 C PRO A 59 -11.417 -6.884 6.930 1.00 0.35 C ATOM 664 O PRO A 59 -10.689 -5.958 6.563 1.00 0.35 O ATOM 665 CB PRO A 59 -13.246 -7.483 8.576 1.00 0.41 C ATOM 666 CG PRO A 59 -13.824 -8.744 7.979 1.00 0.41 C ATOM 667 CD PRO A 59 -14.160 -8.436 6.530 1.00 0.34 C ATOM 0 HA PRO A 59 -12.832 -5.544 7.542 1.00 0.35 H new ATOM 0 HB2 PRO A 59 -12.378 -7.702 9.198 1.00 0.41 H new ATOM 0 HB3 PRO A 59 -13.973 -6.977 9.211 1.00 0.41 H new ATOM 0 HG2 PRO A 59 -13.109 -9.564 8.043 1.00 0.41 H new ATOM 0 HG3 PRO A 59 -14.715 -9.055 8.524 1.00 0.41 H new ATOM 0 HD2 PRO A 59 -13.532 -8.999 5.839 1.00 0.34 H new ATOM 0 HD3 PRO A 59 -15.195 -8.682 6.292 1.00 0.34 H new ATOM 675 N SER A 60 -11.011 -8.152 6.968 1.00 0.44 N ATOM 676 CA SER A 60 -9.605 -8.524 6.869 1.00 0.49 C ATOM 677 C SER A 60 -9.125 -8.582 5.424 1.00 0.49 C ATOM 678 O SER A 60 -8.905 -9.661 4.871 1.00 0.68 O ATOM 679 CB SER A 60 -9.373 -9.872 7.562 1.00 0.63 C ATOM 680 OG SER A 60 -8.010 -10.266 7.505 1.00 1.52 O ATOM 0 H SER A 60 -11.645 -8.945 7.068 1.00 0.44 H new ATOM 0 HA SER A 60 -9.023 -7.750 7.370 1.00 0.49 H new ATOM 0 HB2 SER A 60 -9.689 -9.805 8.603 1.00 0.63 H new ATOM 0 HB3 SER A 60 -9.992 -10.635 7.090 1.00 0.63 H new ATOM 0 HG SER A 60 -7.900 -11.128 7.958 1.00 1.52 H new ATOM 686 N ASN A 61 -8.985 -7.421 4.814 1.00 0.43 N ATOM 687 CA ASN A 61 -8.392 -7.332 3.495 1.00 0.45 C ATOM 688 C ASN A 61 -7.227 -6.362 3.506 1.00 0.38 C ATOM 689 O ASN A 61 -7.420 -5.146 3.607 1.00 0.34 O ATOM 690 CB ASN A 61 -9.416 -6.896 2.446 1.00 0.48 C ATOM 691 CG ASN A 61 -10.563 -7.872 2.313 1.00 0.79 C ATOM 692 OD1 ASN A 61 -11.630 -7.665 2.883 1.00 1.76 O ATOM 693 ND2 ASN A 61 -10.341 -8.955 1.582 1.00 1.07 N ATOM 0 H ASN A 61 -9.274 -6.527 5.211 1.00 0.43 H new ATOM 0 HA ASN A 61 -8.035 -8.327 3.228 1.00 0.45 H new ATOM 0 HB2 ASN A 61 -9.808 -5.914 2.712 1.00 0.48 H new ATOM 0 HB3 ASN A 61 -8.920 -6.790 1.481 1.00 0.48 H new ATOM 0 HD21 ASN A 61 -11.073 -9.657 1.476 1.00 1.07 H new ATOM 0 HD22 ASN A 61 -9.438 -9.086 1.126 1.00 1.07 H new ATOM 700 N ALA A 62 -6.017 -6.902 3.402 1.00 0.42 N ATOM 701 CA ALA A 62 -4.814 -6.080 3.327 1.00 0.42 C ATOM 702 C ALA A 62 -4.883 -5.150 2.127 1.00 0.37 C ATOM 703 O ALA A 62 -4.176 -4.149 2.060 1.00 0.38 O ATOM 704 CB ALA A 62 -3.584 -6.951 3.219 1.00 0.52 C ATOM 0 H ALA A 62 -5.843 -7.907 3.368 1.00 0.42 H new ATOM 0 HA ALA A 62 -4.751 -5.486 4.239 1.00 0.42 H new ATOM 0 HB1 ALA A 62 -2.696 -6.321 3.164 1.00 0.52 H new ATOM 0 HB2 ALA A 62 -3.517 -7.597 4.095 1.00 0.52 H new ATOM 0 HB3 ALA A 62 -3.650 -7.564 2.320 1.00 0.52 H new ATOM 710 N ILE A 63 -5.725 -5.526 1.175 1.00 0.36 N ATOM 711 CA ILE A 63 -6.021 -4.709 0.011 1.00 0.35 C ATOM 712 C ILE A 63 -6.490 -3.318 0.429 1.00 0.31 C ATOM 713 O ILE A 63 -5.872 -2.313 0.088 1.00 0.34 O ATOM 714 CB ILE A 63 -7.119 -5.382 -0.843 1.00 0.43 C ATOM 715 CG1 ILE A 63 -6.631 -6.741 -1.356 1.00 0.57 C ATOM 716 CG2 ILE A 63 -7.533 -4.488 -2.001 1.00 0.49 C ATOM 717 CD1 ILE A 63 -5.487 -6.651 -2.338 1.00 0.74 C ATOM 0 H ILE A 63 -6.225 -6.415 1.191 1.00 0.36 H new ATOM 0 HA ILE A 63 -5.107 -4.612 -0.575 1.00 0.35 H new ATOM 0 HB ILE A 63 -7.995 -5.540 -0.214 1.00 0.43 H new ATOM 0 HG12 ILE A 63 -6.320 -7.349 -0.506 1.00 0.57 H new ATOM 0 HG13 ILE A 63 -7.464 -7.259 -1.831 1.00 0.57 H new ATOM 0 HG21 ILE A 63 -8.307 -4.985 -2.586 1.00 0.49 H new ATOM 0 HG22 ILE A 63 -7.921 -3.546 -1.613 1.00 0.49 H new ATOM 0 HG23 ILE A 63 -6.669 -4.291 -2.635 1.00 0.49 H new ATOM 0 HD11 ILE A 63 -5.199 -7.654 -2.654 1.00 0.74 H new ATOM 0 HD12 ILE A 63 -5.798 -6.072 -3.207 1.00 0.74 H new ATOM 0 HD13 ILE A 63 -4.637 -6.162 -1.862 1.00 0.74 H new ATOM 729 N TYR A 64 -7.557 -3.277 1.218 1.00 0.29 N ATOM 730 CA TYR A 64 -8.181 -2.015 1.594 1.00 0.28 C ATOM 731 C TYR A 64 -7.287 -1.229 2.541 1.00 0.30 C ATOM 732 O TYR A 64 -7.188 -0.005 2.442 1.00 0.34 O ATOM 733 CB TYR A 64 -9.545 -2.271 2.237 1.00 0.26 C ATOM 734 CG TYR A 64 -10.500 -3.031 1.342 1.00 0.26 C ATOM 735 CD1 TYR A 64 -10.662 -2.676 0.011 1.00 0.28 C ATOM 736 CD2 TYR A 64 -11.223 -4.113 1.825 1.00 0.38 C ATOM 737 CE1 TYR A 64 -11.520 -3.377 -0.815 1.00 0.30 C ATOM 738 CE2 TYR A 64 -12.082 -4.821 1.003 1.00 0.43 C ATOM 739 CZ TYR A 64 -12.226 -4.450 -0.316 1.00 0.35 C ATOM 740 OH TYR A 64 -13.075 -5.153 -1.144 1.00 0.42 O ATOM 0 H TYR A 64 -8.008 -4.104 1.610 1.00 0.29 H new ATOM 0 HA TYR A 64 -8.324 -1.421 0.691 1.00 0.28 H new ATOM 0 HB2 TYR A 64 -9.403 -2.830 3.162 1.00 0.26 H new ATOM 0 HB3 TYR A 64 -9.995 -1.316 2.508 1.00 0.26 H new ATOM 0 HD1 TYR A 64 -10.109 -1.838 -0.386 1.00 0.28 H new ATOM 0 HD2 TYR A 64 -11.113 -4.407 2.858 1.00 0.38 H new ATOM 0 HE1 TYR A 64 -11.637 -3.085 -1.848 1.00 0.30 H new ATOM 0 HE2 TYR A 64 -12.637 -5.661 1.394 1.00 0.43 H new ATOM 0 HH TYR A 64 -12.700 -5.181 -2.049 1.00 0.42 H new ATOM 750 N TYR A 65 -6.629 -1.938 3.445 1.00 0.30 N ATOM 751 CA TYR A 65 -5.685 -1.315 4.367 1.00 0.32 C ATOM 752 C TYR A 65 -4.468 -0.781 3.603 1.00 0.33 C ATOM 753 O TYR A 65 -3.930 0.281 3.917 1.00 0.37 O ATOM 754 CB TYR A 65 -5.253 -2.322 5.436 1.00 0.34 C ATOM 755 CG TYR A 65 -6.284 -2.566 6.524 1.00 0.36 C ATOM 756 CD1 TYR A 65 -7.605 -2.883 6.222 1.00 0.37 C ATOM 757 CD2 TYR A 65 -5.927 -2.487 7.865 1.00 0.51 C ATOM 758 CE1 TYR A 65 -8.532 -3.107 7.221 1.00 0.40 C ATOM 759 CE2 TYR A 65 -6.850 -2.711 8.868 1.00 0.58 C ATOM 760 CZ TYR A 65 -8.150 -3.019 8.541 1.00 0.47 C ATOM 761 OH TYR A 65 -9.072 -3.249 9.537 1.00 0.55 O ATOM 0 H TYR A 65 -6.730 -2.946 3.562 1.00 0.30 H new ATOM 0 HA TYR A 65 -6.175 -0.475 4.860 1.00 0.32 H new ATOM 0 HB2 TYR A 65 -5.023 -3.271 4.952 1.00 0.34 H new ATOM 0 HB3 TYR A 65 -4.331 -1.969 5.899 1.00 0.34 H new ATOM 0 HD1 TYR A 65 -7.911 -2.955 5.189 1.00 0.37 H new ATOM 0 HD2 TYR A 65 -4.908 -2.246 8.128 1.00 0.51 H new ATOM 0 HE1 TYR A 65 -9.553 -3.350 6.968 1.00 0.40 H new ATOM 0 HE2 TYR A 65 -6.552 -2.645 9.904 1.00 0.58 H new ATOM 0 HH TYR A 65 -8.641 -3.148 10.411 1.00 0.55 H new ATOM 771 N GLY A 66 -4.052 -1.520 2.578 1.00 0.35 N ATOM 772 CA GLY A 66 -2.953 -1.087 1.740 1.00 0.41 C ATOM 773 C GLY A 66 -3.322 0.134 0.935 1.00 0.43 C ATOM 774 O GLY A 66 -2.528 1.066 0.798 1.00 0.51 O ATOM 0 H GLY A 66 -4.461 -2.416 2.314 1.00 0.35 H new ATOM 0 HA2 GLY A 66 -2.085 -0.866 2.361 1.00 0.41 H new ATOM 0 HA3 GLY A 66 -2.666 -1.895 1.067 1.00 0.41 H new ATOM 778 N ASN A 67 -4.532 0.131 0.411 1.00 0.44 N ATOM 779 CA ASN A 67 -5.056 1.278 -0.307 1.00 0.57 C ATOM 780 C ASN A 67 -5.107 2.497 0.603 1.00 0.41 C ATOM 781 O ASN A 67 -4.763 3.604 0.188 1.00 0.38 O ATOM 782 CB ASN A 67 -6.447 0.975 -0.848 1.00 0.84 C ATOM 783 CG ASN A 67 -6.436 -0.025 -1.987 1.00 1.28 C ATOM 784 OD1 ASN A 67 -5.386 -0.005 -2.793 1.00 2.28 O flip ATOM 785 ND2 ASN A 67 -7.375 -0.801 -2.149 1.00 1.35 N flip ATOM 0 H ASN A 67 -5.175 -0.658 0.469 1.00 0.44 H new ATOM 0 HA ASN A 67 -4.391 1.492 -1.144 1.00 0.57 H new ATOM 0 HB2 ASN A 67 -7.069 0.590 -0.040 1.00 0.84 H new ATOM 0 HB3 ASN A 67 -6.907 1.902 -1.190 1.00 0.84 H new ATOM 0 HD21 ASN A 67 -8.166 -0.785 -1.506 1.00 1.35 H new ATOM 0 HD22 ASN A 67 -7.363 -1.461 -2.927 1.00 1.35 H new ATOM 792 N ARG A 68 -5.521 2.288 1.852 1.00 0.39 N ATOM 793 CA ARG A 68 -5.555 3.371 2.827 1.00 0.39 C ATOM 794 C ARG A 68 -4.163 3.911 3.085 1.00 0.31 C ATOM 795 O ARG A 68 -3.949 5.118 3.009 1.00 0.32 O ATOM 796 CB ARG A 68 -6.175 2.934 4.151 1.00 0.53 C ATOM 797 CG ARG A 68 -7.685 2.834 4.117 1.00 0.80 C ATOM 798 CD ARG A 68 -8.285 3.232 5.453 1.00 0.48 C ATOM 799 NE ARG A 68 -7.815 2.389 6.548 1.00 0.94 N ATOM 800 CZ ARG A 68 -8.482 2.215 7.688 1.00 1.16 C ATOM 801 NH1 ARG A 68 -9.659 2.807 7.868 1.00 1.42 N ATOM 802 NH2 ARG A 68 -7.974 1.454 8.647 1.00 1.87 N ATOM 0 H ARG A 68 -5.835 1.385 2.208 1.00 0.39 H new ATOM 0 HA ARG A 68 -6.179 4.155 2.397 1.00 0.39 H new ATOM 0 HB2 ARG A 68 -5.763 1.965 4.432 1.00 0.53 H new ATOM 0 HB3 ARG A 68 -5.885 3.641 4.928 1.00 0.53 H new ATOM 0 HG2 ARG A 68 -8.078 3.478 3.331 1.00 0.80 H new ATOM 0 HG3 ARG A 68 -7.980 1.814 3.871 1.00 0.80 H new ATOM 0 HD2 ARG A 68 -8.035 4.271 5.665 1.00 0.48 H new ATOM 0 HD3 ARG A 68 -9.372 3.172 5.392 1.00 0.48 H new ATOM 0 HE ARG A 68 -6.924 1.905 6.434 1.00 0.94 H new ATOM 0 HH11 ARG A 68 -10.052 3.395 7.133 1.00 1.42 H new ATOM 0 HH12 ARG A 68 -10.169 2.673 8.741 1.00 1.42 H new ATOM 0 HH21 ARG A 68 -7.070 1.000 8.513 1.00 1.87 H new ATOM 0 HH22 ARG A 68 -8.487 1.322 9.519 1.00 1.87 H new ATOM 816 N SER A 69 -3.221 3.019 3.394 1.00 0.31 N ATOM 817 CA SER A 69 -1.848 3.434 3.656 1.00 0.32 C ATOM 818 C SER A 69 -1.309 4.279 2.505 1.00 0.27 C ATOM 819 O SER A 69 -0.657 5.292 2.729 1.00 0.27 O ATOM 820 CB SER A 69 -0.939 2.223 3.924 1.00 0.43 C ATOM 821 OG SER A 69 -0.908 1.313 2.832 1.00 1.16 O ATOM 0 H SER A 69 -3.384 2.015 3.468 1.00 0.31 H new ATOM 0 HA SER A 69 -1.851 4.049 4.556 1.00 0.32 H new ATOM 0 HB2 SER A 69 0.073 2.571 4.131 1.00 0.43 H new ATOM 0 HB3 SER A 69 -1.286 1.703 4.817 1.00 0.43 H new ATOM 0 HG SER A 69 -1.650 1.508 2.222 1.00 1.16 H new ATOM 827 N LEU A 70 -1.627 3.879 1.277 1.00 0.28 N ATOM 828 CA LEU A 70 -1.220 4.617 0.089 1.00 0.31 C ATOM 829 C LEU A 70 -1.890 5.994 0.052 1.00 0.31 C ATOM 830 O LEU A 70 -1.262 6.988 -0.307 1.00 0.38 O ATOM 831 CB LEU A 70 -1.555 3.795 -1.168 1.00 0.36 C ATOM 832 CG LEU A 70 -1.060 4.355 -2.511 1.00 0.46 C ATOM 833 CD1 LEU A 70 -2.009 5.414 -3.052 1.00 1.25 C ATOM 834 CD2 LEU A 70 0.349 4.918 -2.373 1.00 1.16 C ATOM 0 H LEU A 70 -2.171 3.039 1.080 1.00 0.28 H new ATOM 0 HA LEU A 70 -0.143 4.781 0.118 1.00 0.31 H new ATOM 0 HB2 LEU A 70 -1.139 2.796 -1.042 1.00 0.36 H new ATOM 0 HB3 LEU A 70 -2.638 3.685 -1.224 1.00 0.36 H new ATOM 0 HG LEU A 70 -1.035 3.532 -3.225 1.00 0.46 H new ATOM 0 HD11 LEU A 70 -1.631 5.790 -4.003 1.00 1.25 H new ATOM 0 HD12 LEU A 70 -2.996 4.976 -3.202 1.00 1.25 H new ATOM 0 HD13 LEU A 70 -2.081 6.236 -2.340 1.00 1.25 H new ATOM 0 HD21 LEU A 70 0.680 5.309 -3.335 1.00 1.16 H new ATOM 0 HD22 LEU A 70 0.350 5.720 -1.635 1.00 1.16 H new ATOM 0 HD23 LEU A 70 1.027 4.128 -2.050 1.00 1.16 H new ATOM 846 N ALA A 71 -3.155 6.054 0.447 1.00 0.26 N ATOM 847 