USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 742 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 100 ASN : amide:sc= -6.56! C(o=-8.1!,f=-13!) USER MOD Set 1.2: A 144 HIS :FLIP no HD1:sc= -1.57 F(o=-8.8,f=-8.1) USER MOD Set 2.1: A 116 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 120 SER OG : rot 142:sc= 0.149 USER MOD Set 3.1: A 108 LYS NZ :NH3+ 169:sc= 0.676 (180deg=-0.255) USER MOD Set 3.2: A 109 SER OG : rot 180:sc= 0.66 USER MOD Set 4.1: A 95 LYS NZ :NH3+ 132:sc= 1.87 (180deg=1.75) USER MOD Set 4.2: A 175 SER OG : rot 180:sc= 0.375 USER MOD Single : A 92 SER OG : rot 28:sc= 0.768 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 1.1 K(o=1.1,f=-1.2) USER MOD Single : A 112 ASN : amide:sc= 0.501 K(o=0.5,f=-6.8!) USER MOD Single : A 113 LYS NZ :NH3+ -165:sc=-0.00647 (180deg=-0.124) USER MOD Single : A 118 THR OG1 : rot 80:sc= 0.0919 USER MOD Single : A 124 ASN : amide:sc= 1.06 K(o=1.1,f=-1.4) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 129:sc= -4.38! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 CYS SG : rot 44:sc= 0.694 USER MOD Single : A 135 ASN : amide:sc= 1.27 K(o=1.3,f=-0.072) USER MOD Single : A 137 SER OG : rot 180:sc= 0.00789 USER MOD Single : A 138 LYS NZ :NH3+ 154:sc= 0.204 (180deg=0.0781) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 GLN : amide:sc= 0.136 K(o=0.14,f=-3.5!) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 MET CE :methyl -178:sc= -1.55 (180deg=-1.59) USER MOD Single : A 159 ASN : amide:sc= -1.82! C(o=-1.8!,f=-5.7!) USER MOD Single : A 161 MET CE :methyl -138:sc= -0.135 (180deg=-1.34) USER MOD Single : A 164 ASN : amide:sc= 0.125 K(o=0.13,f=-1.8!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 88 11.207 -9.660 -8.360 1.00 14.85 N ATOM 2 CA GLY A 88 10.875 -8.458 -7.560 1.00 14.52 C ATOM 3 C GLY A 88 11.628 -7.235 -8.038 1.00 14.06 C ATOM 4 O GLY A 88 12.859 -7.208 -8.003 1.00 14.34 O ATOM 0 HA2 GLY A 88 9.803 -8.269 -7.617 1.00 14.52 H new ATOM 0 HA3 GLY A 88 11.111 -8.643 -6.512 1.00 14.52 H new ATOM 10 N ALA A 89 10.894 -6.221 -8.486 1.00 13.50 N ATOM 11 CA ALA A 89 11.504 -4.998 -8.997 1.00 13.18 C ATOM 12 C ALA A 89 12.200 -4.228 -7.882 1.00 12.18 C ATOM 13 O ALA A 89 13.309 -3.727 -8.060 1.00 12.38 O ATOM 14 CB ALA A 89 10.459 -4.126 -9.672 1.00 13.38 C ATOM 0 H ALA A 89 9.874 -6.222 -8.505 1.00 13.50 H new ATOM 0 HA ALA A 89 12.255 -5.277 -9.736 1.00 13.18 H new ATOM 0 HB1 ALA A 89 10.930 -3.218 -10.048 1.00 13.38 H new ATOM 0 HB2 ALA A 89 10.011 -4.672 -10.502 1.00 13.38 H new ATOM 0 HB3 ALA A 89 9.685 -3.862 -8.951 1.00 13.38 H new ATOM 20 N ASP A 90 11.546 -4.148 -6.731 1.00 11.25 N ATOM 21 CA ASP A 90 12.128 -3.480 -5.570 1.00 10.32 C ATOM 22 C ASP A 90 12.183 -4.435 -4.381 1.00 10.04 C ATOM 23 O ASP A 90 11.296 -4.425 -3.523 1.00 9.96 O ATOM 24 CB ASP A 90 11.336 -2.225 -5.171 1.00 9.53 C ATOM 25 CG ASP A 90 11.381 -1.108 -6.201 1.00 9.74 C ATOM 26 OD1 ASP A 90 10.746 -1.242 -7.267 1.00 9.92 O ATOM 27 OD2 ASP A 90 12.022 -0.069 -5.919 1.00 9.91 O ATOM 0 H ASP A 90 10.615 -4.535 -6.574 1.00 11.25 H new ATOM 0 HA ASP A 90 13.136 -3.174 -5.850 1.00 10.32 H new ATOM 0 HB2 ASP A 90 10.296 -2.504 -4.999 1.00 9.53 H new ATOM 0 HB3 ASP A 90 11.726 -1.848 -4.225 1.00 9.53 H new ATOM 32 N PRO A 91 13.203 -5.301 -4.333 1.00 10.16 N ATOM 33 CA PRO A 91 13.413 -6.226 -3.234 1.00 10.16 C ATOM 34 C PRO A 91 14.368 -5.642 -2.185 1.00 9.18 C ATOM 35 O PRO A 91 15.585 -5.759 -2.340 1.00 9.15 O ATOM 36 CB PRO A 91 14.056 -7.430 -3.932 1.00 10.77 C ATOM 37 CG PRO A 91 14.684 -6.898 -5.190 1.00 11.14 C ATOM 38 CD PRO A 91 14.247 -5.459 -5.352 1.00 10.63 C ATOM 0 HA PRO A 91 12.496 -6.463 -2.694 1.00 10.16 H new ATOM 0 HB2 PRO A 91 14.803 -7.898 -3.291 1.00 10.77 H new ATOM 0 HB3 PRO A 91 13.310 -8.191 -4.161 1.00 10.77 H new ATOM 0 HG2 PRO A 91 15.770 -6.963 -5.132 1.00 11.14 H new ATOM 0 HG3 PRO A 91 14.375 -7.490 -6.051 1.00 11.14 H new ATOM 0 HD2 PRO A 91 15.074 -4.768 -5.190 1.00 10.63 H new ATOM 0 HD3 PRO A 91 13.863 -5.267 -6.354 1.00 10.63 H new ATOM 46 N SER A 92 13.827 -5.001 -1.129 1.00 8.61 N ATOM 47 CA SER A 92 14.657 -4.265 -0.152 1.00 7.83 C ATOM 48 C SER A 92 15.664 -3.383 -0.885 1.00 6.91 C ATOM 49 O SER A 92 16.864 -3.401 -0.604 1.00 6.95 O ATOM 50 CB SER A 92 15.359 -5.225 0.828 1.00 8.48 C ATOM 51 OG SER A 92 16.000 -6.304 0.163 1.00 9.30 O ATOM 0 H SER A 92 12.827 -4.978 -0.931 1.00 8.61 H new ATOM 0 HA SER A 92 14.005 -3.626 0.443 1.00 7.83 H new ATOM 0 HB2 SER A 92 16.096 -4.671 1.410 1.00 8.48 H new ATOM 0 HB3 SER A 92 14.627 -5.619 1.533 1.00 8.48 H new ATOM 0 HG SER A 92 16.257 -6.025 -0.741 1.00 9.30 H new ATOM 57 N LEU A 93 15.145 -2.610 -1.832 1.00 6.42 N ATOM 58 CA LEU A 93 15.973 -1.833 -2.737 1.00 5.85 C ATOM 59 C LEU A 93 15.585 -0.348 -2.703 1.00 4.94 C ATOM 60 O LEU A 93 14.428 -0.009 -2.968 1.00 5.05 O ATOM 61 CB LEU A 93 15.804 -2.381 -4.158 1.00 6.31 C ATOM 62 CG LEU A 93 16.527 -1.600 -5.257 1.00 7.36 C ATOM 63 CD1 LEU A 93 18.036 -1.665 -5.053 1.00 7.82 C ATOM 64 CD2 LEU A 93 16.151 -2.151 -6.635 1.00 7.89 C ATOM 0 H LEU A 93 14.143 -2.507 -1.991 1.00 6.42 H new ATOM 0 HA LEU A 93 17.013 -1.916 -2.423 1.00 5.85 H new ATOM 0 HB2 LEU A 93 16.159 -3.411 -4.176 1.00 6.31 H new ATOM 0 HB3 LEU A 93 14.740 -2.406 -4.395 1.00 6.31 H new ATOM 0 HG LEU A 93 16.216 -0.557 -5.202 1.00 7.36 H new ATOM 0 HD11 LEU A 93 18.535 -1.104 -5.844 1.00 7.82 H new ATOM 0 HD12 LEU A 93 18.291 -1.233 -4.085 1.00 7.82 H new ATOM 0 HD13 LEU A 93 18.363 -2.704 -5.084 1.00 7.82 H new ATOM 0 HD21 LEU A 93 16.673 -1.586 -7.407 1.00 7.89 H new ATOM 0 HD22 LEU A 93 16.437 -3.201 -6.698 1.00 7.89 H new ATOM 0 HD23 LEU A 93 15.075 -2.059 -6.782 1.00 7.89 H new ATOM 76 N ARG A 94 16.551 0.523 -2.364 1.00 4.45 N ATOM 77 CA ARG A 94 16.372 1.979 -2.420 1.00 3.96 C ATOM 78 C ARG A 94 15.369 2.475 -1.380 1.00 3.05 C ATOM 79 O ARG A 94 14.808 3.564 -1.526 1.00 3.26 O ATOM 80 CB ARG A 94 15.911 2.415 -3.814 1.00 4.35 C ATOM 81 CG ARG A 94 16.809 1.941 -4.944 1.00 5.15 C ATOM 82 CD ARG A 94 16.249 2.347 -6.295 1.00 5.75 C ATOM 83 NE ARG A 94 14.865 1.904 -6.473 1.00 6.33 N ATOM 84 CZ ARG A 94 13.939 2.614 -7.117 1.00 7.04 C ATOM 85 NH1 ARG A 94 14.265 3.765 -7.692 1.00 7.28 N ATOM 86 NH2 ARG A 94 12.693 2.161 -7.204 1.00 7.78 N ATOM 0 H ARG A 94 17.476 0.235 -2.044 1.00 4.45 H new ATOM 0 HA ARG A 94 17.342 2.423 -2.198 1.00 3.96 H new ATOM 0 HB2 ARG A 94 14.902 2.039 -3.985 1.00 4.35 H new ATOM 0 HB3 ARG A 94 15.855 3.503 -3.842 1.00 4.35 H new ATOM 0 HG2 ARG A 94 17.807 2.361 -4.820 1.00 5.15 H new ATOM 0 HG3 ARG A 94 16.912 0.857 -4.901 1.00 5.15 H new ATOM 0 HD2 ARG A 94 16.298 3.431 -6.396 1.00 5.75 H new ATOM 0 HD3 ARG A 94 16.869 1.925 -7.086 1.00 5.75 H new ATOM 0 HE ARG A 94 14.594 1.002 -6.082 1.00 6.33 H new ATOM 0 HH11 ARG A 94 15.225 4.107 -7.641 1.00 7.28 H new ATOM 0 HH12 ARG A 94 13.556 4.308 -8.185 1.00 7.28 H new ATOM 0 HH21 ARG A 94 12.444 1.269 -6.778 1.00 7.78 H new ATOM 0 HH22 ARG A 94 11.986 2.706 -7.697 1.00 7.78 H new ATOM 100 N LYS A 95 15.145 1.695 -0.328 1.00 2.37 N ATOM 101 CA LYS A 95 14.151 2.061 0.674 1.00 1.60 C ATOM 102 C LYS A 95 14.686 1.823 2.089 1.00 1.26 C ATOM 103 O LYS A 95 15.752 1.230 2.268 1.00 1.52 O ATOM 104 CB LYS A 95 12.858 1.267 0.452 1.00 1.56 C ATOM 105 CG LYS A 95 12.413 1.256 -1.000 1.00 1.15 C ATOM 106 CD LYS A 95 11.112 0.505 -1.207 1.00 1.36 C ATOM 107 CE LYS A 95 10.976 0.055 -2.655 1.00 1.24 C ATOM 108 NZ LYS A 95 11.219 1.165 -3.617 1.00 1.91 N ATOM 0 H LYS A 95 15.631 0.817 -0.148 1.00 2.37 H new ATOM 0 HA LYS A 95 13.935 3.124 0.568 1.00 1.60 H new ATOM 0 HB2 LYS A 95 13.005 0.241 0.789 1.00 1.56 H new ATOM 0 HB3 LYS A 95 12.065 1.694 1.066 1.00 1.56 H new ATOM 0 HG2 LYS A 95 12.295 2.282 -1.347 1.00 1.15 H new ATOM 0 HG3 LYS A 95 13.192 0.800 -1.611 1.00 1.15 H new ATOM 0 HD2 LYS A 95 11.077 -0.362 -0.547 1.00 1.36 H new ATOM 0 HD3 LYS A 95 10.271 1.144 -0.939 1.00 1.36 H new ATOM 0 HE2 LYS A 95 11.682 -0.753 -2.850 1.00 1.24 H new ATOM 0 HE3 LYS A 95 9.977 -0.349 -2.815 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 11.877 0.846 -4.356 1.00 1.91 H new ATOM 0 HZ2 LYS A 95 10.319 1.449 -4.054 1.00 1.91 H new ATOM 0 HZ3 LYS A 95 11.631 1.977 -3.114 1.00 1.91 H new ATOM 122 N SER A 96 13.943 2.270 3.092 1.00 1.02 N ATOM 123 CA SER A 96 14.369 2.139 4.473 1.00 0.93 C ATOM 124 C SER A 96 13.341 1.334 5.258 1.00 0.89 C ATOM 125 O SER A 96 13.682 0.597 6.182 1.00 1.75 O ATOM 126 CB SER A 96 14.551 3.527 5.094 1.00 1.13 C ATOM 127 OG SER A 96 15.194 3.456 6.356 1.00 1.79 O ATOM 0 H SER A 96 13.039 2.728 2.971 1.00 1.02 H new ATOM 0 HA SER A 96 15.323 1.613 4.508 1.00 0.93 H new ATOM 0 HB2 SER A 96 15.138 4.153 4.421 1.00 1.13 H new ATOM 0 HB3 SER A 96 13.578 4.005 5.207 1.00 1.13 H new ATOM 0 HG SER A 96 15.295 4.359 6.723 1.00 1.79 H new ATOM 133 N GLY A 97 12.081 1.473 4.867 1.00 0.44 N ATOM 134 CA GLY A 97 11.007 0.777 5.543 1.00 0.29 C ATOM 135 C GLY A 97 11.077 -0.735 5.364 1.00 0.27 C ATOM 136 O GLY A 97 10.963 -1.479 6.335 1.00 0.36 O ATOM 0 H GLY A 97 11.784 2.060 4.088 1.00 0.44 H new ATOM 0 HA2 GLY A 97 11.039 1.014 6.606 1.00 0.29 H new ATOM 0 HA3 GLY A 97 10.051 1.139 5.165 1.00 0.29 H new ATOM 140 N VAL A 98 11.280 -1.165 4.114 1.00 0.29 N ATOM 141 CA VAL A 98 11.254 -2.582 3.707 1.00 0.33 C ATOM 142 C VAL A 98 9.872 -3.204 3.906 1.00 0.25 C ATOM 143 O VAL A 98 9.219 -3.015 4.933 1.00 0.27 O ATOM 144 CB VAL A 98 12.345 -3.453 4.370 1.00 0.49 C ATOM 145 CG1 VAL A 98 11.792 -4.252 5.525 1.00 0.47 C ATOM 146 CG2 VAL A 98 12.948 -4.379 3.332 1.00 0.71 C ATOM 0 H VAL A 98 11.471 -0.529 3.339 1.00 0.29 H new ATOM 0 HA VAL A 98 11.484 -2.570 2.642 1.00 0.33 H new ATOM 0 HB VAL A 98 13.116 -2.794 4.768 1.00 0.49 H new ATOM 0 HG11 VAL A 98 12.588 -4.852 5.966 1.00 0.47 H new ATOM 0 HG12 VAL A 98 11.390 -3.573 6.277 1.00 0.47 H new ATOM 0 HG13 VAL A 98 10.999 -4.908 5.167 1.00 0.47 H new ATOM 0 HG21 VAL A 98 13.718 -4.995 3.797 1.00 0.71 H new ATOM 0 HG22 VAL A 98 12.169 -5.021 2.921 1.00 0.71 H new ATOM 0 HG23 VAL A 98 13.391 -3.788 2.531 1.00 0.71 H new ATOM 156 N GLY A 99 9.415 -3.934 2.899 1.00 0.21 N ATOM 157 CA GLY A 99 8.070 -4.467 2.936 1.00 0.20 C ATOM 158 C GLY A 99 7.041 -3.375 2.720 1.00 0.15 C ATOM 159 O GLY A 99 5.889 -3.495 3.125 1.00 0.18 O ATOM 0 H GLY A 99 9.949 -4.166 2.061 1.00 0.21 H new ATOM 0 HA2 GLY A 99 7.958 -5.233 2.168 1.00 0.20 H new ATOM 0 HA3 GLY A 99 7.894 -4.951 3.897 1.00 0.20 H new ATOM 163 N ASN A 100 7.478 -2.295 2.093 1.00 0.13 N ATOM 164 CA ASN A 100 6.637 -1.125 1.871 1.00 0.14 C ATOM 165 C ASN A 100 6.034 -1.202 0.479 1.00 0.14 C ATOM 166 O ASN A 100 6.750 -1.403 -0.507 1.00 0.19 O ATOM 167 CB ASN A 100 7.475 0.152 2.007 1.00 0.21 C ATOM 168 CG ASN A 100 8.397 0.142 3.205 1.00 0.28 C ATOM 169 OD1 ASN A 100 9.408 0.834 3.205 1.00 0.63 O ATOM 170 ND2 ASN A 100 8.078 -0.659 4.219 1.00 0.20 N ATOM 0 H ASN A 100 8.424 -2.202 1.723 1.00 0.13 H new ATOM 0 HA ASN A 100 5.839 -1.103 2.613 1.00 0.14 H new ATOM 0 HB2 ASN A 100 8.068 0.286 1.103 1.00 0.21 H new ATOM 0 HB3 ASN A 100 6.807 1.010 2.080 1.00 0.21 H new ATOM 0 HD21 ASN A 100 8.685 -0.713 5.037 1.00 0.20 H new ATOM 0 HD22 ASN A 100 7.226 -1.219 4.178 1.00 0.20 H new ATOM 177 N ILE A 101 4.725 -1.054 0.403 1.00 0.12 N ATOM 178 CA ILE A 101 4.018 -1.086 -0.868 1.00 0.13 C ATOM 179 C ILE A 101 3.040 0.074 -0.944 1.00 0.12 C ATOM 180 O ILE A 101 2.699 0.668 0.081 1.00 0.15 O ATOM 181 CB ILE A 101 3.248 -2.411 -1.067 1.00 0.13 C ATOM 182 CG1 ILE A 101 2.205 -2.597 0.038 1.00 0.11 C ATOM 183 CG2 ILE A 101 4.212 -3.587 -1.105 1.00 0.15 C ATOM 184 CD1 ILE A 101 1.446 -3.903 -0.046 1.00 0.13 C ATOM 0 H ILE A 101 4.123 -0.909 1.213 1.00 0.12 H new ATOM 0 HA ILE A 101 4.764 -1.004 -1.658 1.00 0.13 H new ATOM 0 HB ILE A 101 2.726 -2.368 -2.023 1.00 0.13 H new ATOM 0 HG12 ILE A 101 2.702 -2.539 1.006 1.00 0.11 H new ATOM 0 HG13 ILE A 101 1.494 -1.772 -0.005 1.00 0.11 H new ATOM 0 HG21 ILE A 101 3.652 -4.512 -1.246 1.00 0.15 H new ATOM 0 HG22 ILE A 101 4.912 -3.457 -1.930 1.00 0.15 H new ATOM 0 HG23 ILE A 101 4.763 -3.636 -0.166 1.00 0.15 H new ATOM 0 HD11 ILE A 101 0.727 -3.959 0.771 1.00 0.13 H new ATOM 0 HD12 ILE A 101 0.918 -3.957 -0.998 1.00 0.13 H new ATOM 0 HD13 ILE A 101 2.145 -4.736 0.029 1.00 0.13 H new ATOM 196 N PHE A 102 2.589 0.395 -2.144 1.00 0.11 N ATOM 197 CA PHE A 102 1.614 1.455 -2.312 1.00 0.11 C ATOM 198 C PHE A 102 0.403 0.930 -3.071 1.00 0.09 C ATOM 199 O PHE A 102 0.526 0.070 -3.948 1.00 0.11 O ATOM 200 CB PHE A 102 2.245 2.676 -3.007 1.00 0.16 C ATOM 201 CG PHE A 102 1.866 2.870 -4.450 1.00 0.13 C ATOM 202 CD1 PHE A 102 0.739 3.597 -4.796 1.00 0.14 C ATOM 203 CD2 PHE A 102 2.634 2.307 -5.457 1.00 0.17 C ATOM 204 CE1 PHE A 102 0.389 3.763 -6.121 1.00 0.17 C ATOM 205 CE2 PHE A 102 2.290 2.468 -6.782 1.00 0.21 C ATOM 206 CZ PHE A 102 1.168 3.256 -7.109 1.00 0.20 C ATOM 0 H PHE A 102 2.880 -0.060 -3.009 1.00 0.11 H new ATOM 0 HA PHE A 102 1.277 1.788 -1.331 1.00 0.11 H new ATOM 0 HB2 PHE A 102 1.965 3.572 -2.453 1.00 0.16 H new ATOM 0 HB3 PHE A 102 3.330 2.588 -2.943 1.00 0.16 H new ATOM 0 HD1 PHE A 102 0.128 4.038 -4.022 1.00 0.14 H new ATOM 0 HD2 PHE A 102 3.513 1.735 -5.200 1.00 0.17 H new ATOM 0 HE1 PHE A 102 -0.513 4.301 -6.373 1.00 0.17 H new ATOM 0 HE2 PHE A 102 2.873 1.996 -7.560 1.00 0.21 H new ATOM 0 HZ PHE A 102 0.929 3.456 -8.143 1.00 0.20 H new ATOM 216 N ILE A 103 -0.763 1.432 -2.703 1.00 0.08 N ATOM 217 CA ILE A 103 -2.019 0.994 -3.283 1.00 0.08 C ATOM 218 C ILE A 103 -2.724 2.167 -3.949 1.00 0.08 C ATOM 219 O ILE A 103 -2.790 3.254 -3.382 1.00 0.15 O ATOM 220 CB ILE A 103 -2.942 0.400 -2.203 1.00 0.08 C ATOM 221 CG1 ILE A 103 -2.229 -0.714 -1.442 1.00 0.08 C ATOM 222 CG2 ILE A 103 -4.225 -0.129 -2.824 1.00 0.10 C ATOM 223 CD1 ILE A 103 -2.510 -0.695 0.037 1.00 0.09 C ATOM 0 H ILE A 103 -0.865 2.156 -1.992 1.00 0.08 H new ATOM 0 HA ILE A 103 -1.799 0.226 -4.025 1.00 0.08 H new ATOM 0 HB ILE A 103 -3.198 1.194 -1.502 1.00 0.08 H new ATOM 0 HG12 ILE A 103 -2.534 -1.677 -1.851 1.00 0.08 H new ATOM 0 HG13 ILE A 103 -1.155 -0.625 -1.602 1.00 0.08 H new ATOM 0 HG21 ILE A 103 -4.863 -0.544 -2.044 1.00 0.10 H new ATOM 0 HG22 ILE A 103 -4.749 0.685 -3.326 1.00 0.10 H new ATOM 0 HG23 ILE A 103 -3.985 -0.907 -3.548 1.00 0.10 H new ATOM 0 HD11 ILE A 103 -1.974 -1.512 0.520 1.00 0.09 H new ATOM 0 HD12 ILE A 103 -2.180 0.255 0.458 1.00 0.09 H new ATOM 0 HD13 ILE A 103 -3.580 -0.814 0.206 1.00 0.09 H new ATOM 235 N LYS A 104 -3.245 1.947 -5.144 1.00 