CA ALA A 71 -3.893 7.308 0.453 1.00 0.30 C ATOM 848 C ALA A 71 -3.311 8.254 1.495 1.00 0.29 C ATOM 849 O ALA A 71 -3.159 9.453 1.252 1.00 0.36 O ATOM 850 CB ALA A 71 -5.366 7.052 0.715 1.00 0.32 C ATOM 0 H ALA A 71 -3.691 5.247 0.768 1.00 0.26 H new ATOM 0 HA ALA A 71 -3.800 7.778 -0.526 1.00 0.30 H new ATOM 0 HB1 ALA A 71 -5.905 7.999 0.717 1.00 0.32 H new ATOM 0 HB2 ALA A 71 -5.768 6.407 -0.066 1.00 0.32 H new ATOM 0 HB3 ALA A 71 -5.484 6.566 1.683 1.00 0.32 H new ATOM 856 N TYR A 72 -2.961 7.696 2.647 1.00 0.25 N ATOM 857 CA TYR A 72 -2.266 8.443 3.687 1.00 0.25 C ATOM 858 C TYR A 72 -0.866 8.832 3.201 1.00 0.26 C ATOM 859 O TYR A 72 -0.297 9.837 3.628 1.00 0.30 O ATOM 860 CB TYR A 72 -2.167 7.608 4.970 1.00 0.25 C ATOM 861 CG TYR A 72 -3.489 7.376 5.683 1.00 0.29 C ATOM 862 CD1 TYR A 72 -4.179 8.428 6.274 1.00 0.34 C ATOM 863 CD2 TYR A 72 -4.043 6.104 5.774 1.00 0.41 C ATOM 864 CE1 TYR A 72 -5.378 8.220 6.932 1.00 0.41 C ATOM 865 CE2 TYR A 72 -5.240 5.888 6.429 1.00 0.47 C ATOM 866 CZ TYR A 72 -5.905 6.947 7.006 1.00 0.43 C ATOM 867 OH TYR A 72 -7.099 6.733 7.661 1.00 0.52 O ATOM 0 H TYR A 72 -3.149 6.722 2.885 1.00 0.25 H new ATOM 0 HA TYR A 72 -2.831 9.349 3.907 1.00 0.25 H new ATOM 0 HB2 TYR A 72 -1.728 6.641 4.724 1.00 0.25 H new ATOM 0 HB3 TYR A 72 -1.482 8.104 5.657 1.00 0.25 H new ATOM 0 HD1 TYR A 72 -3.771 9.427 6.218 1.00 0.34 H new ATOM 0 HD2 TYR A 72 -3.527 5.269 5.324 1.00 0.41 H new ATOM 0 HE1 TYR A 72 -5.899 9.050 7.386 1.00 0.41 H new ATOM 0 HE2 TYR A 72 -5.653 4.892 6.488 1.00 0.47 H new ATOM 0 HH TYR A 72 -7.329 5.781 7.620 1.00 0.52 H new ATOM 877 N LEU A 73 -0.329 8.022 2.292 1.00 0.26 N ATOM 878 CA LEU A 73 0.970 8.276 1.673 1.00 0.30 C ATOM 879 C LEU A 73 0.880 9.380 0.628 1.00 0.37 C ATOM 880 O LEU A 73 1.897 9.906 0.178 1.00 0.50 O ATOM 881 CB LEU A 73 1.498 6.991 1.026 1.00 0.31 C ATOM 882 CG LEU A 73 2.100 5.983 2.006 1.00 0.31 C ATOM 883 CD1 LEU A 73 2.411 4.667 1.310 1.00 0.33 C ATOM 884 CD2 LEU A 73 3.358 6.551 2.641 1.00 0.43 C ATOM 0 H LEU A 73 -0.783 7.170 1.963 1.00 0.26 H new ATOM 0 HA LEU A 73 1.657 8.603 2.453 1.00 0.30 H new ATOM 0 HB2 LEU A 73 0.682 6.510 0.487 1.00 0.31 H new ATOM 0 HB3 LEU A 73 2.255 7.256 0.288 1.00 0.31 H new ATOM 0 HG LEU A 73 1.366 5.790 2.788 1.00 0.31 H new ATOM 0 HD11 LEU A 73 2.838 3.967 2.029 1.00 0.33 H new ATOM 0 HD12 LEU A 73 1.493 4.248 0.897 1.00 0.33 H new ATOM 0 HD13 LEU A 73 3.125 4.841 0.505 1.00 0.33 H new ATOM 0 HD21 LEU A 73 3.775 5.823 3.336 1.00 0.43 H new ATOM 0 HD22 LEU A 73 4.090 6.772 1.864 1.00 0.43 H new ATOM 0 HD23 LEU A 73 3.112 7.467 3.179 1.00 0.43 H new ATOM 896 N ARG A 74 -0.334 9.705 0.215 1.00 0.38 N ATOM 897 CA ARG A 74 -0.544 10.769 -0.758 1.00 0.48 C ATOM 898 C ARG A 74 -0.697 12.108 -0.061 1.00 0.53 C ATOM 899 O ARG A 74 -0.216 13.132 -0.546 1.00 0.67 O ATOM 900 CB ARG A 74 -1.786 10.490 -1.608 1.00 0.51 C ATOM 901 CG ARG A 74 -1.796 9.127 -2.291 1.00 0.48 C ATOM 902 CD ARG A 74 -0.662 8.963 -3.299 1.00 1.19 C ATOM 903 NE ARG A 74 0.664 9.070 -2.688 1.00 1.95 N ATOM 904 CZ ARG A 74 1.757 9.456 -3.344 1.00 2.78 C ATOM 905 NH1 ARG A 74 1.704 9.709 -4.648 1.00 3.07 N ATOM 906 NH2 ARG A 74 2.904 9.600 -2.695 1.00 3.53 N ATOM 0 H ARG A 74 -1.188 9.250 0.536 1.00 0.38 H new ATOM 0 HA ARG A 74 0.330 10.803 -1.409 1.00 0.48 H new ATOM 0 HB2 ARG A 74 -2.669 10.570 -0.974 1.00 0.51 H new ATOM 0 HB3 ARG A 74 -1.869 11.264 -2.371 1.00 0.51 H new ATOM 0 HG2 ARG A 74 -1.720 8.346 -1.535 1.00 0.48 H new ATOM 0 HG3 ARG A 74 -2.750 8.987 -2.799 1.00 0.48 H new ATOM 0 HD2 ARG A 74 -0.754 7.993 -3.787 1.00 1.19 H new ATOM 0 HD3 ARG A 74 -0.761 9.721 -4.076 1.00 1.19 H new ATOM 0 HE ARG A 74 0.756 8.835 -1.700 1.00 1.95 H new ATOM 0 HH11 ARG A 74 0.823 9.608 -5.152 1.00 3.07 H new ATOM 0 HH12 ARG A 74 2.544 10.004 -5.145 1.00 3.07 H new ATOM 0 HH21 ARG A 74 2.950 9.415 -1.693 1.00 3.53 H new ATOM 0 HH22 ARG A 74 3.741 9.896 -3.198 1.00 3.53 H new ATOM 920 N THR A 75 -1.364 12.090 1.081 1.00 0.48 N ATOM 921 CA THR A 75 -1.646 13.307 1.816 1.00 0.57 C ATOM 922 C THR A 75 -0.398 13.806 2.556 1.00 0.70 C ATOM 923 O THR A 75 0.328 14.664 2.049 1.00 1.53 O ATOM 924 CB THR A 75 -2.819 13.075 2.795 1.00 0.54 C ATOM 925 OG1 THR A 75 -2.510 12.000 3.695 1.00 0.55 O ATOM 926 CG2 THR A 75 -4.090 12.730 2.033 1.00 0.49 C ATOM 0 H THR A 75 -1.721 11.241 1.519 1.00 0.48 H new ATOM 0 HA THR A 75 -1.936 14.082 1.106 1.00 0.57 H new ATOM 0 HB THR A 75 -2.974 13.994 3.360 1.00 0.54 H new ATOM 0 HG1 THR A 75 -2.830 12.224 4.594 1.00 0.55 H new ATOM 0 HG21 THR A 75 -4.905 12.570 2.739 1.00 0.49 H new ATOM 0 HG22 THR A 75 -4.346 13.550 1.362 1.00 0.49 H new ATOM 0 HG23 THR A 75 -3.930 11.822 1.451 1.00 0.49 H new ATOM 934 N GLU A 76 -0.154 13.248 3.737 1.00 0.57 N ATOM 935 CA GLU A 76 1.039 13.548 4.539 1.00 0.59 C ATOM 936 C GLU A 76 1.044 12.686 5.800 1.00 0.42 C ATOM 937 O GLU A 76 1.743 12.972 6.769 1.00 0.45 O ATOM 938 CB GLU A 76 1.086 15.044 4.904 1.00 0.86 C ATOM 939 CG GLU A 76 -0.194 15.585 5.537 1.00 1.85 C ATOM 940 CD GLU A 76 -0.308 15.289 7.020 1.00 2.38 C ATOM 941 OE1 GLU A 76 0.294 16.024 7.830 1.00 2.71 O ATOM 942 OE2 GLU A 76 -1.002 14.319 7.380 1.00 2.77 O ATOM 0 H GLU A 76 -0.779 12.570 4.172 1.00 0.57 H new ATOM 0 HA GLU A 76 1.927 13.317 3.950 1.00 0.59 H new ATOM 0 HB2 GLU A 76 1.915 15.211 5.592 1.00 0.86 H new ATOM 0 HB3 GLU A 76 1.300 15.618 4.002 1.00 0.86 H new ATOM 0 HG2 GLU A 76 -0.237 16.664 5.386 1.00 1.85 H new ATOM 0 HG3 GLU A 76 -1.054 15.156 5.022 1.00 1.85 H new ATOM 949 N CYS A 77 0.312 11.586 5.734 1.00 0.32 N ATOM 950 CA CYS A 77 -0.059 10.812 6.907 1.00 0.32 C ATOM 951 C CYS A 77 0.740 9.527 7.000 1.00 0.32 C ATOM 952 O CYS A 77 0.209 8.491 7.389 1.00 0.35 O ATOM 953 CB CYS A 77 -1.547 10.496 6.862 1.00 0.33 C ATOM 954 SG CYS A 77 -2.606 11.957 6.754 1.00 0.37 S ATOM 0 H CYS A 77 -0.044 11.202 4.858 1.00 0.32 H new ATOM 0 HA CYS A 77 0.164 11.409 7.792 1.00 0.32 H new ATOM 0 HB2 CYS A 77 -1.745 9.852 6.005 1.00 0.33 H new ATOM 0 HB3 CYS A 77 -1.815 9.931 7.755 1.00 0.33 H new ATOM 0 HG CYS A 77 -1.868 13.026 6.714 1.00 0.37 H new ATOM 960 N TYR A 78 2.001 9.598 6.605 1.00 0.34 N ATOM 961 CA TYR A 78 2.873 8.429 6.539 1.00 0.38 C ATOM 962 C TYR A 78 2.861 7.623 7.849 1.00 0.41 C ATOM 963 O TYR A 78 3.104 6.416 7.837 1.00 0.43 O ATOM 964 CB TYR A 78 4.299 8.855 6.206 1.00 0.44 C ATOM 965 CG TYR A 78 4.389 10.047 5.273 1.00 0.42 C ATOM 966 CD1 TYR A 78 3.715 10.065 4.058 1.00 0.55 C ATOM 967 CD2 TYR A 78 5.160 11.152 5.610 1.00 0.54 C ATOM 968 CE1 TYR A 78 3.804 11.150 3.209 1.00 0.66 C ATOM 969 CE2 TYR A 78 5.256 12.238 4.763 1.00 0.66 C ATOM 970 CZ TYR A 78 4.577 12.230 3.564 1.00 0.66 C ATOM 971 OH TYR A 78 4.679 13.308 2.716 1.00 0.84 O ATOM 0 H TYR A 78 2.452 10.467 6.320 1.00 0.34 H new ATOM 0 HA TYR A 78 2.489 7.782 5.750 1.00 0.38 H new ATOM 0 HB2 TYR A 78 4.821 9.093 7.133 1.00 0.44 H new ATOM 0 HB3 TYR A 78 4.822 8.013 5.753 1.00 0.44 H new ATOM 0 HD1 TYR A 78 3.111 9.216 3.773 1.00 0.55 H new ATOM 0 HD2 TYR A 78 5.693 11.162 6.549 1.00 0.54 H new ATOM 0 HE1 TYR A 78 3.269 11.150 2.271 1.00 0.66 H new ATOM 0 HE2 TYR A 78 5.860 13.090 5.039 1.00 0.66 H new ATOM 0 HH TYR A 78 5.262 13.986 3.117 1.00 0.84 H new ATOM 981 N GLY A 79 2.584 8.290 8.969 1.00 0.43 N ATOM 982 CA GLY A 79 2.419 7.587 10.230 1.00 0.49 C ATOM 983 C GLY A 79 1.219 6.658 10.198 1.00 0.42 C ATOM 984 O GLY A 79 1.355 5.451 10.408 1.00 0.42 O ATOM 0 H GLY A 79 2.471 9.302 9.025 1.00 0.43 H new ATOM 0 HA2 GLY A 79 3.319 7.012 10.448 1.00 0.49 H new ATOM 0 HA3 GLY A 79 2.299 8.310 11.037 1.00 0.49 H new ATOM 988 N TYR A 80 0.039 7.224 9.923 1.00 0.38 N ATOM 989 CA TYR A 80 -1.168 6.429 9.693 1.00 0.36 C ATOM 990 C TYR A 80 -0.916 5.395 8.610 1.00 0.30 C ATOM 991 O TYR A 80 -1.379 4.259 8.700 1.00 0.32 O ATOM 992 CB TYR A 80 -2.339 7.314 9.253 1.00 0.40 C ATOM 993 CG TYR A 80 -3.157 7.902 10.380 1.00 0.56 C ATOM 994 CD1 TYR A 80 -3.615 7.108 11.424 1.00 0.96 C ATOM 995 CD2 TYR A 80 -3.506 9.246 10.375 1.00 1.06 C ATOM 996 CE1 TYR A 80 -4.395 7.638 12.434 1.00 1.28 C ATOM 997 CE2 TYR A 80 -4.280 9.785 11.382 1.00 1.34 C ATOM 998 CZ TYR A 80 -4.724 8.978 12.409 1.00 1.29 C ATOM 999 OH TYR A 80 -5.511 9.510 13.405 1.00 1.70 O ATOM 0 H TYR A 80 -0.104 8.232 9.855 1.00 0.38 H new ATOM 0 HA TYR A 80 -1.421 5.939 10.633 1.00 0.36 H new ATOM 0 HB2 TYR A 80 -1.949 8.130 8.644 1.00 0.40 H new ATOM 0 HB3 TYR A 80 -2.998 6.726 8.614 1.00 0.40 H new ATOM 0 HD1 TYR A 80 -3.357 6.059 11.447 1.00 0.96 H new ATOM 0 HD2 TYR A 80 -3.166 9.880 9.569 1.00 1.06 H new ATOM 0 HE1 TYR A 80 -4.745 7.007 13.238 1.00 1.28 H new ATOM 0 HE2 TYR A 80 -4.537 10.834 11.366 1.00 1.34 H new ATOM 0 HH TYR A 80 -5.647 10.466 13.239 1.00 1.70 H new ATOM 1009 N ALA A 81 -0.177 5.811 7.589 1.00 0.28 N ATOM 1010 CA ALA A 81 0.145 4.958 6.462 1.00 0.28 C ATOM 1011 C ALA A 81 0.818 3.677 6.918 1.00 0.29 C ATOM 1012 O ALA A 81 0.256 2.603 6.764 1.00 0.33 O ATOM 1013 CB ALA A 81 1.026 5.700 5.472 1.00 0.31 C ATOM 0 H ALA A 81 0.214 6.751 7.523 1.00 0.28 H new ATOM 0 HA ALA A 81 -0.787 4.687 5.966 1.00 0.28 H new ATOM 0 HB1 ALA A 81 1.259 5.046 4.631 1.00 0.31 H new ATOM 0 HB2 ALA A 81 0.501 6.584 5.110 1.00 0.31 H new ATOM 0 HB3 ALA A 81 1.951 6.003 5.964 1.00 0.31 H new ATOM 1019 N LEU A 82 2.002 3.795 7.511 1.00 0.30 N ATOM 1020 CA LEU A 82 2.763 2.623 7.935 1.00 0.34 C ATOM 1021 C LEU A 82 1.987 1.842 8.999 1.00 0.32 C ATOM 1022 O LEU A 82 2.047 0.612 9.045 1.00 0.37 O ATOM 1023 CB LEU A 82 4.152 3.047 8.449 1.00 0.42 C ATOM 1024 CG LEU A 82 5.216 1.933 8.579 1.00 0.49 C ATOM 1025 CD1 LEU A 82 4.937 1.014 9.751 1.00 0.49 C ATOM 1026 CD2 LEU A 82 5.303 1.116 7.303 1.00 0.52 C ATOM 0 H LEU A 82 2.455 4.687 7.709 1.00 0.30 H new ATOM 0 HA LEU A 82 2.910 1.965 7.079 1.00 0.34 H new ATOM 0 HB2 LEU A 82 4.543 3.814 7.780 1.00 0.42 H new ATOM 0 HB3 LEU A 82 4.025 3.512 9.427 1.00 0.42 H new ATOM 0 HG LEU A 82 6.170 2.430 8.756 1.00 0.49 H new ATOM 0 HD11 LEU A 82 5.710 0.247 9.804 1.00 0.49 H new ATOM 0 HD12 LEU A 82 4.936 1.592 10.675 1.00 0.49 H new ATOM 0 HD13 LEU A 82 3.964 0.541 9.619 1.00 