0.13 N ATOM 236 CA LYS A 104 -3.922 2.999 -5.886 1.00 0.13 C ATOM 237 C LYS A 104 -5.391 2.649 -6.096 1.00 0.12 C ATOM 238 O LYS A 104 -5.744 1.469 -6.133 1.00 0.14 O ATOM 239 CB LYS A 104 -3.249 3.185 -7.245 1.00 0.19 C ATOM 240 CG LYS A 104 -3.234 4.627 -7.733 1.00 0.28 C ATOM 241 CD LYS A 104 -2.461 4.786 -9.039 1.00 0.39 C ATOM 242 CE LYS A 104 -3.262 4.313 -10.244 1.00 0.66 C ATOM 243 NZ LYS A 104 -2.525 4.518 -11.515 1.00 1.46 N ATOM 0 H LYS A 104 -3.212 1.047 -5.623 1.00 0.13 H new ATOM 0 HA LYS A 104 -3.858 3.923 -5.311 1.00 0.13 H new ATOM 0 HB2 LYS A 104 -2.223 2.821 -7.184 1.00 0.19 H new ATOM 0 HB3 LYS A 104 -3.763 2.568 -7.982 1.00 0.19 H new ATOM 0 HG2 LYS A 104 -4.258 4.971 -7.875 1.00 0.28 H new ATOM 0 HG3 LYS A 104 -2.787 5.263 -6.969 1.00 0.28 H new ATOM 0 HD2 LYS A 104 -2.190 5.833 -9.174 1.00 0.39 H new ATOM 0 HD3 LYS A 104 -1.531 4.221 -8.979 1.00 0.39 H new ATOM 0 HE2 LYS A 104 -3.500 3.255 -10.129 1.00 0.66 H new ATOM 0 HE3 LYS A 104 -4.210 4.850 -10.283 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 -3.105 4.183 -12.311 1.00 1.46 H new ATOM 0 HZ2 LYS A 104 -2.320 5.530 -11.638 1.00 1.46 H new ATOM 0 HZ3 LYS A 104 -1.632 3.985 -11.489 1.00 1.46 H new ATOM 257 N ASN A 105 -6.227 3.681 -6.223 1.00 0.12 N ATOM 258 CA ASN A 105 -7.643 3.533 -6.583 1.00 0.13 C ATOM 259 C ASN A 105 -8.461 2.930 -5.437 1.00 0.15 C ATOM 260 O ASN A 105 -9.346 2.103 -5.656 1.00 0.25 O ATOM 261 CB ASN A 105 -7.794 2.675 -7.844 1.00 0.16 C ATOM 262 CG ASN A 105 -9.134 2.887 -8.531 1.00 0.23 C ATOM 263 OD1 ASN A 105 -9.684 3.991 -8.535 1.00 0.49 O ATOM 264 ND2 ASN A 105 -9.675 1.826 -9.100 1.00 0.34 N ATOM 0 H ASN A 105 -5.941 4.650 -6.079 1.00 0.12 H new ATOM 0 HA ASN A 105 -8.031 4.532 -6.783 1.00 0.13 H new ATOM 0 HB2 ASN A 105 -6.990 2.913 -8.540 1.00 0.16 H new ATOM 0 HB3 ASN A 105 -7.686 1.623 -7.580 1.00 0.16 H new ATOM 0 HD21 ASN A 105 -10.580 1.902 -9.565 1.00 0.34 H new ATOM 0 HD22 ASN A 105 -9.188 0.930 -9.075 1.00 0.34 H new ATOM 271 N LEU A 106 -8.176 3.364 -4.217 1.00 0.14 N ATOM 272 CA LEU A 106 -8.913 2.896 -3.048 1.00 0.17 C ATOM 273 C LEU A 106 -10.265 3.582 -2.922 1.00 0.22 C ATOM 274 O LEU A 106 -10.492 4.664 -3.475 1.00 0.26 O ATOM 275 CB LEU A 106 -8.098 3.120 -1.775 1.00 0.16 C ATOM 276 CG LEU A 106 -6.985 2.100 -1.550 1.00 0.14 C ATOM 277 CD1 LEU A 106 -5.931 2.653 -0.618 1.00 0.15 C ATOM 278 CD2 LEU A 106 -7.561 0.821 -0.972 1.00 0.16 C ATOM 0 H LEU A 106 -7.440 4.039 -4.010 1.00 0.14 H new ATOM 0 HA LEU A 106 -9.087 1.828 -3.181 1.00 0.17 H new ATOM 0 HB2 LEU A 106 -7.659 4.117 -1.810 1.00 0.16 H new ATOM 0 HB3 LEU A 106 -8.772 3.099 -0.919 1.00 0.16 H new ATOM 0 HG LEU A 106 -6.519 1.884 -2.512 1.00 0.14 H new ATOM 0 HD11 LEU A 106 -5.148 1.909 -0.472 1.00 0.15 H new ATOM 0 HD12 LEU A 106 -5.499 3.555 -1.052 1.00 0.15 H new ATOM 0 HD13 LEU A 106 -6.385 2.895 0.343 1.00 0.15 H new ATOM 0 HD21 LEU A 106 -6.759 0.099 -0.815 1.00 0.16 H new ATOM 0 HD22 LEU A 106 -8.046 1.038 -0.020 1.00 0.16 H new ATOM 0 HD23 LEU A 106 -8.292 0.406 -1.665 1.00 0.16 H new ATOM 290 N ASP A 107 -11.161 2.938 -2.194 1.00 0.27 N ATOM 291 CA ASP A 107 -12.491 3.470 -1.960 1.00 0.32 C ATOM 292 C ASP A 107 -12.478 4.488 -0.826 1.00 0.30 C ATOM 293 O ASP A 107 -11.654 4.405 0.085 1.00 0.26 O ATOM 294 CB ASP A 107 -13.461 2.331 -1.646 1.00 0.37 C ATOM 295 CG ASP A 107 -14.835 2.829 -1.255 1.00 0.50 C ATOM 296 OD1 ASP A 107 -15.572 3.303 -2.144 1.00 0.62 O ATOM 297 OD2 ASP A 107 -15.190 2.730 -0.068 1.00 0.71 O ATOM 0 H ASP A 107 -10.988 2.036 -1.751 1.00 0.27 H new ATOM 0 HA ASP A 107 -12.824 3.979 -2.864 1.00 0.32 H new ATOM 0 HB2 ASP A 107 -13.548 1.682 -2.517 1.00 0.37 H new ATOM 0 HB3 ASP A 107 -13.054 1.725 -0.837 1.00 0.37 H new ATOM 302 N LYS A 108 -13.397 5.441 -0.901 1.00 0.38 N ATOM 303 CA LYS A 108 -13.496 6.525 0.076 1.00 0.43 C ATOM 304 C LYS A 108 -13.639 6.000 1.508 1.00 0.36 C ATOM 305 O LYS A 108 -13.096 6.583 2.447 1.00 0.46 O ATOM 306 CB LYS A 108 -14.692 7.428 -0.255 1.00 0.55 C ATOM 307 CG LYS A 108 -16.044 6.740 -0.103 1.00 0.57 C ATOM 308 CD LYS A 108 -17.195 7.710 -0.285 1.00 0.90 C ATOM 309 CE LYS A 108 -18.539 7.024 -0.071 1.00 1.21 C ATOM 310 NZ LYS A 108 -18.691 6.527 1.322 1.00 2.20 N ATOM 0 H LYS A 108 -14.098 5.487 -1.641 1.00 0.38 H new ATOM 0 HA LYS A 108 -12.569 7.096 0.017 1.00 0.43 H new ATOM 0 HB2 LYS A 108 -14.665 8.303 0.394 1.00 0.55 H new ATOM 0 HB3 LYS A 108 -14.591 7.788 -1.279 1.00 0.55 H new ATOM 0 HG2 LYS A 108 -16.127 5.937 -0.835 1.00 0.57 H new ATOM 0 HG3 LYS A 108 -16.109 6.281 0.883 1.00 0.57 H new ATOM 0 HD2 LYS A 108 -17.091 8.537 0.418 1.00 0.90 H new ATOM 0 HD3 LYS A 108 -17.158 8.137 -1.287 1.00 0.90 H new ATOM 0 HE2 LYS A 108 -19.344 7.723 -0.297 1.00 1.21 H new ATOM 0 HE3 LYS A 108 -18.636 6.191 -0.767 1.00 1.21 H new ATOM 0 HZ1 LYS A 108 -19.677 