0.49 H new ATOM 0 HD21 LEU A 82 6.058 0.339 7.419 1.00 0.52 H new ATOM 0 HD22 LEU A 82 4.336 0.655 7.099 1.00 0.52 H new ATOM 0 HD23 LEU A 82 5.577 1.767 6.472 1.00 0.52 H new ATOM 1038 N ASN A 83 1.240 2.556 9.832 1.00 0.32 N ATOM 1039 CA ASN A 83 0.436 1.927 10.877 1.00 0.39 C ATOM 1040 C ASN A 83 -0.611 0.992 10.274 1.00 0.38 C ATOM 1041 O ASN A 83 -0.616 -0.213 10.545 1.00 0.42 O ATOM 1042 CB ASN A 83 -0.253 2.992 11.733 1.00 0.47 C ATOM 1043 CG ASN A 83 -1.069 2.395 12.862 1.00 1.25 C ATOM 1044 OD1 ASN A 83 -2.244 2.070 12.695 1.00 1.86 O ATOM 1045 ND2 ASN A 83 -0.452 2.253 14.023 1.00 2.09 N ATOM 0 H ASN A 83 1.173 3.573 9.805 1.00 0.32 H new ATOM 0 HA ASN A 83 1.105 1.339 11.506 1.00 0.39 H new ATOM 0 HB2 ASN A 83 0.500 3.662 12.149 1.00 0.47 H new ATOM 0 HB3 ASN A 83 -0.903 3.597 11.100 1.00 0.47 H new ATOM 0 HD21 ASN A 83 -0.952 1.862 14.821 1.00 2.09 H new ATOM 0 HD22 ASN A 83 0.523 2.535 14.120 1.00 2.09 H new ATOM 1052 N ASP A 84 -1.482 1.552 9.443 1.00 0.39 N ATOM 1053 CA ASP A 84 -2.543 0.780 8.798 1.00 0.45 C ATOM 1054 C ASP A 84 -1.927 -0.226 7.829 1.00 0.42 C ATOM 1055 O ASP A 84 -2.457 -1.314 7.602 1.00 0.44 O ATOM 1056 CB ASP A 84 -3.496 1.730 8.062 1.00 0.55 C ATOM 1057 CG ASP A 84 -4.833 1.098 7.724 1.00 0.74 C ATOM 1058 OD1 ASP A 84 -5.498 0.582 8.643 1.00 1.10 O ATOM 1059 OD2 ASP A 84 -5.251 1.160 6.549 1.00 1.19 O ATOM 0 H ASP A 84 -1.476 2.542 9.198 1.00 0.39 H new ATOM 0 HA ASP A 84 -3.111 0.234 9.551 1.00 0.45 H new ATOM 0 HB2 ASP A 84 -3.665 2.613 8.678 1.00 0.55 H new ATOM 0 HB3 ASP A 84 -3.020 2.070 7.142 1.00 0.55 H new ATOM 1064 N ALA A 85 -0.773 0.146 7.291 1.00 0.41 N ATOM 1065 CA ALA A 85 -0.003 -0.717 6.410 1.00 0.43 C ATOM 1066 C ALA A 85 0.428 -1.994 7.128 1.00 0.42 C ATOM 1067 O ALA A 85 0.256 -3.102 6.612 1.00 0.42 O ATOM 1068 CB ALA A 85 1.217 0.032 5.896 1.00 0.48 C ATOM 0 H ALA A 85 -0.345 1.057 7.455 1.00 0.41 H new ATOM 0 HA ALA A 85 -0.635 -1.002 5.569 1.00 0.43 H new ATOM 0 HB1 ALA A 85 1.792 -0.618 5.236 1.00 0.48 H new ATOM 0 HB2 ALA A 85 0.896 0.916 5.345 1.00 0.48 H new ATOM 0 HB3 ALA A 85 1.839 0.335 6.738 1.00 0.48 H new ATOM 1074 N THR A 86 0.991 -1.834 8.318 1.00 0.42 N ATOM 1075 CA THR A 86 1.442 -2.967 9.115 1.00 0.44 C ATOM 1076 C THR A 86 0.268 -3.872 9.455 1.00 0.43 C ATOM 1077 O THR A 86 0.397 -5.098 9.499 1.00 0.44 O ATOM 1078 CB THR A 86 2.131 -2.495 10.413 1.00 0.47 C ATOM 1079 OG1 THR A 86 3.199 -1.598 10.091 1.00 0.47 O ATOM 1080 CG2 THR A 86 2.686 -3.672 11.202 1.00 0.55 C ATOM 0 H THR A 86 1.147 -0.925 8.755 1.00 0.42 H new ATOM 0 HA THR A 86 2.168 -3.525 8.524 1.00 0.44 H new ATOM 0 HB THR A 86 1.386 -1.988 11.027 1.00 0.47 H new ATOM 0 HG1 THR A 86 2.833 -0.790 9.675 1.00 0.47 H new ATOM 0 HG21 THR A 86 3.165 -3.307 12.111 1.00 0.55 H new ATOM 0 HG22 THR A 86 1.873 -4.348 11.467 1.00 0.55 H new ATOM 0 HG23 THR A 86 3.418 -4.205 10.595 1.00 0.55 H new ATOM 1088 N ARG A 87 -0.891 -3.265 9.654 1.00 0.43 N ATOM 1089 CA ARG A 87 -2.078 -4.024 9.992 1.00 0.43 C ATOM 1090 C ARG A 87 -2.527 -4.864 8.806 1.00 0.39 C ATOM 1091 O ARG A 87 -3.133 -5.917 8.979 1.00 0.38 O ATOM 1092 CB ARG A 87 -3.207 -3.101 10.460 1.00 0.47 C ATOM 1093 CG ARG A 87 -4.349 -3.847 11.128 1.00 0.58 C ATOM 1094 CD ARG A 87 -3.875 -4.548 12.389 1.00 0.71 C ATOM 1095 NE ARG A 87 -4.856 -5.506 12.892 1.00 1.63 N ATOM 1096 CZ ARG A 87 -4.593 -6.406 13.839 1.00 2.24 C ATOM 1097 NH1 ARG A 87 -3.408 -6.417 14.435 1.00 2.10 N ATOM 1098 NH2 ARG A 87 -5.521 -7.282 14.202 1.00 3.28 N ATOM 0 H ARG A 87 -1.032 -2.257 9.587 1.00 0.43 H new ATOM 0 HA ARG A 87 -1.830 -4.693 10.816 1.00 0.43 H new ATOM 0 HB2 ARG A 87 -2.803 -2.368 11.158 1.00 0.47 H new ATOM 0 HB3 ARG A 87 -3.594 -2.548 9.604 1.00 0.47 H new ATOM 0 HG2 ARG A 87 -5.150 -3.149 11.374 1.00 0.58 H new ATOM 0 HG3 ARG A 87 -4.765 -4.578 10.435 1.00 0.58 H new ATOM 0 HD2 ARG A 87 -2.937 -5.065 12.184 1.00 0.71 H new ATOM 0 HD3 ARG A 87 -3.668 -3.805 13.159 1.00 0.71 H new ATOM 0 HE ARG A 87 -5.796 -5.485 12.496 1.00 1.63 H new ATOM 0 HH11 ARG A 87 -2.697 -5.736 14.169 1.00 2.10 H new ATOM 0 HH12 ARG A 87 -3.208 -7.106 15.160 1.00 2.10 H new ATOM 0 HH21 ARG A 87 -6.438 -7.268 13.756 1.00 3.28 H new ATOM 0 HH22 ARG A 87 -5.317 -7.970 14.927 1.00 3.28 H new ATOM 1112 N ALA A 88 -2.214 -4.408 7.602 1.00 0.39 N ATOM 1113 CA ALA A 88 -2.488 -5.195 6.415 1.00 0.38 C ATOM 1114 C ALA A 88 -1.649 -6.465 6.410 1.00 0.39 C ATOM 1115 O ALA A 88 -2.151 -7.533 6.082 1.00 0.41 O ATOM 1116 CB ALA A 88 -2.240 -4.400 5.153 1.00 0.42 C ATOM 0 H ALA A 88 -1.774 -3.505 7.425 1.00 0.39 H new ATOM 0 HA ALA A 88 -3.543 -5.468 6.438 1.00 0.38 H new ATOM 0 HB1 ALA A 88 -2.455 -5.021 4.284 1.00 0.42 H new ATOM 0 HB2 ALA A 88 -2.888 -3.523 5.142 1.00 0.42 H new ATOM 0 HB3 ALA A 88 -1.198 -4.082 5.122 1.00 0.42 H new ATOM 1122 N ILE A 89 -0.363 -6.345 6.757 1.00 0.42 N ATOM 1123 CA ILE A 89 0.491 -7.522 6.941 1.00 0.47 C ATOM 1124 C ILE A 89 -0.129 -8.501 7.941 1.00 0.47 C ATOM 1125 O ILE A 89 0.068 -9.713 7.852 1.00 0.59 O ATOM 1126 CB ILE A 89 1.892 -7.142 7.453 1.00 0.60 C ATOM 1127 CG1 ILE A 89 2.318 -5.785 6.878 1.00 0.73 C ATOM 1128 CG2 ILE A 89 2.886 -8.239 7.098 1.00 0.66 C ATOM 1129 CD1 ILE A 89 3.820 -5.594 6.771 1.00 1.15 C ATOM 0 H ILE A 89 0.106 -5.453 6.915 1.00 0.42 H new ATOM 0 HA ILE A 89 0.579 -7.990 5.960 1.00 0.47 H new ATOM 0 HB ILE A 89 1.868 -7.046 8.539 1.00 0.60 H new ATOM 0 HG12 ILE A 89 1.878 -5.669 5.888 1.00 0.73 H new ATOM 0 HG13 ILE A 89 1.907 -4.993 7.504 1.00 0.73 H new ATOM 0 HG21 ILE A 89 3.876 -7.965 7.463 1.00 0.66 H new ATOM 0 HG22 ILE A 89 2.575 -9.175 7.561 1.00 0.66 H new ATOM 0 HG23 ILE A 89 2.920 -8.363 6.016 1.00 0.66 H new ATOM 0 HD11 ILE A 89 4.033 -4.609 6.355 1.00 1.15 H new ATOM 0 HD12 ILE A 89 4.268 -5.675 7.761 1.00 1.15 H new ATOM 0 HD13 ILE A 89 4.239 -6.361 6.119 1.00 1.15 H new ATOM 1141 N GLU A 90 -0.860 -7.966 8.904 1.00 0.42 N ATOM 1142 CA GLU A 90 -1.542 -8.789 9.892 1.00 0.43 C ATOM 1143 C GLU A 90 -2.746 -9.495 9.272 1.00 0.40 C ATOM 1144 O GLU A 90 -3.062 -10.629 9.622 1.00 0.47 O ATOM 1145 CB GLU A 90 -1.991 -7.927 11.070 1.00 0.44 C ATOM 1146 CG GLU A 90 -0.842 -7.293 11.834 1.00 0.50 C ATOM 1147 CD GLU A 90 -0.071 -8.299 12.660 1.00 0.58 C ATOM 1148 OE1 GLU A 90 -0.485 -8.587 13.803 1.00 0.82 O ATOM 1149 OE2 GLU A 90 0.960 -8.808 12.167 1.00 0.73 O ATOM 0 H GLU A 90 -0.998 -6.962 9.024 1.00 0.42 H new ATOM 0 HA GLU A 90 -0.845 -9.547 10.248 1.00 0.43 H new ATOM 0 HB2 GLU A 90 -2.650 -7.140 10.703 1.00 0.44 H new ATOM 0 HB3 GLU A 90 -2.577 -8.540 11.755 1.00 0.44 H new ATOM 0 HG2 GLU A 90 -0.164 -6.810 11.130 1.00 0.50 H new ATOM 0 HG3 GLU A 90 -1.231 -6.513 12.488 1.00 0.50 H new ATOM 1156 N LEU A 91 -3.405 -8.815 8.345 1.00 0.38 N ATOM 1157 CA LEU A 91 -4.576 -9.357 7.666 1.00 0.39 C ATOM 1158 C LEU A 91 -4.160 -10.384 6.616 1.00 0.43 C ATOM 1159 O LEU A 91 -4.623 -11.526 6.620 1.00 0.51 O ATOM 1160 CB LEU A 91 -5.358 -8.230 6.998 1.00 0.36 C ATOM 1161 CG LEU A 91 -5.733 -7.063 7.907 1.00 0.37 C ATOM 1162 CD1 LEU A 91 -6.482 -6.011 7.120 1.00 0.39 C ATOM 1163 CD2 LEU A 91 -6.568 -7.530 9.090 1.00 0.45 C ATOM 0 H LEU A 91 -3.146 -7.876 8.042 1.00 0.38 H new ATOM 0 HA LEU A 91 -5.208 -9.848 8.406 1.00 0.39 H new ATOM 0 HB2 LEU A 91 -4.768 -7.845 6.166 1.00 0.36 H new ATOM 0 HB3 LEU A 91 -6.272 -8.647 6.575 1.00 0.36 H new ATOM 0 HG LEU A 91 -4.812 -6.629 8.297 1.00 0.37 H new ATOM 0 HD11 LEU A 91 -6.745 -5.183 7.778 1.00 0.39 H new ATOM 0 HD12 LEU A 91 -5.851 -5.645 6.310 1.00 0.39 H new ATOM 0 HD13 LEU A 91 -7.391 -6.446 6.704 1.00 0.39 H new ATOM 0 HD21 LEU A 91 -6.819 -6.675 9.718 1.00 0.45 H new ATOM 0 HD22 LEU A 91 -7.485 -7.995 8.727 1.00 0.45 H new ATOM 0 HD23 LEU A 91 -6.000 -8.255 9.673 1.00 0.45 H new ATOM 1175 N ASP A 92 -3.262 -9.967 5.736 1.00 0.46 N ATOM 1176 CA ASP A 92 -2.751 -10.811 4.683 1.00 0.53 C ATOM 1177 C ASP A 92 -1.257 -10.803 4.778 1.00 0.56 C ATOM 1178 O ASP A 92 -0.596 -9.903 4.257 1.00 0.82 O ATOM 1179 CB ASP A 92 -3.182 -10.355 3.285 1.00 0.66 C ATOM 1180 CG ASP A 92 -4.658 -10.561 3.004 1.00 1.77 C ATOM 1181 OD1 ASP A 92 -5.020 -11.655 2.521 1.00 2.32 O ATOM 1182 OD2 ASP A 92 -5.459 -9.629 3.237 1.00 2.34 O ATOM 0 H ASP A 92 -2.869 -9.026 5.738 1.00 0.46 H new ATOM 0 HA ASP A 92 -3.160 -11.812 4.817 1.00 0.53 H new ATOM 0 HB2 ASP A 92 -2.943 -9.298 3.168 1.00 0.66 H new ATOM 0 HB3 ASP A 92 -2.600 -10.898 2.540 1.00 0.66 H new ATOM 1187 N LYS A 93 -0.738 -11.779 5.495 1.00 0.48 N ATOM 1188 CA LYS A 93 0.680 -11.864 5.747 1.00 0.50 C ATOM 1189 C LYS A 93 1.428 -11.841 4.427 1.00 0.55 C ATOM 1190 O LYS A 93 2.332 -11.032 4.247 1.00 0.64 O ATOM 1191 CB LYS A 93 0.988 -13.129 6.531 1.00 0.55 C ATOM 1192 CG LYS A 93 2.236 -13.041 7.406 1.00 0.73 C ATOM 1193 CD LYS A 93 3.495 -12.738 6.607 1.00 1.22 C ATOM 1194 CE LYS A 93 4.702 -12.571 7.519 1.00 1.76 C ATOM 1195 NZ LYS A 93 5.937 -12.235 6.760 1.00 2.61 N ATOM 0 H LYS A 93 -1.286 -12.530 5.916 1.00 0.48 H new ATOM 0 HA LYS A 93 1.003 -11.010 6.342 1.00 0.50 H new ATOM 0 HB2 LYS A 93 0.132 -13.368 7.163 1.00 0.55 H new ATOM 0 HB3 LYS A 93 1.108 -13.956 5.831 1.00 0.55 H new ATOM 0 HG2 LYS A 93 2.093 -12.265 8.158 1.00 0.73 H new ATOM 0 HG3 LYS A 93 2.367 -13.982 7.940 1.00 0.73 H new ATOM 0 HD2 LYS A 93 3.681 -13.545 5.898 1.00 1.22 H new ATOM 0 HD3 LYS A 93 3.348 -11.829 6.024 1.00 1.22 H new ATOM 0 HE2 LYS A 93 4.500 -11.785 8.247 1.00 1.76 H new ATOM 0 HE3 LYS A 93 4.862 -13.492 8.080 1.00 1.76 H new ATOM 0 HZ1 LYS A 93 6.733 -12.131 7.421 1.00 2.61 H new ATOM 0 HZ2 LYS A 93 6.146 -12.996 6.083 1.00 2.61 H new ATOM 0 HZ3 LYS A 93 5.796 -11.343 6.245 1.00 2.61 H new ATOM 1209 N LYS A 94 1.046 -12.705 3.491 1.00 0.55 N ATOM 1210 CA LYS A 94 1.620 -12.613 2.166 1.00 0.61 C ATOM 1211 C LYS A 94 0.747 -11.737 1.287 1.00 0.60 C ATOM 1212 O LYS A 94 -0.284 -12.162 0.763 1.00 0.69 O ATOM 1213 CB LYS A 94 1.787 -13.995 1.529 1.00 0.76 C ATOM 1214 CG LYS A 94 2.942 -14.800 2.103 1.00 0.96 C ATOM 1215 CD LYS A 94 3.160 -16.091 1.328 1.00 1.17 C ATOM 1216 CE LYS A 94 3.400 -15.828 -0.155 1.00 1.41 C ATOM 1217 NZ LYS A 94 4.638 -15.043 -0.403 1.00 2.11 N ATOM 0 H LYS A 94 0.364 -13.451 3.624 1.00 0.55 H new ATOM 0 HA LYS A 94 2.610 -12.167 2.257 1.00 0.61 H new ATOM 0 HB2 LYS A 94 0.863 -14.559 1.659 1.00 0.76 H new ATOM 0 HB3 LYS A 94 1.938 -13.874 0.456 1.00 0.76 H new ATOM 0 HG2 LYS A 94 3.852 -14.201 2.078 1.00 0.96 H new ATOM 0 HG3 LYS A 94 2.741 -15.032 3.149 1.00 0.96 H new ATOM 0 HD2 LYS A 94 4.013 -16.626 1.745 1.00 1.17 H new ATOM 0 HD3 LYS A 94 2.290 -16.737 1.446 1.00 1.17 H new ATOM 0 HE2 LYS A 94 3.465 -16.779 -0.683 1.00 1.41 H new ATOM 0 HE3 LYS A 94 2.545 -15.292 -0.568 1.00 1.41 H new ATOM 0 HZ1 LYS A 94 4.791 -14.950 -1.428 1.00 2.11 H new ATOM 0 HZ2 LYS A 94 4.540 -14.098 0.020 1.00 2.11 H new ATOM 0 HZ3 LYS A 94 5.450 -15.531 0.025 1.00 2.11 H new ATOM 1231 N TYR A 95 1.179 -10.502 1.169 1.00 0.53 N ATOM 1232 CA TYR A 95 0.627 -9.543 0.236 1.00 0.58 C ATOM 1233 C TYR A 95 1.793 -8.731 -0.328 1.00 0.55 C ATOM 1234 O TYR A 95 2.260 -7.791 0.315 1.00 0.55 O ATOM 1235 CB TYR A 95 -0.413 -8.669 0.964 1.00 0.63 C ATOM 1236 CG TYR A 95 -1.045 -7.560 0.143 1.00 0.81 C ATOM 1237 CD1 TYR A 95 -1.425 -7.746 -1.183 1.00 0.99 C ATOM 1238 CD2 TYR A 95 -1.258 -6.311 0.711 1.00 0.91 C ATOM 1239 CE1 TYR A 95 -1.995 -6.712 -1.913 1.00 1.19 C ATOM 1240 CE2 TYR A 95 -1.818 -5.278 -0.011 1.00 1.12 C ATOM 1241 CZ TYR A 95 -2.188 -5.481 -1.318 1.00 1.23 C ATOM 1242 OH TYR A 95 -2.719 -4.432 -2.036 1.00 1.46 O ATOM 0 H TYR A 95 1.942 -10.126 1.732 1.00 0.53 H new ATOM 0 HA TYR A 95 0.107 -10.025 -0.592 1.00 0.58 H new ATOM 0 HB2 TYR A 95 -1.207 -9.317 1.334 1.00 0.63 H new ATOM 0 HB3 TYR A 95 0.065 -8.221 1.835 1.00 0.63 H new ATOM 0 HD1 TYR A 95 -1.274 -8.708 -1.650 1.00 0.99 H new ATOM 0 HD2 TYR A 95 -0.979 -6.145 1.741 1.00 0.91 H new ATOM 0 HE1 TYR A 95 -2.286 -6.870 -2.941 1.00 1.19 H new ATOM 0 HE2 TYR A 95 -1.965 -4.312 0.450 1.00 1.12 H new ATOM 0 HH TYR A 95 -2.786 -3.642 -1.460 1.00 1.46 H new ATOM 1252 N ILE A 96 2.297 -9.124 -1.498 1.00 0.56 N ATOM 1253 CA ILE A 96 3.521 -8.534 -2.054 1.00 0.55 C ATOM 1254 C ILE A 96 3.358 -7.038 -2.282 1.00 0.49 C ATOM 1255 O ILE A 96 4.218 -6.239 -1.897 1.00 0.45 O ATOM 1256 CB ILE A 96 3.939 -9.217 -3.378 1.00 0.64 C ATOM 1257 CG1 ILE A 96 4.150 -10.718 -3.164 1.00 0.87 C ATOM 1258 CG2 ILE A 96 5.202 -8.583 -3.934 1.00 0.59 C ATOM 1259 CD1 ILE A 96 5.142 -11.035 -2.066 1.00 0.83 C ATOM 0 H ILE A 96 1.878 -9.848 -2.081 1.00 0.56 H new ATOM 0 HA ILE A 96 4.308 -8.698 -1.318 1.00 0.55 H new ATOM 0 HB ILE A 96 3.135 -9.077 -4.101 1.00 0.64 H new ATOM 0 HG12 ILE A 96 3.193 -11.181 -2.924 1.00 0.87 H new ATOM 0 HG13 ILE A 96 4.496 -11.165 -4.096 1.00 0.87 H new ATOM 0 HG21 ILE A 96 5.478 -9.078 -4.865 1.00 0.59 H new ATOM 0 HG22 ILE A 96 5.024 -7.525 -4.125 1.00 0.59 H new ATOM 0 HG23 ILE A 96 6.011 -8.690 -3.212 1.00 0.59 H new ATOM 0 HD11 ILE A 96 5.243 -12.116 -1.968 1.00 0.83 H new ATOM 0 HD12 ILE A 96 6.110 -10.601 -2.314 1.00 0.83 H new ATOM 0 HD13 ILE A 96 4.788 -10.617 -1.124 1.00 0.83 H new ATOM 1271 N LYS A 97 2.238 -6.666 -2.885 1.00 0.54 N ATOM 1272 CA LYS A 97 1.890 -5.264 -3.076 1.00 0.55 C ATOM 1273 C LYS A 97 1.814 -4.547 -1.727 1.00 0.50 C ATOM 1274 O LYS A 97 1.954 -3.326 -1.639 1.00 0.51 O ATOM 1275 CB LYS A 97 0.538 -5.149 -3.785 1.00 0.71 C ATOM 1276 CG LYS A 97 0.551 -5.530 -5.257 1.00 1.28 C ATOM 1277 CD LYS A 97 -0.854 -5.466 -5.834 1.00 1.65 C ATOM 1278 CE LYS A 97 -0.863 -5.540 -7.353 1.00 1.73 C ATOM 1279 NZ LYS A 97 -2.244 -5.433 -7.899 1.00 1.59 N ATOM 0 H LYS A 97 1.549 -7.322 -3.254 1.00 0.54 H new ATOM 0 HA LYS A 97 2.662 -4.798 -3.688 1.00 0.55 H new ATOM 0 HB2 LYS A 97 -0.182 -5.783 -3.267 1.00 0.71 H new ATOM 0 HB3 LYS A 97 0.183 -4.123 -3.694 1.00 0.71 H new ATOM 0 HG2 LYS A 97 1.208 -4.857 -5.808 1.00 1.28 H new ATOM 0 HG3 LYS A 97 0.954 -6.536 -5.375 1.00 1.28 H new ATOM 0 HD2 LYS A 97 -1.447 -6.286 -5.430 1.00 1.65 H new ATOM 0 HD3 LYS A 97 -1.332 -4.540 -5.516 1.00 1.65 H new ATOM 0 HE2 LYS A 97 -0.247 -4.738 -7.760 1.00 1.73 H new ATOM 0 HE3 LYS A 97 -0.416 -6.481 -7.675 1.00 1.73 H new ATOM 0 HZ1 LYS A 97 -2.212 -5.487 -8.937 1.00 1.59 H new ATOM 0 HZ2 LYS A 97 -2.825 -6.212 -7.529 1.00 1.59 H new ATOM 0 HZ3 LYS A 97 -2.661 -4.524 -7.613 1.00 1.59 H new ATOM 1293 N GLY A 98 1.614 -5.326 -0.675 1.00 0.51 N ATOM 1294 CA GLY A 98 1.444 -4.768 0.640 1.00 0.52 C ATOM 1295 C GLY A 98 2.748 -4.337 1.242 1.00 0.43 C ATOM 1296 O GLY A 98 2.900 -3.174 1.601 1.00 0.48 O ATOM 0 H GLY A 98 1.567 -6.344 -0.715 1.00 0.51 H new ATOM 0 HA2 GLY A 98 0.770 -3.913 0.586 1.00 0.52 H new ATOM 0 HA3 GLY A 98 0.972 -5.506 1.288 1.00 0.52 H new ATOM 1300 N TYR A 99 3.696 -5.265 1.339 1.00 0.35 N ATOM 1301 CA TYR A 99 5.017 -4.946 1.874 1.00 0.29 C ATOM 1302 C TYR A 99 5.558 -3.702 1.166 1.00 0.31 C ATOM 1303 O TYR A 99 6.147 -2.818 1.781 1.00 0.32 O ATOM 1304 CB TYR A 99 6.021 -6.075 1.625 1.00 0.30 C ATOM 1305 CG TYR A 99 5.591 -7.470 2.018 1.00 0.38 C ATOM 1306 CD1 TYR A 99 5.227 -7.787 3.322 1.00 0.64 C ATOM 1307 CD2 TYR A 99 5.595 -8.487 1.072 1.00 0.98 C ATOM 1308 CE1 TYR A 99 4.873 -9.078 3.663 1.00 0.71 C ATOM 1309 CE2 TYR A 99 5.252 -9.777 1.409 1.00 1.11 C ATOM 1310 CZ TYR A 99 4.892 -10.069 2.702 1.00 0.72 C ATOM 1311 OH TYR A 99 4.559 -11.358 3.040 1.00 0.92 O ATOM 0 H TYR A 99 3.576 -6.238 1.056 1.00 0.35 H new ATOM 0 HA TYR A 99 4.904 -4.792 2.947 1.00 0.29 H new ATOM 0 HB2 TYR A 99 6.267 -6.082 0.563 1.00 0.30 H new ATOM 0 HB3 TYR A 99 6.939 -5.838 2.164 1.00 0.30 H new ATOM 0 HD1 TYR A 99 5.221 -7.015 4.077 1.00 0.64 H new ATOM 0 HD2 TYR A 99 5.872 -8.262 0.053 1.00 0.98 H new ATOM 0 HE1 TYR A 99 4.583 -9.311 4.677 1.00 0.71 H new ATOM 0 HE2 TYR A 99 5.266 -10.555 0.661 1.00 1.11 H new ATOM 0 HH TYR A 99 3.942 -11.348 3.801 1.00 0.92 H new ATOM 1321 N TYR A 100 5.321 -3.669 -0.146 1.00 0.34 N ATOM 1322 CA TYR A 100 5.752 -2.582 -1.021 1.00 0.37 C ATOM 1323 C TYR A 100 5.245 -1.236 -0.498 1.00 0.39 C ATOM 1324 O TYR A 100 6.000 -0.266 -0.405 1.00 0.42 O ATOM 1325 CB TYR A 100 5.206 -2.851 -2.430 1.00 0.42 C ATOM 1326 CG TYR A 100 5.915 -2.128 -3.554 1.00 0.43 C ATOM 1327 CD1 TYR A 100 5.503 -0.870 -3.971 1.00 0.51 C ATOM 1328 CD2 TYR A 100 6.978 -2.728 -4.225 1.00 0.46 C ATOM 1329 CE1 TYR A 100 6.131 -0.226 -5.021 1.00 0.60 C ATOM 1330 CE2 TYR A 100 7.604 -2.093 -5.281 1.00 0.55 C ATOM 1331 CZ TYR A 100 7.177 -0.843 -5.672 1.00 0.60 C ATOM 1332 OH TYR A 100 7.786 -0.219 -6.732 1.00 0.73 O ATOM 0 H TYR A 100 4.817 -4.408 -0.636 1.00 0.34 H new ATOM 0 HA TYR A 100 6.841 -2.538 -1.046 1.00 0.37 H new ATOM 0 HB2 TYR A 100 5.257 -3.923 -2.622 1.00 0.42 H new ATOM 0 HB3 TYR A 100 4.152 -2.574 -2.451 1.00 0.42 H new ATOM 0 HD1 TYR A 100 4.679 -0.387 -3.467 1.00 0.51 H new ATOM 0 HD2 TYR A 100 7.318 -3.705 -3.915 1.00 0.46 H new ATOM 0 HE1 TYR A 100 5.803 0.756 -5.329 1.00 0.60 H new ATOM 0 HE2 TYR A 100 8.423 -2.574 -5.796 1.00 0.55 H new ATOM 0 HH TYR A 100 7.508 -0.648 -7.568 1.00 0.73 H new ATOM 1342 N ARG A 101 3.964 -1.188 -0.142 1.00 0.41 N ATOM 1343 CA ARG A 101 3.373 0.028 0.417 1.00 0.46 C ATOM 1344 C ARG A 101 3.964 0.365 1.789 1.00 0.43 C ATOM 1345 O ARG A 101 4.167 1.538 2.103 1.00 0.46 O ATOM 1346 CB ARG A 101 1.850 -0.093 0.524 1.00 0.53 C ATOM 1347 CG ARG A 101 1.096 0.397 -0.706 1.00 0.82 C ATOM 1348 CD ARG A 101 1.476 -0.374 -1.958 1.00 1.06 C ATOM 1349 NE ARG A 101 0.609 -0.055 -3.089 1.00 1.18 N ATOM 1350 CZ ARG A 101 -0.142 -0.957 -3.720 1.00 1.58 C ATOM 1351 NH1 ARG A 101 -0.174 -2.212 -3.309 1.00 2.34 N ATOM 1352 NH2 ARG A 101 -0.873 -0.602 -4.756 1.00 1.89 N ATOM 0 H ARG A 101 3.317 -1.972 -0.229 1.00 0.41 H new ATOM 0 HA ARG A 101 3.614 0.840 -0.270 1.00 0.46 H new ATOM 0 HB2 ARG A 101 1.591 -1.137 0.703 1.00 0.53 H new ATOM 0 HB3 ARG A 101 1.512 0.472 1.392 1.00 0.53 H new ATOM 0 HG2 ARG A 101 0.024 0.302 -0.534 1.00 0.82 H new ATOM 0 HG3 ARG A 101 1.302 1.457 -0.858 1.00 0.82 H new ATOM 0 HD2 ARG A 101 2.510 -0.149 -2.221 1.00 1.06 H new ATOM 0 HD3 ARG A 101 1.424 -1.443 -1.753 1.00 1.06 H new ATOM 0 HE ARG A 101 0.576 0.911 -3.414 1.00 1.18 H new ATOM 0 HH11 ARG A 101 0.379 -2.498 -2.502 1.00 2.34 H new ATOM 0 HH12 ARG A 101 -0.752 -2.895 -3.799 1.00 2.34 H new ATOM 0 HH21 ARG A 101 -0.866 0.366 -5.078 1.00 1.89 H new ATOM 0 HH22 ARG A 101 -1.447 -1.295 -5.237 1.00 1.89 H new ATOM 1366 N ARG A 102 4.239 -0.657 2.605 1.00 0.41 N ATOM 1367 CA ARG A 102 4.871 -0.435 3.910 1.00 0.43 C ATOM 1368 C ARG A 102 6.232 0.214 3.724 1.00 0.37 C ATOM 1369 O ARG A 102 6.561 1.204 4.377 1.00 0.38 O ATOM 1370 CB ARG A 102 5.059 -1.738 4.699 1.00 0.52 C ATOM 1371 CG ARG A 102 3.863 -2.175 5.531 1.00 0.87 C ATOM 1372 CD ARG A 102 2.830 -2.925 4.709 1.00 1.12 C ATOM 1373 NE ARG A 102 1.962 -2.034 3.935 1.00 1.87 N ATOM 1374 CZ ARG A 102 0.761 -2.384 3.467 1.00 2.58 C ATOM 1375 NH1 ARG A 102 0.341 -3.637 3.589 1.00 2.78 N ATOM 1376 NH2 ARG A 102 -0.014 -1.486 2.869 1.00 3.57 N ATOM 0 H ARG A 102 4.038 -1.633 2.390 1.00 0.41 H new ATOM 0 HA ARG A 102 4.204 0.216 4.475 1.00 0.43 H new ATOM 0 HB2 ARG A 102 5.303 -2.536 3.997 1.00 0.52 H new ATOM 0 HB3 ARG A 102 5.917 -1.622 5.361 1.00 0.52 H new ATOM 0 HG2 ARG A 102 4.205 -2.811 6.348 1.00 0.87 H new ATOM 0 HG3 ARG A 102 3.398 -1.299 5.982 1.00 0.87 H new ATOM 0 HD2 ARG A 102 3.340 -3.608 4.029 1.00 1.12 H new ATOM 0 HD3 ARG A 102 2.217 -3.534 5.373 1.00 1.12 H new ATOM 0 HE ARG A 102 2.295 -1.089 3.742 1.00 1.87 H new ATOM 0 HH11 ARG A 102 0.935 -4.332 4.040 1.00 2.78 H new ATOM 0 HH12 ARG A 102 -0.576 -3.905 3.232 1.00 2.78 H new ATOM 0 HH21 ARG A 102 0.307 -0.523 2.765 1.00 3.57 H new ATOM 0 HH22 ARG A 102 -0.930 -1.759 2.514 1.00 3.57 H new ATOM 1390 N ALA A 103 7.004 -0.352 2.810 1.00 0.34 N ATOM 1391 CA ALA A 103 8.331 0.148 2.497 1.00 0.32 C ATOM 1392 C ALA A 103 8.286 1.617 2.087 1.00 0.33 C ATOM 1393 O ALA A 103 9.179 2.393 2.422 1.00 0.35 O ATOM 1394 CB ALA A 103 8.943 -0.685 1.390 1.00 0.33 C ATOM 0 H ALA A 103 6.728 -1.169 2.266 1.00 0.34 H new ATOM 0 HA ALA A 103 8.947 0.070 3.393 1.00 0.32 H new ATOM 0 HB1 ALA A 103 9.939 -0.307 1.158 1.00 0.33 H new ATOM 0 HB2 ALA A 103 9.016 -1.723 1.714 1.00 0.33 H new ATOM 0 HB3 ALA A 