6.237 1.481 1.00 2.20 H new ATOM 0 HZ2 LYS A 108 -18.062 5.712 1.470 1.00 2.20 H new ATOM 0 HZ3 LYS A 108 -18.441 7.284 1.990 1.00 2.20 H new ATOM 324 N SER A 109 -14.369 4.904 1.674 1.00 0.31 N ATOM 325 CA SER A 109 -14.663 4.378 2.999 1.00 0.40 C ATOM 326 C SER A 109 -13.531 3.495 3.526 1.00 0.34 C ATOM 327 O SER A 109 -13.587 3.017 4.662 1.00 0.43 O ATOM 328 CB SER A 109 -15.981 3.606 2.972 1.00 0.56 C ATOM 329 OG SER A 109 -17.024 4.402 2.427 1.00 1.41 O ATOM 0 H SER A 109 -14.768 4.363 0.907 1.00 0.31 H new ATOM 0 HA SER A 109 -14.756 5.222 3.682 1.00 0.40 H new ATOM 0 HB2 SER A 109 -15.863 2.699 2.380 1.00 0.56 H new ATOM 0 HB3 SER A 109 -16.246 3.295 3.983 1.00 0.56 H new ATOM 0 HG SER A 109 -17.858 3.887 2.418 1.00 1.41 H new ATOM 335 N ILE A 110 -12.508 3.267 2.706 1.00 0.23 N ATOM 336 CA ILE A 110 -11.352 2.499 3.144 1.00 0.20 C ATOM 337 C ILE A 110 -10.523 3.313 4.131 1.00 0.20 C ATOM 338 O ILE A 110 -10.009 4.381 3.800 1.00 0.26 O ATOM 339 CB ILE A 110 -10.468 2.049 1.955 1.00 0.20 C ATOM 340 CG1 ILE A 110 -11.197 0.994 1.119 1.00 0.21 C ATOM 341 CG2 ILE A 110 -9.132 1.502 2.443 1.00 0.22 C ATOM 342 CD1 ILE A 110 -11.483 -0.288 1.873 1.00 0.23 C ATOM 0 H ILE A 110 -12.458 3.601 1.743 1.00 0.23 H new ATOM 0 HA ILE A 110 -11.725 1.600 3.635 1.00 0.20 H new ATOM 0 HB ILE A 110 -10.272 2.921 1.331 1.00 0.20 H new ATOM 0 HG12 ILE A 110 -12.138 1.413 0.762 1.00 0.21 H new ATOM 0 HG13 ILE A 110 -10.597 0.762 0.239 1.00 0.21 H new ATOM 0 HG21 ILE A 110 -8.531 1.193 1.588 1.00 0.22 H new ATOM 0 HG22 ILE A 110 -8.603 2.277 2.998 1.00 0.22 H new ATOM 0 HG23 ILE A 110 -9.306 0.644 3.093 1.00 0.22 H new ATOM 0 HD11 ILE A 110 -12.001 -0.988 1.217 1.00 0.23 H new ATOM 0 HD12 ILE A 110 -10.545 -0.730 2.207 1.00 0.23 H new ATOM 0 HD13 ILE A 110 -12.110 -0.069 2.738 1.00 0.23 H new ATOM 354 N ASP A 111 -10.427 2.811 5.351 1.00 0.17 N ATOM 355 CA ASP A 111 -9.644 3.459 6.392 1.00 0.18 C ATOM 356 C ASP A 111 -8.359 2.667 6.605 1.00 0.14 C ATOM 357 O ASP A 111 -8.087 1.722 5.861 1.00 0.13 O ATOM 358 CB ASP A 111 -10.460 3.539 7.689 1.00 0.23 C ATOM 359 CG ASP A 111 -9.846 4.470 8.719 1.00 1.01 C ATOM 360 OD1 ASP A 111 -10.076 5.692 8.629 1.00 1.23 O ATOM 361 OD2 ASP A 111 -9.119 3.982 9.615 1.00 1.59 O ATOM 0 H ASP A 111 -10.886 1.949 5.647 1.00 0.17 H new ATOM 0 HA ASP A 111 -9.391 4.476 6.092 1.00 0.18 H new ATOM 0 HB2 ASP A 111 -11.469 3.878 7.456 1.00 0.23 H new ATOM 0 HB3 ASP A 111 -10.550 2.541 8.117 1.00 0.23 H new ATOM 366 N ASN A 112 -7.592 3.007 7.631 1.00 0.15 N ATOM 367 CA ASN A 112 -6.311 2.358 7.860 1.00 0.13 C ATOM 368 C ASN A 112 -6.571 0.956 8.351 1.00 0.11 C ATOM 369 O ASN A 112 -5.845 0.020 8.043 1.00 0.12 O ATOM 370 CB ASN A 112 -5.482 3.129 8.890 1.00 0.16 C ATOM 371 CG ASN A 112 -5.112 4.524 8.419 1.00 0.19 C ATOM 372 OD1 ASN A 112 -4.967 4.770 7.225 1.00 0.60 O ATOM 373 ND2 ASN A 112 -4.953 5.450 9.351 1.00 0.55 N ATOM 0 H ASN A 112 -7.833 3.725 8.314 1.00 0.15 H new ATOM 0 HA ASN A 112 -5.745 2.335 6.929 1.00 0.13 H new ATOM 0 HB2 ASN A 112 -6.044 3.202 9.821 1.00 0.16 H new ATOM 0 HB3 ASN A 112 -4.572 2.571 9.109 1.00 0.16 H new ATOM 0 HD21 ASN A 112 -4.702 6.403 9.086 1.00 0.55 H new ATOM 0 HD22 ASN A 112 -5.081 5.211 10.334 1.00 0.55 H new ATOM 380 N LYS A 113 -7.663 0.836 9.079 1.00 0.12 N ATOM 381 CA LYS A 113 -8.111 -0.409 9.631 1.00 0.12 C ATOM 382 C LYS A 113 -8.565 -1.315 8.528 1.00 0.11 C ATOM 383 O LYS A 113 -8.269 -2.493 8.504 1.00 0.11 O ATOM 384 CB LYS A 113 -9.301 -0.087 10.482 1.00 0.15 C ATOM 385 CG LYS A 113 -9.592 -1.013 11.659 1.00 0.28 C ATOM 386 CD LYS A 113 -8.337 -1.568 12.335 1.00 0.54 C ATOM 387 CE LYS A 113 -7.774 -2.767 11.588 1.00 1.63 C ATOM 388 NZ LYS A 113 -8.622 -3.977 11.760 1.00 2.58 N ATOM 0 H LYS A 113 -8.271 1.624 9.303 1.00 0.12 H new ATOM 0 HA LYS A 113 -7.314 -0.895 10.193 1.00 0.12 H new ATOM 0 HB2 LYS A 113 -9.174 0.923 10.871 1.00 0.15 H new ATOM 0 HB3 LYS A 113 -10.181 -0.072 9.839 1.00 0.15 H new ATOM 0 HG2 LYS A 113 -10.182 -0.471 12.398 1.00 0.28 H new ATOM 0 HG3 LYS A 113 -10.204 -1.845 11.311 1.00 0.28 H new ATOM 0 HD2 LYS A 113 -7.579 -0.787 12.391 1.00 0.54 H new ATOM 0 HD3 LYS A 113 -8.574 -1.857 13.359 1.00 0.54 H new ATOM 0 HE2 LYS A 113 -7.693 -2.528 10.528 1.00 1.63 H new ATOM 0 HE3 LYS A 113 -6.766 -2.977 11.946 1.00 1.63 H new ATOM 0 HZ1 LYS A 113 -8.090 -4.819 11.460 1.00 2.58 H new ATOM 0 HZ2 LYS A 113 -8.889 -4.074 12.760 1.00 2.58 H new ATOM 0 HZ3 LYS A 113 -9.480 -3.885 11.180 1.00 2.58 H new ATOM 402 N ALA A 114 -9.320 -0.723 7.640 1.00 0.11 N ATOM 403 CA ALA A 114 -9.889 -1.425 6.502 1.00 0.12 C ATOM 404 C ALA A 114 -8.789 -1.976 5.610 1.00 0.11 C ATOM 405 O ALA A 114 -8.842 -3.123 5.164 1.00 0.13 O ATOM 406 CB ALA A 114 -10.784 -0.484 5.716 1.00 0.15 C ATOM 0 H ALA A 114 -9.564 0.267 7.680 1.00 0.11 H new ATOM 0 HA