103 8.316 -0.625 0.501 1.00 0.33 H new ATOM 1400 N ALA A 104 7.223 2.002 1.387 1.00 0.33 N ATOM 1401 CA ALA A 104 7.074 3.368 0.915 1.00 0.35 C ATOM 1402 C ALA A 104 6.805 4.309 2.081 1.00 0.35 C ATOM 1403 O ALA A 104 7.233 5.464 2.070 1.00 0.38 O ATOM 1404 CB ALA A 104 5.955 3.455 -0.108 1.00 0.39 C ATOM 0 H ALA A 104 6.452 1.383 1.135 1.00 0.33 H new ATOM 0 HA ALA A 104 8.005 3.672 0.436 1.00 0.35 H new ATOM 0 HB1 ALA A 104 5.856 4.485 -0.452 1.00 0.39 H new ATOM 0 HB2 ALA A 104 6.186 2.810 -0.956 1.00 0.39 H new ATOM 0 HB3 ALA A 104 5.019 3.133 0.348 1.00 0.39 H new ATOM 1410 N SER A 105 6.109 3.803 3.093 1.00 0.34 N ATOM 1411 CA SER A 105 5.816 4.599 4.275 1.00 0.36 C ATOM 1412 C SER A 105 7.061 4.700 5.148 1.00 0.34 C ATOM 1413 O SER A 105 7.366 5.765 5.679 1.00 0.33 O ATOM 1414 CB SER A 105 4.657 3.992 5.065 1.00 0.40 C ATOM 1415 OG SER A 105 3.670 3.459 4.199 1.00 0.64 O ATOM 0 H SER A 105 5.740 2.852 3.118 1.00 0.34 H new ATOM 0 HA SER A 105 5.520 5.599 3.959 1.00 0.36 H new ATOM 0 HB2 SER A 105 5.032 3.206 5.720 1.00 0.40 H new ATOM 0 HB3 SER A 105 4.211 4.754 5.704 1.00 0.40 H new ATOM 0 HG SER A 105 2.941 3.076 4.730 1.00 0.64 H new ATOM 1421 N ASN A 106 7.788 3.591 5.272 1.00 0.36 N ATOM 1422 CA ASN A 106 9.048 3.573 6.015 1.00 0.37 C ATOM 1423 C ASN A 106 10.057 4.516 5.371 1.00 0.36 C ATOM 1424 O ASN A 106 10.739 5.274 6.062 1.00 0.37 O ATOM 1425 CB ASN A 106 9.621 2.152 6.087 1.00 0.40 C ATOM 1426 CG ASN A 106 8.947 1.302 7.150 1.00 0.43 C ATOM 1427 OD1 ASN A 106 8.515 1.815 8.183 1.00 1.09 O ATOM 1428 ND2 ASN A 106 8.854 0.002 6.914 1.00 1.32 N ATOM 0 H ASN A 106 7.526 2.692 4.867 1.00 0.36 H new ATOM 0 HA ASN A 106 8.847 3.913 7.031 1.00 0.37 H new ATOM 0 HB2 ASN A 106 9.508 1.669 5.116 1.00 0.40 H new ATOM 0 HB3 ASN A 106 10.690 2.206 6.294 1.00 0.40 H new ATOM 0 HD21 ASN A 106 8.413 -0.611 7.600 1.00 1.32 H new ATOM 0 HD22 ASN A 106 9.224 -0.387 6.046 1.00 1.32 H new ATOM 1435 N MET A 107 10.133 4.471 4.045 1.00 0.38 N ATOM 1436 CA MET A 107 10.966 5.393 3.278 1.00 0.40 C ATOM 1437 C MET A 107 10.598 6.837 3.595 1.00 0.40 C ATOM 1438 O MET A 107 11.462 7.674 3.859 1.00 0.45 O ATOM 1439 CB MET A 107 10.777 5.140 1.781 1.00 0.46 C ATOM 1440 CG MET A 107 11.975 4.502 1.108 1.00 0.44 C ATOM 1441 SD MET A 107 13.400 5.602 1.070 1.00 1.26 S ATOM 1442 CE MET A 107 14.577 4.570 0.210 1.00 0.70 C ATOM 0 H MET A 107 9.622 3.798 3.473 1.00 0.38 H new ATOM 0 HA MET A 107 12.008 5.225 3.551 1.00 0.40 H new ATOM 0 HB2 MET A 107 9.908 4.497 1.638 1.00 0.46 H new ATOM 0 HB3 MET A 107 10.558 6.087 1.288 1.00 0.46 H new ATOM 0 HG2 MET A 107 12.240 3.585 1.635 1.00 0.44 H new ATOM 0 HG3 MET A 107 11.709 4.219 0.089 1.00 0.44 H new ATOM 0 HE1 MET A 107 15.514 4.545 0.766 1.00 0.70 H new ATOM 0 HE2 MET A 107 14.179 3.559 0.124 1.00 0.70 H new ATOM 0 HE3 MET A 107 14.757 4.975 -0.786 1.00 0.70 H new ATOM 1452 N ALA A 108 9.300 7.104 3.575 1.00 0.36 N ATOM 1453 CA ALA A 108 8.769 8.431 3.850 1.00 0.38 C ATOM 1454 C ALA A 108 9.096 8.881 5.274 1.00 0.39 C ATOM 1455 O ALA A 108 9.445 10.039 5.501 1.00 0.43 O ATOM 1456 CB ALA A 108 7.266 8.439 3.615 1.00 0.38 C ATOM 0 H ALA A 108 8.585 6.406 3.368 1.00 0.36 H new ATOM 0 HA ALA A 108 9.242 9.139 3.170 1.00 0.38 H new ATOM 0 HB1 ALA A 108 6.871 9.434 3.822 1.00 0.38 H new ATOM 0 HB2 ALA A 108 7.058 8.174 2.578 1.00 0.38 H new ATOM 0 HB3 ALA A 108 6.790 7.715 4.277 1.00 0.38 H new ATOM 1462 N LEU A 109 8.990 7.960 6.225 1.00 0.38 N ATOM 1463 CA LEU A 109 9.279 8.262 7.624 1.00 0.40 C ATOM 1464 C LEU A 109 10.771 8.507 7.837 1.00 0.43 C ATOM 1465 O LEU A 109 11.162 9.399 8.594 1.00 0.65 O ATOM 1466 CB LEU A 109 8.808 7.118 8.524 1.00 0.38 C ATOM 1467 CG LEU A 109 7.298 6.862 8.525 1.00 0.48 C ATOM 1468 CD1 LEU A 109 6.970 5.636 9.362 1.00 0.75 C ATOM 1469 CD2 LEU A 109 6.551 8.079 9.051 1.00 0.82 C ATOM 0 H LEU A 109 8.706 6.996 6.053 1.00 0.38 H new ATOM 0 HA LEU A 109 8.739 9.171 7.888 1.00 0.40 H new ATOM 0 HB2 LEU A 109 9.314 6.203 8.215 1.00 0.38 H new ATOM 0 HB3 LEU A 109 9.124 7.328 9.546 1.00 0.38 H new ATOM 0 HG LEU A 109 6.978 6.678 7.499 1.00 0.48 H new ATOM 0 HD11 LEU A 109 5.893 5.467 9.353 1.00 0.75 H new ATOM 0 HD12 LEU A 109 7.478 4.765 8.947 1.00 0.75 H new ATOM 0 HD13 LEU A 109 7.304 5.796 10.387 1.00 0.75 H new ATOM 0 HD21 LEU A 109 5.480 7.879 9.045 1.00 0.82 H new ATOM 0 HD22 LEU A 109 6.874 8.292 10.070 1.00 0.82 H new ATOM 0 HD23 LEU A 109 6.763 8.939 8.416 1.00 0.82 H new ATOM 1481 N GLY A 110 11.598 7.714 7.169 1.00 0.39 N ATOM 1482 CA GLY A 110 13.034 7.859 7.305 1.00 0.41 C ATOM 1483 C GLY A 110 13.706 6.568 7.726 1.00 0.39 C ATOM 1484 O GLY A 110 14.882 6.558 8.093 1.00 0.47 O ATOM 0 H GLY A 110 11.300 6.973 6.535 1.00 0.39 H new ATOM 0 HA2 GLY A 110 13.455 8.192 6.356 1.00 0.41 H new ATOM 0 HA3 GLY A 110 13.250 8.635 8.039 1.00 0.41 H new ATOM 1488 N LYS A 111 12.955 5.478 7.680 1.00 0.36 N ATOM 1489 CA LYS A 111 13.481 4.165 8.018 1.00 0.38 C ATOM 1490 C LYS A 111 13.960 3.467 6.754 1.00 0.30 C ATOM 1491 O LYS A 111 13.275 2.602 6.217 1.00 0.32 O ATOM 1492 CB LYS A 111 12.411 3.317 8.711 1.00 0.53 C ATOM 1493 CG LYS A 111 11.967 3.856 10.060 1.00 0.74 C ATOM 1494 CD LYS A 111 10.833 3.026 10.637 1.00 0.54 C ATOM 1495 CE LYS A 111 10.444 3.495 12.032 1.00 1.22 C ATOM 1496 NZ LYS A 111 11.529 3.262 13.022 1.00 1.73 N ATOM 0 H LYS A 111 11.972 5.478 7.410 1.00 0.36 H new ATOM 0 HA LYS A 111 14.319 4.288 8.704 1.00 0.38 H new ATOM 0 HB2 LYS A 111 11.542 3.244 8.057 1.00 0.53 H new ATOM 0 HB3 LYS A 111 12.795 2.306 8.845 1.00 0.53 H new ATOM 0 HG2 LYS A 111 12.810 3.854 10.751 1.00 0.74 H new ATOM 0 HG3 LYS A 111 11.645 4.892 9.953 1.00 0.74 H new ATOM 0 HD2 LYS A 111 9.967 3.086 9.978 1.00 0.54 H new ATOM 0 HD3 LYS A 111 11.132 1.979 10.676 1.00 0.54 H new ATOM 0 HE2 LYS A 111 10.202 4.557 12.003 1.00 1.22 H new ATOM 0 HE3 LYS A 111 9.543 2.972 12.352 1.00 1.22 H new ATOM 0 HZ1 LYS A 111 11.154 3.386 13.984 1.00 1.73 H new ATOM 0 HZ2 LYS A 111 11.895 2.294 12.915 1.00 1.73 H new ATOM 0 HZ3 LYS A 111 12.299 3.943 12.860 1.00 1.73 H new ATOM 1510 N PHE A 112 15.127 3.867 6.271 1.00 0.30 N ATOM 1511 CA PHE A 112 15.646 3.371 5.005 1.00 0.29 C ATOM 1512 C PHE A 112 16.032 1.898 5.077 1.00 0.30 C ATOM 1513 O PHE A 112 15.904 1.172 4.095 1.00 0.34 O ATOM 1514 CB PHE A 112 16.840 4.216 4.572 1.00 0.35 C ATOM 1515 CG PHE A 112 16.499 5.672 4.468 1.00 0.39 C ATOM 1516 CD1 PHE A 112 15.769 6.146 3.394 1.00 0.41 C ATOM 1517 CD2 PHE A 112 16.891 6.562 5.453 1.00 0.48 C ATOM 1518 CE1 PHE A 112 15.438 7.481 3.301 1.00 0.48 C ATOM 1519 CE2 PHE A 112 16.560 7.899 5.367 1.00 0.54 C ATOM 1520 CZ PHE A 112 15.835 8.358 4.289 1.00 0.53 C ATOM 0 H PHE A 112 15.736 4.538 6.740 1.00 0.30 H new ATOM 0 HA PHE A 112 14.851 3.455 4.264 1.00 0.29 H new ATOM 0 HB2 PHE A 112 17.653 4.086 5.287 1.00 0.35 H new ATOM 0 HB3 PHE A 112 17.203 3.860 3.608 1.00 0.35 H new ATOM 0 HD1 PHE A 112 15.454 5.463 2.619 1.00 0.41 H new ATOM 0 HD2 PHE A 112 17.462 6.206 6.298 1.00 0.48 H new ATOM 0 HE1 PHE A 112 14.869 7.840 2.456 1.00 0.48 H new ATOM 0 HE2 PHE A 112 16.869 8.584 6.143 1.00 0.54 H new ATOM 0 HZ PHE A 112 15.578 9.404 4.218 1.00 0.53 H new ATOM 1530 N ARG A 113 16.492 1.444 6.232 1.00 0.34 N ATOM 1531 CA ARG A 113 16.872 0.044 6.370 1.00 0.38 C ATOM 1532 C ARG A 113 15.641 -0.806 6.645 1.00 0.34 C ATOM 1533 O ARG A 113 15.561 -1.959 6.221 1.00 0.34 O ATOM 1534 CB ARG A 113 17.923 -0.147 7.464 1.00 0.49 C ATOM 1535 CG ARG A 113 19.181 0.676 7.237 1.00 1.21 C ATOM 1536 CD ARG A 113 20.396 0.067 7.921 1.00 1.58 C ATOM 1537 NE ARG A 113 20.196 -0.124 9.356 1.00 2.42 N ATOM 1538 CZ ARG A 113 21.180 -0.086 10.253 1.00 3.14 C ATOM 1539 NH1 ARG A 113 22.423 0.173 9.872 1.00 3.25 N ATOM 1540 NH2 ARG A 113 20.921 -0.317 11.530 1.00 4.15 N ATOM 0 H ARG A 113 16.610 2.009 7.073 1.00 0.34 H new ATOM 0 HA ARG A 113 17.320 -0.280 5.431 1.00 0.38 H new ATOM 0 HB2 ARG A 113 17.489 0.123 8.427 1.00 0.49 H new ATOM 0 HB3 ARG A 113 18.192 -1.202 7.520 1.00 0.49 H new ATOM 0 HG2 ARG A 113 19.371 0.758 6.167 1.00 1.21 H new ATOM 0 HG3 ARG A 113 19.024 1.688 7.611 1.00 1.21 H new ATOM 0 HD2 ARG A 113 20.625 -0.893 7.459 1.00 1.58 H new ATOM 0 HD3 ARG A 113 21.260 0.712 7.761 1.00 1.58 H new ATOM 0 HE ARG A 113 19.248 -0.296 9.690 1.00 2.42 H new ATOM 0 HH11 ARG A 113 22.630 0.344 8.888 1.00 3.25 H new ATOM 0 HH12 ARG A 113 23.173 0.201 10.563 1.00 3.25 H new ATOM 0 HH21 ARG A 113 19.968 -0.524 11.828 1.00 4.15 H new ATOM 0 HH22 ARG A 113 21.675 -0.288 12.217 1.00 4.15 H new ATOM 1554 N ALA A 114 14.671 -0.223 7.337 1.00 0.34 N ATOM 1555 CA ALA A 114 13.402 -0.894 7.574 1.00 0.34 C ATOM 1556 C ALA A 114 12.635 -1.041 6.265 1.00 0.28 C ATOM 1557 O ALA A 114 12.098 -2.105 5.962 1.00 0.30 O ATOM 1558 CB ALA A 114 12.575 -0.132 8.595 1.00 0.40 C ATOM 0 H ALA A 114 14.739 0.710 7.743 1.00 0.34 H new ATOM 0 HA ALA A 114 13.603 -1.888 7.975 1.00 0.34 H new ATOM 0 HB1 ALA A 114 11.630 -0.650 8.758 1.00 0.40 H new ATOM 0 HB2 ALA A 114 13.123 -0.072 9.535 1.00 0.40 H new ATOM 0 HB3 ALA A 114 12.378 0.874 8.225 1.00 0.40 H new ATOM 1564 N ALA A 115 12.626 0.026 5.471 1.00 0.26 N ATOM 1565 CA ALA A 115 11.968 0.010 4.176 1.00 0.23 C ATOM 1566 C ALA A 115 12.658 -0.978 3.258 1.00 0.23 C ATOM 1567 O ALA A 115 12.027 -1.607 2.406 1.00 0.25 O ATOM 1568 CB ALA A 115 11.982 1.396 3.556 1.00 0.23 C ATOM 0 H ALA A 115 13.070 0.914 5.706 1.00 0.26 H new ATOM 0 HA ALA A 115 10.931 -0.297 4.315 1.00 0.23 H new ATOM 0 HB1 ALA A 115 11.485 1.366 2.586 1.00 0.23 H new ATOM 0 HB2 ALA A 115 11.458 2.093 4.211 1.00 0.23 H new ATOM 0 HB3 ALA A 115 13.013 1.726 3.425 1.00 0.23 H new ATOM 1574 N LEU A 116 13.963 -1.120 3.448 1.00 0.24 N ATOM 1575 CA LEU A 116 14.735 -2.064 2.669 1.00 0.28 C ATOM 1576 C LEU A 116 14.310 -3.483 2.995 1.00 0.29 C ATOM 1577 O LEU A 116 14.323 -4.338 2.128 1.00 0.30 O ATOM 1578 CB LEU A 116 16.233 -1.902 2.912 1.00 0.32 C ATOM 1579 CG LEU A 116 17.106 -2.786 2.022 1.00 0.40 C ATOM 1580 CD1 LEU A 116 16.856 -2.462 0.563 1.00 0.47 C ATOM 1581 CD2 LEU A 116 18.576 -2.624 2.363 1.00 0.49 C ATOM 0 H LEU A 116 14.503 -0.593 4.134 1.00 0.24 H new ATOM 0 HA LEU A 116 14.541 -1.860 1.616 1.00 0.28 H new ATOM 0 HB2 LEU A 116 16.506 -0.859 2.751 1.00 0.32 H new ATOM 0 HB3 LEU A 116 16.448 -2.130 3.956 1.00 0.32 H new ATOM 0 HG LEU A 116 16.837 -3.827 2.202 1.00 0.40 H new ATOM 0 HD11 LEU A 116 17.483 -3.097 -0.063 1.00 0.47 H new ATOM 0 HD12 LEU A 116 15.807 -2.640 0.325 1.00 0.47 H new ATOM 0 HD13 LEU A 116 17.098 -1.416 0.376 1.00 0.47 H new ATOM 0 HD21 LEU A 116 19.173 -3.265 1.714 1.00 0.49 H new ATOM 0 HD22 LEU A 116 18.871 -1.585 2.218 1.00 0.49 H new ATOM 0 HD23 LEU A 116 18.742 -2.906 3.403 1.00 0.49 H new ATOM 1593 N ARG A 117 13.912 -3.721 4.239 1.00 0.34 N ATOM 1594 CA ARG A 117 13.427 -5.036 4.642 1.00 0.40 C ATOM 1595 C ARG A 117 12.169 -5.372 3.871 1.00 0.34 C ATOM 1596 O ARG A 117 11.985 -6.495 3.393 1.00 0.35 O ATOM 1597 CB ARG A 117 13.092 -5.075 6.128 1.00 0.57 C ATOM 1598 CG ARG A 117 14.274 -4.908 7.053 1.00 0.70 C ATOM 1599 CD ARG A 117 13.820 -4.993 8.494 1.00 1.01 C ATOM 1600 NE ARG A 117 13.073 -6.227 8.751 1.00 1.90 N ATOM 1601 CZ ARG A 117 13.217 -6.977 9.841 1.00 2.55 C ATOM 1602 NH1 ARG A 117 14.061 -6.614 10.797 1.00 2.45 N ATOM 1603 NH2 ARG A 117 12.494 -8.085 9.979 1.00 3.56 N ATOM 0 H ARG A 117 13.915 -3.024 4.984 1.00 0.34 H new ATOM 0 HA ARG A 117 14.218 -5.756 4.434 1.00 0.40 H new ATOM 0 HB2 ARG A 117 12.368 -4.289 6.343 1.00 0.57 H new ATOM 0 HB3 ARG A 117 12.607 -6.025 6.351 1.00 0.57 H new ATOM 0 HG2 ARG A 117 15.016 -5.680 6.851 1.00 0.70 H new ATOM 0 HG3 ARG A 117 14.756 -3.947 6.871 1.00 0.70 H new ATOM 0 HD2 ARG A 117 14.687 -4.948 9.153 1.00 1.01 H new ATOM 0 HD3 ARG A 117 13.195 -4.132 8.731 1.00 1.01 H new ATOM 0 HE ARG A 117 12.399 -6.531 8.049 1.00 1.90 H new ATOM 0 HH11 ARG A 117 14.604 -5.756 10.699 1.00 2.45 H new ATOM 0 HH12 ARG A 117 14.167 -7.193 11.630 1.00 2.45 H new ATOM 0 HH21 ARG A 117 11.833 -8.356 9.251 1.00 3.56 H new ATOM 0 HH22 ARG A 117 12.601 -8.663 10.813 1.00 3.56 H new ATOM 1617 N ASP A 118 11.308 -4.378 3.758 1.00 0.33 N ATOM 1618 CA ASP A 118 10.026 -4.554 3.113 1.00 0.33 C ATOM 1619 C ASP A 118 10.210 -4.778 1.620 1.00 0.28 C ATOM 1620 O ASP A 118 9.652 -5.715 1.048 1.00 0.31 O ATOM 1621 CB ASP A 118 9.125 -3.350 3.378 1.00 0.40 C ATOM 1622 CG ASP A 118 8.664 -3.282 4.819 1.00 0.63 C ATOM 1623 OD1 ASP A 118 7.808 -4.102 5.214 1.00 0.77 O ATOM 1624 OD2 ASP A 118 9.166 -2.416 5.566 1.00 1.06 O ATOM 0 H ASP A 118 11.478 -3.435 4.108 1.00 0.33 H new ATOM 0 HA ASP A 118 9.543 -5.437 3.532 1.00 0.33 H new ATOM 0 HB2 ASP A 118 9.662 -2.435 3.127 1.00 0.40 H new ATOM 0 HB3 ASP A 118 8.255 -3.399 2.723 1.00 0.40 H new ATOM 1629 N TYR A 119 11.026 -3.932 0.998 1.00 0.24 N ATOM 1630 CA TYR A 119 11.351 -4.080 -0.416 1.00 0.26 C ATOM 1631 C TYR A 119 12.121 -5.375 -0.664 1.00 0.28 C ATOM 1632 O TYR A 119 11.919 -6.042 -1.680 1.00 0.33 O ATOM 1633 CB TYR A 119 12.171 -2.890 -0.918 1.00 0.28 C ATOM 1634 CG TYR A 119 11.367 -1.625 -1.126 1.00 0.33 C ATOM 1635 CD1 TYR A 119 10.140 -1.656 -1.779 1.00 0.38 C ATOM 1636 CD2 TYR A 119 11.835 -0.401 -0.671 1.00 0.38 C ATOM 1637 CE1 TYR A 119 9.404 -0.499 -1.970 1.00 0.46 C ATOM 1638 CE2 TYR A 119 11.107 0.759 -0.858 1.00 0.47 C ATOM 1639 CZ TYR A 119 9.892 0.705 -1.509 1.00 0.50 C ATOM 1640 OH TYR A 119 9.161 1.858 -1.695 1.00 0.60 O ATOM 0 H TYR A 119 11.474 -3.136 1.452 1.00 0.24 H new ATOM 0 HA TYR A 119 10.411 -4.116 -0.967 1.00 0.26 H new ATOM 0 HB2 TYR A 119 12.969 -2.686 -0.204 1.00 0.28 H new ATOM 0 HB3 TYR A 119 12.647 -3.163 -1.860 1.00 0.28 H new ATOM 0 HD1 TYR A 119 9.755 -2.597 -2.143 1.00 0.38 H new ATOM 0 HD2 TYR A 119 12.786 -0.354 -0.161 1.00 0.38 H new ATOM 0 HE1 TYR A 119 8.452 -0.540 -2.478 1.00 0.46 H new ATOM 0 HE2 TYR A 119 11.487 1.703 -0.496 1.00 0.47 H new ATOM 0 HH TYR A 119 9.645 2.618 -1.310 1.00 0.60 H new ATOM 1650 N GLU A 120 12.998 -5.724 0.272 1.00 0.28 N ATOM 1651 CA GLU A 120 13.789 -6.945 0.178 1.00 0.34 C ATOM 1652 C GLU A 120 12.875 -8.150 0.103 1.00 0.37 C ATOM 1653 O GLU A 120 13.051 -9.022 -0.734 1.00 0.43 O ATOM 1654 CB GLU A 120 14.706 -7.091 1.391 1.00 0.36 C ATOM 1655 CG GLU A 120 15.848 -8.072 1.181 1.00 0.42 C ATOM 1656 CD GLU A 120 16.563 -8.426 2.472 1.00 0.48 C ATOM 1657 OE1 GLU A 120 16.020 -9.238 3.253 1.00 0.61 O ATOM 1658 OE2 GLU A 120 17.676 -7.908 2.705 1.00 0.58 O ATOM 0 H GLU A 120 13.179 -5.173 1.111 1.00 0.28 H new ATOM 0 HA GLU A 120 14.398 -6.885 -0.724 1.00 0.34 H new ATOM 0 HB2 GLU A 120 15.120 -6.114 1.642 1.00 0.36 H new ATOM 0 HB3 GLU A 120 14.113 -7.415 2.246 1.00 0.36 H new ATOM 0 HG2 GLU A 120 15.460 -8.982 0.724 1.00 0.42 H new ATOM 0 HG3 GLU A 120 16.564 -7.644 0.480 1.00 0.42 H new ATOM 1665 N THR A 121 11.895 -8.188 0.986 1.00 0.36 N ATOM 1666 CA THR A 121 10.945 -9.280 1.017 1.00 0.40 C ATOM 1667 C THR A 121 10.208 -9.392 -0.317 1.00 0.40 C ATOM 1668 O THR A 121 10.048 -10.487 -0.865 1.00 0.45 O ATOM 1669 CB THR A 121 9.939 -9.089 2.158 1.00 0.41 C ATOM 1670 OG1 THR A 121 10.642 -8.934 3.401 1.00 0.43 O ATOM 1671 CG2 THR A 121 8.995 -10.279 2.246 1.00 0.47 C ATOM 0 H THR A 121 11.737 -7.471 1.694 1.00 0.36 H new ATOM 0 HA THR A 121 11.498 -10.203 1.189 1.00 0.40 H new ATOM 0 HB THR A 121 9.350 -8.194 1.957 1.00 0.41 H new ATOM 0 HG1 THR A 121 11.066 -8.051 3.429 1.00 0.43 H new ATOM 0 HG21 THR A 121 8.289 -10.124 3.062 1.00 0.47 H new ATOM 0 HG22 THR A 121 8.449 -10.380 1.308 1.00 0.47 H new ATOM 0 HG23 THR A 121 9.570 -11.186 2.431 1.00 0.47 H new ATOM 1679 N VAL A 122 9.795 -8.248 -0.850 1.00 0.37 N ATOM 1680 CA VAL A 122 9.132 -8.198 -2.145 1.00 0.39 C ATOM 1681 C VAL A 122 10.024 -8.800 -3.233 1.00 0.44 C ATOM 1682 O VAL A 122 9.584 -9.653 -4.008 1.00 0.50 O ATOM 1683 CB VAL A 122 8.762 -6.746 -2.524 1.00 0.38 C ATOM 1684 CG1 VAL A 122 8.151 -6.686 -3.913 1.00 0.43 C ATOM 1685 CG2 VAL A 122 7.804 -6.154 -1.501 1.00 0.36 C ATOM 0 H VAL A 122 9.909 -7.339 -0.402 1.00 0.37 H new ATOM 0 HA VAL A 122 8.216 -8.784 -2.069 1.00 0.39 H new ATOM 0 HB VAL A 122 9.678 -6.156 -2.527 1.00 0.38 H new ATOM 0 HG11 VAL A 122 7.900 -5.654 -4.156 1.00 0.43 H new ATOM 0 HG12 VAL A 122 8.867 -7.066 -4.642 1.00 0.43 H new ATOM 0 HG13 VAL A 122 7.248 -7.295 -3.940 1.00 0.43 H new ATOM 0 HG21 VAL A 122 7.555 -5.131 -1.785 1.00 0.36 H new ATOM 0 HG22 VAL A 122 6.894 -6.753 -1.466 1.00 0.36 H new ATOM 0 HG23 VAL A 122 8.276 -6.153 -0.518 1.00 0.36 H new ATOM 1695 N VAL A 123 11.283 -8.379 -3.260 1.00 0.44 N ATOM 1696 CA VAL A 123 12.217 -8.832 -4.284 1.00 0.51 C ATOM 1697 C VAL A 123 12.699 -10.261 -4.007 1.00 0.57 C ATOM 1698 O VAL A 123 13.253 -10.919 -4.879 1.00 0.67 O ATOM 1699 CB VAL A 123 13.426 -7.871 -4.410 1.00 0.50 C ATOM 1700 CG1 VAL A 123 14.422 -8.067 -3.278 1.00 0.48 C ATOM 1701 CG2 VAL A 123 14.104 -8.023 -5.761 1.00 0.59 C ATOM 0 H VAL A 123 11.680 -7.725 -2.585 1.00 0.44 H new ATOM 0 HA VAL A 123 11.680 -8.831 -5.232 1.00 0.51 H new ATOM 0 HB VAL A 123 13.041 -6.854 -4.334 1.00 0.50 H new ATOM 0 HG11 VAL A 123 15.255 -7.375 -3.402 1.00 0.48 H new ATOM 0 HG12 VAL A 123 13.931 -7.876 -2.324 1.00 0.48 H new ATOM 0 HG13 VAL A 123 14.795 -9.091 -3.295 1.00 0.48 H new ATOM 0 HG21 VAL A 123 14.949 -7.337 -5.823 1.00 0.59 H new ATOM 0 HG22 VAL A 123 14.458 -9.047 -5.877 1.00 0.59 H new ATOM 0 HG23 VAL A 123 13.392 -7.794 -6.553 1.00 0.59 H new ATOM 1711 N LYS A 124 12.481 -10.742 -2.791 1.00 0.55 N ATOM 1712 CA LYS A 124 12.832 -12.113 -2.453 1.00 0.61 C ATOM 1713 C LYS A 124 11.752 -13.078 -2.924 1.00 0.63 C ATOM 1714 O LYS A 124 12.008 -14.268 -3.105 1.00 0.72 O ATOM 1715 CB LYS A 124 13.085 -12.268 -0.950 1.00 0.62 C ATOM 1716 CG LYS A 124 14.410 -11.665 -0.504 1.00 0.67 C ATOM 1717 CD LYS A 124 14.685 -11.873 0.979 1.00 0.75 C ATOM 1718 CE LYS A 124 13.645 -11.190 1.855 1.00 0.67 C ATOM 1719 NZ LYS A 124 14.067 -11.142 3.280 1.00 1.07 N ATOM 0 H LYS A 124 12.066 -10.208 -2.028 1.00 0.55 H new ATOM 0 HA LYS A 124 13.759 -12.358 -2.972 1.00 0.61 H new ATOM 0 HB2 LYS A 124 12.273 -11.793 -0.400 1.00 0.62 H new ATOM 0 HB3 LYS A 124 13.069 -13.327 -0.692 1.00 0.62 H new ATOM 0 HG2 LYS A 124 15.219 -12.108 -1.084 1.00 0.67 H new ATOM 0 HG3 LYS A 124 14.409 -10.597 -0.722 1.00 0.67 H new ATOM 0 HD2 LYS A 124 14.699 -12.941 1.199 1.00 0.75 H new ATOM 0 HD3 LYS A 124 15.674 -11.485 1.222 1.00 0.75 H new ATOM 0 HE2 LYS A 124 13.474 -10.176 1.493 1.00 0.67 H new ATOM 0 HE3 LYS A 124 12.697 -11.722 1.775 1.00 0.67 H new ATOM 0 HZ1 LYS A 124 13.228 -11.198 3.892 1.00 1.07 H new ATOM 0 HZ2 LYS A 124 14.697 -11.944 3.483 1.00 1.07 H new ATOM 0 HZ3 LYS A 124 14.571 -10.251 3.463 1.00 1.07 H new ATOM 1733 N VAL A 125 10.545 -12.564 -3.127 1.00 0.59 N ATOM 1734 CA VAL A 125 9.457 -13.383 -3.650 1.00 0.63 C ATOM 1735 C VAL A 125 9.450 -13.356 -5.180 1.00 0.69 C ATOM 1736 O VAL A 125 9.305 -14.394 -5.831 1.00 0.75 O ATOM 1737 CB VAL A 125 8.087 -12.931 -3.103 1.00 0.60 C ATOM 1738 CG1 VAL A 125 6.970 -13.803 -3.660 1.00 0.66 C ATOM 1739 CG2 VAL A 125 8.086 -12.974 -1.582 1.00 0.59 C ATOM 0 H VAL A 125 10.295 -11.593 -2.940 1.00 0.59 H new ATOM 0 HA VAL A 125 9.629 -14.405 -3.314 1.00 0.63 H new ATOM 0 HB VAL A 125 7.910 -11.904 -3.424 1.00 0.60 H new ATOM 0 HG11 VAL A 125 6.013 -13.467 -3.261 1.00 0.66 H new ATOM 0 HG12 VAL A 125 6.957 -13.727 -4.747 1.00 0.66 H new ATOM 0 HG13 VAL A 125 7.139 -14.840 -3.371 1.00 0.66 H new ATOM 0 HG21 VAL A 125 7.113 -12.653 -1.210 1.00 0.59 H new ATOM 0 HG22 VAL A 125 8.285 -13.992 -1.247 1.00 0.59 H new ATOM 0 HG23 VAL A 125 8.859 -12.308 -1.199 1.00 0.59 H new ATOM 1749 N LYS A 126 9.614 -12.170 -5.758 1.00 0.68 N ATOM 1750 CA LYS A 126 9.764 -12.053 -7.204 1.00 0.76 C ATOM 1751 C LYS A 126 11.000 -11.225 -7.566 1.00 0.75 C ATOM 1752 O LYS A 126 10.918 -10.030 -7.836 1.00 0.73 O ATOM 1753 CB LYS A 126 8.484 -11.526 -7.893 1.00 0.80 C ATOM 1754 CG LYS A 126 7.595 -10.605 -7.058 1.00 0.73 C ATOM 1755 CD LYS A 126 8.119 -9.183 -7.033 1.00 0.71 C ATOM 1756 CE LYS A 126 7.018 -8.165 -6.774 1.00 0.73 C ATOM 1757 NZ LYS A 126 6.241 -7.839 -7.999 1.00 1.12 N ATOM 0 H LYS A 126 9.646 -11.284 -5.253 1.00 0.68 H new ATOM 0 HA LYS A 126 9.919 -13.060 -7.593 1.00 