ALA A 114 -10.484 -2.263 6.866 1.00 0.12 H new ATOM 0 HB1 ALA A 114 -11.209 -1.014 4.863 1.00 0.15 H new ATOM 0 HB2 ALA A 114 -11.588 -0.126 6.358 1.00 0.15 H new ATOM 0 HB3 ALA A 114 -10.198 0.364 5.361 1.00 0.15 H new ATOM 412 N LEU A 115 -7.792 -1.145 5.370 1.00 0.09 N ATOM 413 CA LEU A 115 -6.630 -1.535 4.592 1.00 0.09 C ATOM 414 C LEU A 115 -5.831 -2.586 5.365 1.00 0.08 C ATOM 415 O LEU A 115 -5.464 -3.630 4.823 1.00 0.09 O ATOM 416 CB LEU A 115 -5.792 -0.275 4.327 1.00 0.10 C ATOM 417 CG LEU A 115 -4.816 -0.333 3.153 1.00 0.11 C ATOM 418 CD1 LEU A 115 -4.180 1.027 2.933 1.00 0.16 C ATOM 419 CD2 LEU A 115 -3.748 -1.373 3.394 1.00 0.11 C ATOM 0 H LEU A 115 -7.764 -0.183 5.708 1.00 0.09 H new ATOM 0 HA LEU A 115 -6.923 -1.976 3.639 1.00 0.09 H new ATOM 0 HB2 LEU A 115 -6.474 0.559 4.161 1.00 0.10 H new ATOM 0 HB3 LEU A 115 -5.225 -0.048 5.230 1.00 0.10 H new ATOM 0 HG LEU A 115 -5.373 -0.613 2.259 1.00 0.11 H new ATOM 0 HD11 LEU A 115 -3.486 0.973 2.094 1.00 0.16 H new ATOM 0 HD12 LEU A 115 -4.956 1.761 2.716 1.00 0.16 H new ATOM 0 HD13 LEU A 115 -3.640 1.326 3.831 1.00 0.16 H new ATOM 0 HD21 LEU A 115 -3.065 -1.396 2.545 1.00 0.11 H new ATOM 0 HD22 LEU A 115 -3.194 -1.123 4.299 1.00 0.11 H new ATOM 0 HD23 LEU A 115 -4.213 -2.352 3.512 1.00 0.11 H new ATOM 431 N TYR A 116 -5.600 -2.314 6.642 1.00 0.08 N ATOM 432 CA TYR A 116 -4.902 -3.245 7.514 1.00 0.09 C ATOM 433 C TYR A 116 -5.629 -4.578 7.588 1.00 0.10 C ATOM 434 O TYR A 116 -5.010 -5.629 7.469 1.00 0.11 O ATOM 435 CB TYR A 116 -4.752 -2.657 8.922 1.00 0.10 C ATOM 436 CG TYR A 116 -4.155 -3.621 9.919 1.00 0.13 C ATOM 437 CD1 TYR A 116 -2.782 -3.812 9.999 1.00 0.19 C ATOM 438 CD2 TYR A 116 -4.965 -4.320 10.796 1.00 0.18 C ATOM 439 CE1 TYR A 116 -2.237 -4.676 10.927 1.00 0.24 C ATOM 440 CE2 TYR A 116 -4.429 -5.188 11.725 1.00 0.23 C ATOM 441 CZ TYR A 116 -3.051 -5.427 11.715 1.00 0.23 C ATOM 442 OH TYR A 116 -2.532 -6.229 12.713 1.00 0.30 O ATOM 0 H TYR A 116 -5.889 -1.449 7.099 1.00 0.08 H new ATOM 0 HA TYR A 116 -3.912 -3.414 7.091 1.00 0.09 H new ATOM 0 HB2 TYR A 116 -4.125 -1.767 8.870 1.00 0.10 H new ATOM 0 HB3 TYR A 116 -5.731 -2.337 9.279 1.00 0.10 H new ATOM 0 HD1 TYR A 116 -2.130 -3.276 9.325 1.00 0.19 H new ATOM 0 HD2 TYR A 116 -6.036 -4.184 10.753 1.00 0.18 H new ATOM 0 HE1 TYR A 116 -1.165 -4.755 11.027 1.00 0.24 H new ATOM 0 HE2 TYR A 116 -5.064 -5.676 12.449 1.00 0.23 H new ATOM 0 HH TYR A 116 -3.263 -6.691 13.174 1.00 0.30 H new ATOM 452 N ASP A 117 -6.946 -4.527 7.754 1.00 0.10 N ATOM 453 CA ASP A 117 -7.745 -5.736 7.931 1.00 0.12 C ATOM 454 C ASP A 117 -7.550 -6.691 6.762 1.00 0.12 C ATOM 455 O ASP A 117 -7.431 -7.901 6.949 1.00 0.15 O ATOM 456 CB ASP A 117 -9.227 -5.372 8.046 1.00 0.16 C ATOM 457 CG ASP A 117 -10.085 -6.544 8.473 1.00 0.27 C ATOM 458 OD1 ASP A 117 -10.258 -6.738 9.694 1.00 0.36 O ATOM 459 OD2 ASP A 117 -10.608 -7.264 7.597 1.00 0.40 O ATOM 0 H ASP A 117 -7.484 -3.661 7.770 1.00 0.10 H new ATOM 0 HA ASP A 117 -7.416 -6.229 8.846 1.00 0.12 H new ATOM 0 HB2 ASP A 117 -9.343 -4.561 8.765 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -9.581 -4.999 7.085 1.00 0.16 H new ATOM 464 N THR A 118 -7.498 -6.142 5.562 1.00 0.11 N ATOM 465 CA THR A 118 -7.334 -6.950 4.372 1.00 0.11 C ATOM 466 C THR A 118 -5.880 -7.415 4.183 1.00 0.10 C ATOM 467 O THR A 118 -5.612 -8.610 4.054 1.00 0.12 O ATOM 468 CB THR A 118 -7.793 -6.162 3.132 1.00 0.13 C ATOM 469 OG1 THR A 118 -9.147 -5.724 3.313 1.00 0.22 O ATOM 470 CG2 THR A 118 -7.702 -7.019 1.885 1.00 0.17 C ATOM 0 H THR A 118 -7.567 -5.139 5.388 1.00 0.11 H new ATOM 0 HA THR A 118 -7.952 -7.839 4.495 1.00 0.11 H new ATOM 0 HB THR A 118 -7.138 -5.299 3.010 1.00 0.13 H new ATOM 0 HG1 THR A 118 -9.159 -4.922 3.876 1.00 0.22 H new ATOM 0 HG21 THR A 118 -8.031 -6.441 1.022 1.00 0.17 H new ATOM 0 HG22 THR A 118 -6.670 -7.337 1.737 1.00 0.17 H new ATOM 0 HG23 THR A 118 -8.339 -7.896 1.999 1.00 0.17 H new ATOM 478 N PHE A 119 -4.947 -6.467 4.189 1.00 0.08 N ATOM 479 CA PHE A 119 -3.546 -6.759 3.876 1.00 0.08 C ATOM 480 C PHE A 119 -2.845 -7.551 4.987 1.00 0.08 C ATOM 481 O PHE A 119 -1.911 -8.301 4.714 1.00 0.09 O ATOM 482 CB PHE A 119 -2.778 -5.479 3.530 1.00 0.08 C ATOM 483 CG PHE A 119 -3.200 -4.863 2.215 1.00 0.08 C ATOM 484 CD1 PHE A 119 -4.477 -4.334 2.039 1.00 0.10 C ATOM 485 CD2 PHE A 119 -2.321 -4.825 1.146 1.00 0.08 C ATOM 486 CE1 PHE A 119 -4.853 -3.785 0.831 1.00 0.11 C ATOM 487 CE2 PHE A 119 -2.695 -4.278 -0.062 1.00 0.10 C ATOM 488 CZ PHE A 119 -3.991 -3.702 -0.187 1.00 0.09 C ATOM 0 H PHE A 119 -5.133 -5.488 4.407 1.00 0.08 H new ATOM 0 HA PHE A 119 -3.548 -7.400 2.995 1.00 0.08 H new ATOM 0 HB2 PHE A 119 -2.923 -4.750 4.327 1.00 0.08 H new ATOM 0 HB3 PHE A 119 -1.712 -5.703 3.493 1.00 0.08 H new ATOM 0 HD1 PHE A 119 -5.181 -4.354 2.858 1.00 0.10 H new ATOM 0 HD2 PHE