0.76 H new ATOM 0 HB2 LYS A 126 8.777 -10.991 -8.796 1.00 0.80 H new ATOM 0 HB3 LYS A 126 7.888 -12.382 -8.209 1.00 0.80 H new ATOM 0 HG2 LYS A 126 6.583 -10.612 -7.463 1.00 0.73 H new ATOM 0 HG3 LYS A 126 7.533 -10.987 -6.039 1.00 0.73 H new ATOM 0 HD2 LYS A 126 8.882 -9.093 -6.260 1.00 0.71 H new ATOM 0 HD3 LYS A 126 8.601 -8.959 -7.985 1.00 0.71 H new ATOM 0 HE2 LYS A 126 6.342 -8.552 -6.012 1.00 0.73 H new ATOM 0 HE3 LYS A 126 7.459 -7.252 -6.374 1.00 0.73 H new ATOM 0 HZ1 LYS A 126 5.305 -7.476 -7.730 1.00 1.12 H new ATOM 0 HZ2 LYS A 126 6.748 -7.116 -8.549 1.00 1.12 H new ATOM 0 HZ3 LYS A 126 6.127 -8.697 -8.576 1.00 1.12 H new ATOM 1771 N PRO A 127 12.176 -11.876 -7.554 1.00 0.80 N ATOM 1772 CA PRO A 127 13.468 -11.218 -7.801 1.00 0.83 C ATOM 1773 C PRO A 127 13.694 -10.848 -9.264 1.00 0.92 C ATOM 1774 O PRO A 127 14.504 -9.975 -9.571 1.00 0.96 O ATOM 1775 CB PRO A 127 14.485 -12.268 -7.361 1.00 0.87 C ATOM 1776 CG PRO A 127 13.791 -13.569 -7.560 1.00 0.97 C ATOM 1777 CD PRO A 127 12.341 -13.310 -7.261 1.00 0.86 C ATOM 0 HA PRO A 127 13.536 -10.270 -7.267 1.00 0.83 H new ATOM 0 HB2 PRO A 127 15.397 -12.210 -7.955 1.00 0.87 H new ATOM 0 HB3 PRO A 127 14.774 -12.128 -6.319 1.00 0.87 H new ATOM 0 HG2 PRO A 127 13.921 -13.930 -8.580 1.00 0.97 H new ATOM 0 HG3 PRO A 127 14.196 -14.334 -6.897 1.00 0.97 H new ATOM 0 HD2 PRO A 127 11.688 -13.923 -7.882 1.00 0.86 H new ATOM 0 HD3 PRO A 127 12.099 -13.537 -6.223 1.00 0.86 H new ATOM 1785 N HIS A 128 12.988 -11.514 -10.165 1.00 0.99 N ATOM 1786 CA HIS A 128 13.119 -11.222 -11.590 1.00 1.12 C ATOM 1787 C HIS A 128 12.132 -10.135 -11.994 1.00 1.04 C ATOM 1788 O HIS A 128 12.010 -9.787 -13.171 1.00 1.11 O ATOM 1789 CB HIS A 128 12.900 -12.483 -12.435 1.00 1.33 C ATOM 1790 CG HIS A 128 14.045 -13.452 -12.386 1.00 2.00 C ATOM 1791 ND1 HIS A 128 14.073 -14.623 -13.115 1.00 2.75 N ATOM 1792 CD2 HIS A 128 15.212 -13.419 -11.693 1.00 2.49 C ATOM 1793 CE1 HIS A 128 15.202 -15.263 -12.875 1.00 3.56 C ATOM 1794 NE2 HIS A 128 15.909 -14.555 -12.018 1.00 3.37 N ATOM 0 H HIS A 128 12.323 -12.254 -9.941 1.00 0.99 H new ATOM 0 HA HIS A 128 14.133 -10.867 -11.774 1.00 1.12 H new ATOM 0 HB2 HIS A 128 11.996 -12.986 -12.092 1.00 1.33 H new ATOM 0 HB3 HIS A 128 12.729 -12.190 -13.471 1.00 1.33 H new ATOM 0 HD2 HIS A 128 15.532 -12.643 -11.013 1.00 2.49 H new ATOM 0 HE1 HIS A 128 15.497 -16.208 -13.308 1.00 3.56 H new ATOM 0 HE2 HIS A 128 16.827 -14.810 -11.655 1.00 3.37 H new ATOM 1803 N ASP A 129 11.444 -9.598 -11.001 1.00 0.92 N ATOM 1804 CA ASP A 129 10.453 -8.560 -11.218 1.00 0.89 C ATOM 1805 C ASP A 129 11.073 -7.183 -11.039 1.00 0.83 C ATOM 1806 O ASP A 129 11.603 -6.866 -9.974 1.00 0.80 O ATOM 1807 CB ASP A 129 9.293 -8.749 -10.254 1.00 0.89 C ATOM 1808 CG ASP A 129 8.218 -7.714 -10.444 1.00 0.89 C ATOM 1809 OD1 ASP A 129 7.445 -7.827 -11.416 1.00 1.09 O ATOM 1810 OD2 ASP A 129 8.129 -6.794 -9.613 1.00 1.11 O ATOM 0 H ASP A 129 11.557 -9.869 -10.024 1.00 0.92 H new ATOM 0 HA ASP A 129 10.082 -8.635 -12.240 1.00 0.89 H new ATOM 0 HB2 ASP A 129 8.866 -9.742 -10.393 1.00 0.89 H new ATOM 0 HB3 ASP A 129 9.663 -8.701 -9.230 1.00 0.89 H new ATOM 1815 N LYS A 130 11.009 -6.371 -12.089 1.00 0.85 N ATOM 1816 CA LYS A 130 11.638 -5.053 -12.088 1.00 0.89 C ATOM 1817 C LYS A 130 10.995 -4.112 -11.078 1.00 0.84 C ATOM 1818 O LYS A 130 11.636 -3.174 -10.615 1.00 0.84 O ATOM 1819 CB LYS A 130 11.620 -4.429 -13.496 1.00 1.04 C ATOM 1820 CG LYS A 130 10.248 -4.366 -14.167 1.00 1.18 C ATOM 1821 CD LYS A 130 9.375 -3.253 -13.602 1.00 1.44 C ATOM 1822 CE LYS A 130 8.041 -3.160 -14.321 1.00 2.28 C ATOM 1823 NZ LYS A 130 8.198 -2.702 -15.724 1.00 3.05 N ATOM 0 H LYS A 130 10.525 -6.603 -12.956 1.00 0.85 H new ATOM 0 HA LYS A 130 12.675 -5.198 -11.786 1.00 0.89 H new ATOM 0 HB2 LYS A 130 12.021 -3.418 -13.432 1.00 1.04 H new ATOM 0 HB3 LYS A 130 12.293 -4.999 -14.136 1.00 1.04 H new ATOM 0 HG2 LYS A 130 10.377 -4.214 -15.239 1.00 1.18 H new ATOM 0 HG3 LYS A 130 9.740 -5.322 -14.040 1.00 1.18 H new ATOM 0 HD2 LYS A 130 9.204 -3.430 -12.540 1.00 1.44 H new ATOM 0 HD3 LYS A 130 9.900 -2.301 -13.686 1.00 1.44 H new ATOM 0 HE2 LYS A 130 7.554 -4.135 -14.310 1.00 2.28 H new ATOM 0 HE3 LYS A 130 7.387 -2.471 -13.786 1.00 2.28 H new ATOM 0 HZ1 LYS A 130 7.264 -2.473 -16.121 1.00 3.05 H new ATOM 0 HZ2 LYS A 130 8.801 -1.855 -15.747 1.00 3.05 H new ATOM 0 HZ3 LYS A 130 8.639 -3.456 -16.288 1.00 3.05 H new ATOM 1837 N ASP A 131 9.739 -4.362 -10.736 1.00 0.86 N ATOM 1838 CA ASP A 131 9.039 -3.520 -9.774 1.00 0.90 C ATOM 1839 C ASP A 131 9.619 -3.742 -8.389 1.00 0.77 C ATOM 1840 O ASP A 131 9.934 -2.790 -7.670 1.00 0.80 O ATOM 1841 CB ASP A 131 7.540 -3.821 -9.782 1.00 1.05 C ATOM 1842 CG ASP A 131 6.781 -3.019 -8.742 1.00 1.45 C ATOM 1843 OD1 ASP A 131 6.758 -1.773 -8.843 1.00 1.60 O ATOM 1844 OD2 ASP A 131 6.190 -3.635 -7.830 1.00 1.82 O ATOM 0 H ASP A 131 9.186 -5.135 -11.107 1.00 0.86 H new ATOM 0 HA ASP A 131 9.173 -2.475 -10.054 1.00 0.90 H new ATOM 0 HB2 ASP A 131 7.134 -3.604 -10.770 1.00 1.05 H new ATOM 0 HB3 ASP A 131 7.385 -4.885 -9.600 1.00 1.05 H new ATOM 1849 N ALA A 132 9.781 -5.011 -8.040 1.00 0.69 N ATOM 1850 CA ALA A 132 10.447 -5.389 -6.808 1.00 0.62 C ATOM 1851 C ALA A 132 11.880 -4.891 -6.807 1.00 0.59 C ATOM 1852 O ALA A 132 12.325 -4.262 -5.847 1.00 0.56 O ATOM 1853 CB ALA A 132 10.428 -6.894 -6.643 1.00 0.65 C ATOM 0 H ALA A 132 9.456 -5.799 -8.600 1.00 0.69 H new ATOM 0 HA ALA A 132 9.914 -4.932 -5.974 1.00 0.62 H new ATOM 0 HB1 ALA A 132 10.931 -7.165 -5.715 1.00 0.65 H new ATOM 0 HB2 ALA A 132 9.396 -7.244 -6.612 1.00 0.65 H new ATOM 0 HB3 ALA A 132 10.943 -7.359 -7.484 1.00 0.65 H new ATOM 1859 N LYS A 133 12.595 -5.178 -7.897 1.00 0.63 N ATOM 1860 CA LYS A 133 13.979 -4.741 -8.039 1.00 0.66 C ATOM 1861 C LYS A 133 14.102 -3.248 -7.822 1.00 0.65 C ATOM 1862 O LYS A 133 14.762 -2.813 -6.891 1.00 0.63 O ATOM 1863 CB LYS A 133 14.541 -5.069 -9.424 1.00 0.74 C ATOM 1864 CG LYS A 133 14.676 -6.547 -9.716 1.00 0.75 C ATOM 1865 CD LYS A 133 15.443 -6.789 -11.008 1.00 0.95 C ATOM 1866 CE LYS A 133 16.867 -6.248 -10.938 1.00 1.21 C ATOM 1867 NZ LYS A 133 17.690 -6.960 -9.924 1.00 1.93 N ATOM 0 H LYS A 133 12.237 -5.710 -8.690 1.00 0.63 H new ATOM 0 HA LYS A 133 14.549 -5.279 -7.282 1.00 0.66 H new ATOM 0 HB2 LYS A 133 13.895 -4.621 -10.179 1.00 0.74 H new ATOM 0 HB3 LYS A 133 15.521 -4.602 -9.524 1.00 0.74 H new ATOM 0 HG2 LYS A 133 15.189 -7.038 -8.889 1.00 0.75 H new ATOM 0 HG3 LYS A 133 13.686 -6.997 -9.789 1.00 0.75 H new ATOM 0 HD2 LYS A 133 15.472 -7.858 -11.218 1.00 0.95 H new ATOM 0 HD3 LYS A 133 14.916 -6.316 -11.836 1.00 0.95 H new ATOM 0 HE2 LYS A 133 17.338 -6.342 -11.917 1.00 1.21 H new ATOM 0 HE3 LYS A 133 16.839 -5.185 -10.699 1.00 1.21 H new ATOM 0 HZ1 LYS A 133 18.681 -6.654 -10.004 1.00 1.93 H new ATOM 0 HZ2 LYS A 133 17.336 -6.739 -8.972 1.00 1.93 H new ATOM 0 HZ3 LYS A 133 17.630 -7.986 -10.086 1.00 1.93 H new ATOM 1881 N MET A 134 13.433 -2.487 -8.675 1.00 0.68 N ATOM 1882 CA MET A 134 13.603 -1.039 -8.758 1.00 0.72 C ATOM 1883 C MET A 134 13.654 -0.368 -7.390 1.00 0.65 C ATOM 1884 O MET A 134 14.635 0.295 -7.049 1.00 0.68 O ATOM 1885 CB MET A 134 12.467 -0.433 -9.582 1.00 0.78 C ATOM 1886 CG MET A 134 12.566 1.073 -9.743 1.00 0.84 C ATOM 1887 SD MET A 134 11.252 1.747 -10.779 1.00 0.97 S ATOM 1888 CE MET A 134 11.527 0.841 -12.300 1.00 1.61 C ATOM 0 H MET A 134 12.750 -2.858 -9.336 1.00 0.68 H new ATOM 0 HA MET A 134 14.564 -0.859 -9.241 1.00 0.72 H new ATOM 0 HB2 MET A 134 12.459 -0.895 -10.569 1.00 0.78 H new ATOM 0 HB3 MET A 134 11.516 -0.677 -9.108 1.00 0.78 H new ATOM 0 HG2 MET A 134 12.526 1.543 -8.760 1.00 0.84 H new ATOM 0 HG3 MET A 134 13.533 1.325 -10.178 1.00 0.84 H new ATOM 0 HE1 MET A 134 11.102 1.396 -13.136 1.00 1.61 H new ATOM 0 HE2 MET A 134 12.598 0.711 -12.457 1.00 1.61 H new ATOM 0 HE3 MET A 134 11.048 -0.136 -12.233 1.00 1.61 H new ATOM 1898 N LYS A 135 12.607 -0.553 -6.607 1.00 0.59 N ATOM 1899 CA LYS A 135 12.509 0.100 -5.313 1.00 0.54 C ATOM 1900 C LYS A 135 13.432 -0.553 -4.290 1.00 0.48 C ATOM 1901 O LYS A 135 13.887 0.101 -3.353 1.00 0.46 O ATOM 1902 CB LYS A 135 11.065 0.098 -4.830 1.00 0.54 C ATOM 1903 CG LYS A 135 10.315 1.382 -5.154 1.00 0.65 C ATOM 1904 CD LYS A 135 10.280 1.661 -6.648 1.00 0.76 C ATOM 1905 CE LYS A 135 9.421 2.871 -6.966 1.00 1.05 C ATOM 1906 NZ LYS A 135 9.983 4.126 -6.400 1.00 1.94 N ATOM 0 H LYS A 135 11.813 -1.149 -6.843 1.00 0.59 H new ATOM 0 HA LYS A 135 12.833 1.134 -5.428 1.00 0.54 H new ATOM 0 HB2 LYS A 135 10.540 -0.744 -5.282 1.00 0.54 H new ATOM 0 HB3 LYS A 135 11.051 -0.059 -3.752 1.00 0.54 H new ATOM 0 HG2 LYS A 135 9.296 1.312 -4.775 1.00 0.65 H new ATOM 0 HG3 LYS A 135 10.789 2.218 -4.640 1.00 0.65 H new ATOM 0 HD2 LYS A 135 11.294 1.827 -7.012 1.00 0.76 H new ATOM 0 HD3 LYS A 135 9.891 0.789 -7.173 1.00 0.76 H new ATOM 0 HE2 LYS A 135 9.327 2.973 -8.047 1.00 1.05 H new ATOM 0 HE3 LYS A 135 8.417 2.715 -6.572 1.00 1.05 H new ATOM 0 HZ1 LYS A 135 9.312 4.529 -5.715 1.00 1.94 H new ATOM 0 HZ2 LYS A 135 10.883 3.919 -5.922 1.00 1.94 H new ATOM 0 HZ3 LYS A 135 10.147 4.809 -7.167 1.00 1.94 H new ATOM 1920 N TYR A 136 13.718 -1.835 -4.476 1.00 0.48 N ATOM 1921 CA TYR A 136 14.694 -2.514 -3.639 1.00 0.46 C ATOM 1922 C TYR A 136 16.074 -1.904 -3.849 1.00 0.47 C ATOM 1923 O TYR A 136 16.779 -1.628 -2.888 1.00 0.48 O ATOM 1924 CB TYR A 136 14.731 -4.018 -3.931 1.00 0.48 C ATOM 1925 CG TYR A 136 15.915 -4.726 -3.301 1.00 0.48 C ATOM 1926 CD1 TYR A 136 15.964 -4.974 -1.936 1.00 0.48 C ATOM 1927 CD2 TYR A 136 16.989 -5.136 -4.079 1.00 0.54 C ATOM 1928 CE1 TYR A 136 17.053 -5.607 -1.365 1.00 0.51 C ATOM 1929 CE2 TYR A 136 18.077 -5.771 -3.519 1.00 0.57 C ATOM 1930 CZ TYR A 136 18.107 -6.003 -2.162 1.00 0.54 C ATOM 1931 OH TYR A 136 19.197 -6.632 -1.601 1.00 0.59 O ATOM 0 H TYR A 136 13.291 -2.421 -5.194 1.00 0.48 H new ATOM 0 HA TYR A 136 14.396 -2.383 -2.599 1.00 0.46 H new ATOM 0 HB2 TYR A 136 13.810 -4.474 -3.568 1.00 0.48 H new ATOM 0 HB3 TYR A 136 14.758 -4.170 -5.010 1.00 0.48 H new ATOM 0 HD1 TYR A 136 15.139 -4.668 -1.310 1.00 0.48 H new ATOM 0 HD2 TYR A 136 16.972 -4.954 -5.143 1.00 0.54 H new ATOM 0 HE1 TYR A 136 17.078 -5.790 -0.301 1.00 0.51 H new ATOM 0 HE2 TYR A 136 18.902 -6.085 -4.142 1.00 0.57 H new ATOM 0 HH TYR A 136 19.848 -6.845 -2.302 1.00 0.59 H new ATOM 1941 N GLN A 137 16.439 -1.671 -5.106 1.00 0.49 N ATOM 1942 CA GLN A 137 17.741 -1.101 -5.440 1.00 0.51 C ATOM 1943 C GLN A 137 17.793 0.326 -4.935 1.00 0.53 C ATOM 1944 O GLN A 137 18.788 0.765 -4.366 1.00 0.57 O ATOM 1945 CB GLN A 137 17.972 -1.108 -6.956 1.00 0.55 C ATOM 1946 CG GLN A 137 17.452 -2.358 -7.640 1.00 0.61 C ATOM 1947 CD GLN A 137 18.125 -3.627 -7.189 1.00 1.17 C ATOM 1948 OE1 GLN A 137 17.367 -4.704 -7.209 1.00 2.09 O flip ATOM 1949 NE2 GLN A 137 19.300 -3.646 -6.821 1.00 1.24 N flip ATOM 0 H GLN A 137 15.849 -1.869 -5.914 1.00 0.49 H new ATOM 0 HA GLN A 137 18.519 -1.703 -4.971 1.00 0.51 H new ATOM 0 HB2 GLN A 137 17.487 -0.235 -7.394 1.00 0.55 H new ATOM 0 HB3 GLN A 137 19.040 -1.012 -7.154 1.00 0.55 H new ATOM 0 HG2 GLN A 137 16.381 -2.442 -7.456 1.00 0.61 H new ATOM 0 HG3 GLN A 137 17.583 -2.252 -8.717 1.00 0.61 H new ATOM 0 HE21 GLN A 137 19.849 -2.786 -6.822 1.00 1.24 H new ATOM 0 HE22 GLN A 137 19.724 -4.521 -6.515 1.00 1.24 H new ATOM 1958 N GLU A 138 16.691 1.030 -5.146 1.00 0.53 N ATOM 1959 CA GLU A 138 16.530 2.398 -4.689 1.00 0.57 C ATOM 1960 C GLU A 138 16.742 2.501 -3.181 1.00 0.54 C ATOM 1961 O GLU A 138 17.525 3.326 -2.714 1.00 0.60 O ATOM 1962 CB GLU A 138 15.139 2.895 -5.083 1.00 0.60 C ATOM 1963 CG GLU A 138 14.716 4.182 -4.403 1.00 0.69 C ATOM 1964 CD GLU A 138 13.431 4.739 -4.977 1.00 1.33 C ATOM 1965 OE1 GLU A 138 12.350 4.207 -4.648 1.00 2.04 O ATOM 1966 OE2 GLU A 138 13.489 5.722 -5.744 1.00 1.46 O ATOM 0 H GLU A 138 15.879 0.664 -5.643 1.00 0.53 H new ATOM 0 HA GLU A 138 17.284 3.026 -5.163 1.00 0.57 H new ATOM 0 HB2 GLU A 138 15.112 3.043 -6.163 1.00 0.60 H new ATOM 0 HB3 GLU A 138 14.410 2.119 -4.850 1.00 0.60 H new ATOM 0 HG2 GLU A 138 14.586 4.001 -3.336 1.00 0.69 H new ATOM 0 HG3 GLU A 138 15.509 4.923 -4.507 1.00 0.69 H new ATOM 1973 N CYS A 139 16.061 1.656 -2.423 1.00 0.47 N ATOM 1974 CA CYS A 139 16.206 1.659 -0.976 1.00 0.44 C ATOM 1975 C CYS A 139 17.595 1.160 -0.590 1.00 0.43 C ATOM 1976 O CYS A 139 18.254 1.736 0.276 1.00 0.42 O ATOM 1977 CB CYS A 139 15.138 0.777 -0.332 1.00 0.42 C ATOM 1978 SG CYS A 139 14.775 1.200 1.383 1.00 1.06 S ATOM 0 H CYS A 139 15.406 0.963 -2.783 1.00 0.47 H new ATOM 0 HA CYS A 139 16.080 2.680 -0.615 1.00 0.44 H new ATOM 0 HB2 CYS A 139 14.220 0.850 -0.916 1.00 0.42 H new ATOM 0 HB3 CYS A 139 15.463 -0.262 -0.378 1.00 0.42 H new ATOM 0 HG CYS A 139 15.849 1.060 2.101 1.00 1.06 H new ATOM 1984 N ASN A 140 18.034 0.098 -1.260 1.00 0.45 N ATOM 1985 CA ASN A 140 19.334 -0.513 -1.003 1.00 0.48 C ATOM 1986 C ASN A 140 20.447 0.514 -1.129 1.00 0.52 C ATOM 1987 O ASN A 140 21.229 0.711 -0.198 1.00 0.54 O ATOM 1988 CB ASN A 140 19.580 -1.671 -1.979 1.00 0.52 C ATOM 1989 CG ASN A 140 20.946 -2.308 -1.807 1.00 0.60 C ATOM 1990 OD1 ASN A 140 21.910 -1.913 -2.460 1.00 1.22 O ATOM 1991 ND2 ASN A 140 21.038 -3.296 -0.932 1.00 1.13 N ATOM 0 H ASN A 140 17.499 -0.363 -1.996 1.00 0.45 H new ATOM 0 HA ASN A 140 19.332 -0.900 0.016 1.00 0.48 H new ATOM 0 HB2 ASN A 140 18.810 -2.430 -1.836 1.00 0.52 H new ATOM 0 HB3 ASN A 140 19.481 -1.305 -3.001 1.00 0.52 H new ATOM 0 HD21 ASN A 140 21.933 -3.760 -0.779 1.00 1.13 H new ATOM 0 HD22 ASN A 140 20.214 -3.594 -0.410 1.00 1.13 H new ATOM 1998 N LYS A 141 20.497 1.184 -2.272 1.00 0.56 N ATOM 1999 CA LYS A 141 21.538 2.165 -2.529 1.00 0.63 C ATOM 2000 C LYS A 141 21.473 3.303 -1.523 1.00 0.60 C ATOM 2001 O LYS A 141 22.506 3.801 -1.093 1.00 0.65 O ATOM 2002 CB LYS A 141 21.438 2.725 -3.949 1.00 0.70 C ATOM 2003 CG LYS A 141 20.171 3.511 -4.210 1.00 0.69 C ATOM 2004 CD LYS A 141 20.270 4.288 -5.500 1.00 0.81 C ATOM 2005 CE LYS A 141 18.986 5.043 -5.789 1.00 0.85 C ATOM 2006 NZ LYS A 141 18.956 5.556 -7.179 1.00 1.15 N ATOM 0 H LYS A 141 19.829 1.065 -3.034 1.00 0.56 H new ATOM 0 HA LYS A 141 22.495 1.654 -2.425 1.00 0.63 H new ATOM 0 HB2 LYS A 141 22.298 3.368 -4.137 1.00 0.70 H new ATOM 0 HB3 LYS A 141 21.495 1.900 -4.659 1.00 0.70 H new ATOM 0 HG2 LYS A 141 19.320 2.831 -4.256 1.00 0.69 H new ATOM 0 HG3 LYS A 141 19.987 4.196 -3.382 1.00 0.69 H new ATOM 0 HD2 LYS A 141 21.102 4.990 -5.441 1.00 0.81 H new ATOM 0 HD3 LYS A 141 20.486 3.606 -6.322 1.00 0.81 H new ATOM 0 HE2 LYS A 141 18.132 4.386 -5.625 1.00 0.85 H new ATOM 0 HE3 LYS A 141 18.887 5.875 -5.091 1.00 0.85 H new ATOM 0 HZ1 LYS A 141 18.065 6.066 -7.341 1.00 1.15 H new ATOM 0 HZ2 LYS A 141 19.757 6.202 -7.328 1.00 1.15 H new ATOM 0 HZ3 LYS A 141 19.025 4.760 -7.844 1.00 1.15 H new ATOM 2020 N ILE A 142 20.263 3.703 -1.136 1.00 0.54 N ATOM 2021 CA ILE A 142 20.098 4.807 -0.202 1.00 0.52 C ATOM 2022 C ILE A 142 20.609 4.437 1.183 1.00 0.49 C ATOM 2023 O ILE A 142 21.168 5.275 1.894 1.00 0.51 O ATOM 2024 CB ILE A 142 18.643 5.304 -0.141 1.00 0.50 C ATOM 2025 CG1 ILE A 142 18.310 6.036 -1.442 1.00 0.58 C ATOM 2026 CG2 ILE A 142 18.446 6.222 1.056 1.00 0.49 C ATOM 2027 CD1 ILE A 142 16.936 6.670 -1.460 1.00 0.60 C ATOM 0 H ILE A 142 19.391 3.281 -1.454 1.00 0.54 H new ATOM 0 HA ILE A 142 20.702 5.633 -0.577 1.00 0.52 H new ATOM 0 HB ILE A 142 17.972 4.453 -0.025 1.00 0.50 H new ATOM 0 HG12 ILE A 142 19.058 6.810 -1.612 1.00 0.58 H new ATOM 0 HG13 ILE A 142 18.385 5.333 -2.271 1.00 0.58 H new ATOM 0 HG21 ILE A 142 17.412 6.565 1.085 1.00 0.49 H new ATOM 0 HG22 ILE A 142 18.674 5.678 1.973 1.00 0.49 H new ATOM 0 HG23 ILE A 142 19.111 7.081 0.969 1.00 0.49 H new ATOM 0 HD11 ILE A 142 16.778 7.169 -2.416 1.00 0.60 H new ATOM 0 HD12 ILE A 142 16.178 5.899 -1.323 1.00 0.60 H new ATOM 0 HD13 ILE A 142 16.861 7.400 -0.654 1.00 0.60 H new ATOM 2039 N VAL A 143 20.455 3.179 1.549 1.00 0.46 N ATOM 2040 CA VAL A 143 21.051 2.683 2.776 1.00 0.47 C ATOM 2041 C VAL A 143 22.570 2.849 2.719 1.00 0.56 C ATOM 2042 O VAL A 143 23.212 3.193 3.714 1.00 0.59 O ATOM 2043 CB VAL A 143 20.697 1.200 3.018 1.00 0.47 C ATOM 2044 CG1 VAL A 143 21.460 0.655 4.210 1.00 0.55 C ATOM 2045 CG2 VAL A 143 19.199 1.037 3.223 1.00 0.41 C ATOM 0 H VAL A 143 19.927 2.486 1.019 1.00 0.46 H new ATOM 0 HA VAL A 143 20.648 3.265 3.604 1.00 0.47 H new ATOM 0 HB VAL A 143 20.989 0.630 2.136 1.00 0.47 H new ATOM 0 HG11 VAL A 143 21.196 -0.391 4.363 1.00 0.55 H new ATOM 0 HG12 VAL A 143 22.531 0.736 4.024 1.00 0.55 H new ATOM 0 HG13 VAL A 143 21.202 1.228 5.100 1.00 0.55 H new ATOM 0 HG21 VAL A 143 18.967 -0.015 3.392 1.00 0.41 H new ATOM 0 HG22 VAL A 143 18.884 1.622 4.087 1.00 0.41 H new ATOM 0 HG23 VAL A 143 18.670 1.387 2.336 1.00 0.41 H new ATOM 2055 N LYS A 144 23.132 2.639 1.534 1.00 0.63 N ATOM 2056 CA LYS A 144 24.575 2.749 1.337 1.00 0.74 C ATOM 2057 C LYS A 144 25.002 4.204 1.202 1.00 0.76 C ATOM 2058 O LYS A 144 26.166 4.537 1.430 1.00 0.85 O ATOM 2059 CB LYS A 144 25.007 1.966 0.099 1.00 0.84 C ATOM 2060 CG LYS A 144 24.257 0.662 -0.064 1.00 0.83 C ATOM 2061 CD LYS A 144 24.871 -0.229 -1.133 1.00 1.10 C ATOM 2062 CE LYS A 144 24.797 0.405 -2.509 1.00 1.57 C ATOM 2063 NZ LYS A 144 25.481 -0.425 -3.534 1.00 2.23 N ATOM 0 H LYS A 144 22.610 2.391 0.693 1.00 0.63 H new ATOM 0 HA LYS A 144 25.063 2.326 2.215 1.00 0.74 H new ATOM 0 HB2 LYS A 144 24.852 2.582 -0.787 1.00 0.84 H new ATOM 0 HB3 LYS A 144 26.076 1.760 0.160 1.00 0.84 H new ATOM 0 HG2 LYS A 144 24.247 0.130 0.887 1.00 0.83 H new ATOM 0 HG3 LYS A 144 23.219 0.872 -0.322 1.00 0.83 H new ATOM 0 HD2 LYS A 144 25.912 -0.432 -0.882 1.00 1.10 H new ATOM 0 HD3 LYS A 144 24.354 -1.188 -1.147 1.00 1.10 H new ATOM 0 HE2 LYS A 144 23.753 0.543 -2.790 1.00 1.57 H new ATOM 0 HE3 LYS A 144 25.253 1.395 -2.479 1.00 1.57 H new ATOM 0 HZ1 LYS A 144 25.410 0.040 -4.461 1.00 2.23 H new ATOM 0 HZ2 LYS A 144 26.483 -0.536 -3.279 1.00 2.23 H new ATOM 0 HZ3 LYS A 144 25.030 -1.361 -3.580 1.00 2.23 H new ATOM 2077 N GLN A 145 24.072 5.067 0.803 1.00 0.70 N ATOM 2078 CA GLN A 145 24.330 6.501 0.809 1.00 0.74 C ATOM 2079 C GLN A 145 24.681 6.921 2.219 1.00 0.75 C ATOM 2080 O GLN A 145 25.630 7.667 2.463 1.00 0.84 O ATOM 2081 CB GLN A 145 23.104 7.284 0.355 1.00 0.71 C ATOM 2082 CG GLN A 145 22.490 6.744 -0.908 1.00 0.72 C ATOM 2083 CD GLN A 145 23.339 6.979 -2.134 1.00 0.94 C ATOM 2084 OE1 GLN A 145 24.098 7.946 -2.210 1.00 1.36 O ATOM 2085 NE2 GLN A 145 23.211 6.095 -3.105 1.00 1.27 N ATOM 0 H GLN A 145 23.143 4.801 0.475 1.00 0.70 H new ATOM 0 HA GLN A 145 25.149 6.711 0.121 1.00 0.74 H new ATOM 0 HB2 GLN A 145 22.357 7.270 1.149 1.00 0.71 H new ATOM 0 HB3 GLN A 145 23.384 8.326 0.199 1.00 0.71 H new ATOM 0 HG2 GLN A 145 22.320 5.674 -0.792 1.00 0.72 H new ATOM 0 HG3 GLN A 145 21.514 7.207 -1.056 1.00 0.72 H new ATOM 0 HE21 GLN A 145 22.570 5.309 -2.998 1.00 1.27 H new ATOM 0 HE22 GLN A 145 23.753 6.197 -3.963 1.00 1.27 H new ATOM 2094 N LYS A 146 23.892 6.395 3.137 1.00 0.67 N ATOM 2095 CA LYS A 146 24.028 6.678 4.547 1.00 0.70 C ATOM 2096 C LYS A 146 25.262 6.002 5.127 1.00 0.84 C ATOM 2097 O LYS A 146 26.127 6.658 5.710 1.00 0.94 O ATOM 2098 CB LYS A 146 22.781 6.192 5.279 1.00 0.58 C ATOM 2099 CG LYS A 146 21.526 6.966 4.915 1.00 0.58 C ATOM 2100 CD LYS A 146 20.293 6.385 5.586 1.00 0.64 C ATOM 2101 CE LYS A 146 20.370 6.479 7.102 1.00 1.40 C ATOM 2102 NZ LYS A 146 20.495 7.883 7.573 1.00 1.73 N ATOM 0 H LYS A 146 23.131 5.752 2.918 1.00 0.67 H new ATOM 0 HA LYS A 146 24.141 7.754 4.676 1.00 0.70 H new ATOM 0 HB2 LYS A 146 22.626 5.137 5.055 1.00 0.58 H new ATOM 0 HB3 LYS A 146 22.947 6.268 6.354 1.00 0.58 H new ATOM 0 HG2 LYS A 146 21.643 8.009 5.210 1.00 0.58 H new ATOM 0 HG3 LYS A 146 21.392 6.954 3.833 1.00 0.58 H new ATOM 0 HD2 LYS A 146 19.407 6.913 5.235 1.00 0.64 H new ATOM 0 HD3 LYS A 146 20.179 5.341 5.293 1.00 0.64 H new ATOM 0 HE2 LYS A 146 19.478 6.030 7.538 1.00 1.40 H new ATOM 0 HE3 LYS A 146 21.223 5.901 7.457 1.00 1.40 H new ATOM 0 HZ1 LYS A 146 20.341 7.919 8.601 1.00 1.73 H new ATOM 0 HZ2 LYS A 146 21.447 8.240 7.353 1.00 1.73 H new ATOM 0 HZ3 LYS A 146 19.785 8.474 7.095 1.00 1.73 H new