A 119 -1.327 -5.230 1.261 1.00 0.08 H new ATOM 0 HE1 PHE A 119 -5.860 -3.416 0.706 1.00 0.11 H new ATOM 0 HE2 PHE A 119 -2.015 -4.286 -0.901 1.00 0.10 H new ATOM 0 HZ PHE A 119 -4.276 -3.200 -1.100 1.00 0.09 H new ATOM 498 N SER A 120 -3.290 -7.384 6.232 1.00 0.09 N ATOM 499 CA SER A 120 -2.666 -8.059 7.374 1.00 0.09 C ATOM 500 C SER A 120 -2.681 -9.576 7.191 1.00 0.08 C ATOM 501 O SER A 120 -1.820 -10.280 7.720 1.00 0.09 O ATOM 502 CB SER A 120 -3.340 -7.667 8.700 1.00 0.13 C ATOM 503 OG SER A 120 -2.707 -8.294 9.805 1.00 0.19 O ATOM 0 H SER A 120 -4.080 -6.787 6.477 1.00 0.09 H new ATOM 0 HA SER A 120 -1.628 -7.729 7.418 1.00 0.09 H new ATOM 0 HB2 SER A 120 -3.303 -6.585 8.823 1.00 0.13 H new ATOM 0 HB3 SER A 120 -4.393 -7.949 8.673 1.00 0.13 H new ATOM 0 HG SER A 120 -2.674 -7.670 10.560 1.00 0.19 H new ATOM 509 N ALA A 121 -3.669 -10.080 6.458 1.00 0.09 N ATOM 510 CA ALA A 121 -3.767 -11.509 6.168 1.00 0.11 C ATOM 511 C ALA A 121 -2.502 -12.039 5.480 1.00 0.11 C ATOM 512 O ALA A 121 -2.211 -13.234 5.537 1.00 0.13 O ATOM 513 CB ALA A 121 -4.984 -11.782 5.297 1.00 0.14 C ATOM 0 H ALA A 121 -4.417 -9.518 6.052 1.00 0.09 H new ATOM 0 HA ALA A 121 -3.873 -12.032 7.118 1.00 0.11 H new ATOM 0 HB1 ALA A 121 -5.049 -12.849 5.086 1.00 0.14 H new ATOM 0 HB2 ALA A 121 -5.885 -11.460 5.819 1.00 0.14 H new ATOM 0 HB3 ALA A 121 -4.892 -11.232 4.360 1.00 0.14 H new ATOM 519 N PHE A 122 -1.752 -11.146 4.841 1.00 0.08 N ATOM 520 CA PHE A 122 -0.543 -11.530 4.116 1.00 0.09 C ATOM 521 C PHE A 122 0.687 -11.432 5.012 1.00 0.10 C ATOM 522 O PHE A 122 1.747 -11.977 4.697 1.00 0.18 O ATOM 523 CB PHE A 122 -0.373 -10.641 2.884 1.00 0.09 C ATOM 524 CG PHE A 122 -1.607 -10.589 2.039 1.00 0.09 C ATOM 525 CD1 PHE A 122 -2.105 -11.736 1.446 1.00 0.13 C ATOM 526 CD2 PHE A 122 -2.252 -9.387 1.813 1.00 0.10 C ATOM 527 CE1 PHE A 122 -3.226 -11.686 0.643 1.00 0.16 C ATOM 528 CE2 PHE A 122 -3.375 -9.329 1.014 1.00 0.12 C ATOM 529 CZ PHE A 122 -3.926 -10.506 0.518 1.00 0.13 C ATOM 0 H PHE A 122 -1.960 -10.148 4.810 1.00 0.08 H new ATOM 0 HA PHE A 122 -0.646 -12.568 3.799 1.00 0.09 H new ATOM 0 HB2 PHE A 122 -0.112 -9.632 3.202 1.00 0.09 H new ATOM 0 HB3 PHE A 122 0.458 -11.012 2.285 1.00 0.09 H new ATOM 0 HD1 PHE A 122 -1.610 -12.681 1.614 1.00 0.13 H new ATOM 0 HD2 PHE A 122 -1.872 -8.484 2.267 1.00 0.10 H new ATOM 0 HE1 PHE A 122 -3.554 -12.569 0.114 1.00 0.16 H new ATOM 0 HE2 PHE A 122 -3.823 -8.376 0.775 1.00 0.12 H new ATOM 0 HZ PHE A 122 -4.894 -10.495 0.039 1.00 0.13 H new ATOM 539 N GLY A 123 0.537 -10.741 6.131 1.00 0.09 N ATOM 540 CA GLY A 123 1.631 -10.577 7.063 1.00 0.10 C ATOM 541 C GLY A 123 1.370 -9.447 8.031 1.00 0.09 C ATOM 542 O GLY A 123 0.448 -8.654 7.829 1.00 0.11 O ATOM 0 H GLY A 123 -0.332 -10.287 6.412 1.00 0.09 H new ATOM 0 HA2 GLY A 123 1.781 -11.504 7.616 1.00 0.10 H new ATOM 0 HA3 GLY A 123 2.552 -10.381 6.514 1.00 0.10 H new ATOM 546 N ASN A 124 2.162 -9.375 9.087 1.00 0.13 N ATOM 547 CA ASN A 124 2.008 -8.316 10.072 1.00 0.14 C ATOM 548 C ASN A 124 2.376 -6.973 9.461 1.00 0.11 C ATOM 549 O ASN A 124 3.338 -6.864 8.700 1.00 0.14 O ATOM 550 CB ASN A 124 2.869 -8.581 11.311 1.00 0.18 C ATOM 551 CG ASN A 124 2.642 -7.547 12.401 1.00 0.21 C ATOM 552 OD1 ASN A 124 1.547 -6.998 12.532 1.00 0.24 O ATOM 553 ND2 ASN A 124 3.668 -7.273 13.187 1.00 0.25 N ATOM 0 H ASN A 124 2.915 -10.034 9.285 1.00 0.13 H new ATOM 0 HA ASN A 124 0.963 -8.295 10.382 1.00 0.14 H new ATOM 0 HB2 ASN A 124 2.644 -9.573 11.702 1.00 0.18 H new ATOM 0 HB3 ASN A 124 3.921 -8.581 11.027 1.00 0.18 H new ATOM 0 HD21 ASN A 124 3.569 -6.586 13.934 1.00 0.25 H new ATOM 0 HD22 ASN A 124 4.559 -7.749 13.047 1.00 0.25 H new ATOM 560 N ILE A 125 1.601 -5.963 9.793 1.00 0.11 N ATOM 561 CA ILE A 125 1.805 -4.627 9.267 1.00 0.10 C ATOM 562 C ILE A 125 2.225 -3.692 10.390 1.00 0.11 C ATOM 563 O ILE A 125 1.630 -3.706 11.469 1.00 0.14 O ATOM 564 CB ILE A 125 0.518 -4.093 8.606 1.00 0.11 C ATOM 565 CG1 ILE A 125 0.052 -5.041 7.497 1.00 0.10 C ATOM 566 CG2 ILE A 125 0.738 -2.694 8.054 1.00 0.14 C ATOM 567 CD1 ILE A 125 -1.249 -4.621 6.845 1.00 0.11 C ATOM 0 H ILE A 125 0.812 -6.043 10.434 1.00 0.11 H new ATOM 0 HA ILE A 125 2.590 -4.672 8.512 1.00 0.10 H new ATOM 0 HB ILE A 125 -0.261 -4.041 9.366 1.00 0.11 H new ATOM 0 HG12 ILE A 125 0.828 -5.102 6.734 1.00 0.10 H new ATOM 0 HG13 ILE A 125 -0.066 -6.042 7.912 1.00 0.10 H new ATOM 0 HG21 ILE A 125 -0.182 -2.336 7.592 1.00 0.14 H new ATOM 0 HG22 ILE A 125 1.021 -2.023 8.865 1.00 0.14 H new ATOM 0 HG23 ILE A 125 1.533 -2.718 7.308 1.00 0.14 H new ATOM 0 HD11 ILE A 125 -1.516 -5.339 6.070 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.038 -4.587 7.596 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.130 -3.633 6.399 1.00 0.11 H new ATOM 579 N LEU A 126 3.249 -2.886 10.149 1.00 0.13 N ATOM 580 CA LEU A 126 3.734 -1.972 11.172 1.00 0.15 C ATOM 581 C LEU A 126 2.998 -0.650 11.039 1.00 0.16 C ATOM 582 O LEU A 126 2.558 -0.056 12.023 1.00 0.24 O ATOM 583 CB LEU A 126 5.249 -1.705 11.066 1.00 0.19 C ATOM 584 CG LEU A 126 6.186 -2.904 10.824 1.00 0.21 C ATOM 585 CD1 LEU A 126 5.613 -4.210 11.349 1.00 0.53 C ATOM 586 CD2 LEU A 126 6.545 -3.003 9.354 1.00 0.54 C ATOM 0 H LEU A 126 3.755 -2.846 9.264 1.00 0.13 H new ATOM 0 HA LEU A 126 3.549 -2.439 12.139 1.00 0.15 H new ATOM 0 HB2 LEU A 126 5.405 -0.992 10.256 1.00 0.19 H new ATOM 0 HB3 LEU A 126 5.566 -1.216 11.987 1.00 0.19 H new ATOM 0 HG LEU A 126 7.098 -2.725 11.393 1.00 0.21 H new ATOM 0 HD11 LEU A 126 6.315 -5.021 11.152 1.00 0.53 H new ATOM 0 HD12 LEU A 126 5.446 -4.128 12.423 1.00 0.53 H new ATOM 0 HD13 LEU A 126 4.667 -4.419 10.849 1.00 0.53 H new ATOM 0 HD21 LEU A 126 7.207 -3.854 9.198 1.00 0.54 H new ATOM 0 HD22 LEU A 126 5.637 -3.137 8.766 1.00 0.54 H new ATOM 0 HD23 LEU A 126 7.049 -2.089 9.040 1.00 0.54 H new ATOM 598 N SER A 127 2.859 -0.203 9.799 1.00 0.14 N ATOM 599 CA SER A 127 2.234 1.072 9.509 1.00 0.17 C ATOM 600 C SER A 127 1.453 1.012 8.198 1.00 0.19 C ATOM 601 O SER A 127 2.034 1.065 7.115 1.00 0.37 O ATOM 602 CB SER A 127 3.300 2.169 9.431 1.00 0.19 C ATOM 603 OG SER A 127 4.004 2.293 10.659 1.00 0.76 O ATOM 0 H SER A 127 3.175 -0.712 8.974 1.00 0.14 H new ATOM 0 HA SER A 127 1.535 1.302 10.314 1.00 0.17 H new ATOM 0 HB2 SER A 127 4.002 1.941 8.629 1.00 0.19 H new ATOM 0 HB3 SER A 127 2.829 3.120 9.182 1.00 0.19 H new ATOM 0 HG SER A 127 4.679 2.999 10.579 1.00 0.76 H new ATOM 609 N CYS A 128 0.145 0.846 8.299 1.00 0.18 N ATOM 610 CA CYS A 128 -0.728 0.964 7.141 1.00 0.17 C ATOM 611 C CYS A 128 -1.332 2.356 7.112 1.00 0.16 C ATOM 612 O CYS A 128 -1.589 2.946 8.165 1.00 0.28 O ATOM 613 CB CYS A 128 -1.836 -0.084 7.191 1.00 0.21 C ATOM 614 SG CYS A 128 -2.707 -0.140 8.772 1.00 0.72 S ATOM 0 H CYS A 128 -0.337 0.629 9.171 1.00 0.18 H new ATOM 0 HA CYS A 128 -0.143 0.797 6.237 1.00 0.17 H new ATOM 0 HB2 CYS A 128 -2.554 0.121 6.397 1.00 0.21 H new ATOM 0 HB3 CYS A 128 -1.406 -1.065 6.987 1.00 0.21 H new ATOM 0 HG CYS A 128 -3.989 -0.078 8.564 1.00 0.72 H new ATOM 620 N LYS A 129 -1.546 2.892 5.924 1.00 0.13 N ATOM 621 CA LYS A 129 -2.062 4.241 5.802 1.00 0.14 C ATOM 622 C LYS A 129 -2.921 4.408 4.553 1.00 0.12 C ATOM 623 O LYS A 129 -2.555 3.966 3.470 1.00 0.12 O ATOM 624 CB LYS A 129 -0.896 5.238 5.781 1.00 0.18 C ATOM 625 CG LYS A 129 -1.306 6.688 5.556 1.00 0.23 C ATOM 626 CD LYS A 129 -2.122 7.243 6.712 1.00 0.36 C ATOM 627 CE LYS A 129 -2.449 8.714 6.498 1.00 0.47 C ATOM 628 NZ LYS A 129 -3.310 9.254 7.581 1.00 1.00 N ATOM 0 H LYS A 129 -1.372 2.418 5.038 1.00 0.13 H new ATOM 0 HA LYS A 129 -2.699 4.438 6.664 1.00 0.14 H new ATOM 0 HB2 LYS A 129 -0.359 5.169 6.727 1.00 0.18 H new ATOM 0 HB3 LYS A 129 -0.199 4.945 4.996 1.00 0.18 H new ATOM 0 HG2 LYS A 129 -0.413 7.298 5.418 1.00 0.23 H new ATOM 0 HG3 LYS A 129 -1.887 6.760 4.636 1.00 0.23 H new ATOM 0 HD2 LYS A 129 -3.046 6.674 6.815 1.00 0.36 H new ATOM 0 HD3 LYS A 129 -1.568 7.123 7.643 1.00 0.36 H new ATOM 0 HE2 LYS A 129 -1.524 9.288 6.450 1.00 0.47 H new ATOM 0 HE3 LYS A 129 -2.952 8.838 5.539 1.00 0.47 H new ATOM 0 HZ1 LYS A 129 -3.510 10.258 7.398 1.00 1.00 H new ATOM 0 HZ2 LYS A 129 -4.204 8.723 7.611 1.00 1.00 H new ATOM 0 HZ3 LYS A 129 -2.820 9.159 8.494 1.00 1.00 H new ATOM 642 N VAL A 130 -4.063 5.044 4.738 1.00 0.15 N ATOM 643 CA VAL A 130 -4.912 5.481 3.649 1.00 0.17 C ATOM 644 C VAL A 130 -4.909 6.983 3.679 1.00 0.20 C ATOM 645 O VAL A 130 -5.348 7.593 4.654 1.00 0.24 O ATOM 646 CB VAL A 130 -6.376 4.995 3.764 1.00 0.21 C ATOM 647 CG1 VAL A 130 -7.224 5.571 2.626 1.00 0.28 C ATOM 648 CG2 VAL A 130 -6.448 3.477 3.769 1.00 0.21 C ATOM 0 H VAL A 130 -4.430 5.274 5.661 1.00 0.15 H new ATOM 0 HA VAL A 130 -4.520 5.061 2.723 1.00 0.17 H new ATOM 0 HB VAL A 130 -6.778 5.354 4.711 1.00 0.21 H new ATOM 0 HG11 VAL A 130 -8.251 5.218 2.723 1.00 0.28 H new ATOM 0 HG12 VAL A 130 -7.208 6.660 2.675 1.00 0.28 H new ATOM 0 HG13 VAL A 130 -6.818 5.245 1.669 1.00 0.28 H new ATOM 0 HG21 VAL A 130 -7.488 3.162 3.851 1.00 0.21 H new ATOM 0 HG22 VAL A 130 -6.023 3.090 2.843 1.00 0.21 H new ATOM 0 HG23 VAL A 130 -5.884 3.089 4.617 1.00 0.21 H new ATOM 658 N VAL A 131 -4.375 7.579 2.653 1.00 0.21 N ATOM 659 CA VAL A 131 -4.261 9.009 2.624 1.00 0.27 C ATOM 660 C VAL A 131 -5.580 9.592 2.164 1.00 0.33 C ATOM 661 O VAL A 131 -6.019 9.362 1.038 1.00 0.33 O ATOM 662 CB VAL A 131 -3.094 9.412 1.719 1.00 0.28 C ATOM 663 CG1 VAL A 131 -2.770 10.890 1.865 1.00 0.34 C ATOM 664 CG2 VAL A 131 -1.891 8.550 2.072 1.00 0.25 C ATOM 0 H VAL A 131 -4.013 7.100 1.828 1.00 0.21 H new ATOM 0 HA VAL A 131 -4.047 9.404 3.617 1.00 0.27 H new ATOM 0 HB VAL A 131 -3.368 9.250 0.676 1.00 0.28 H new ATOM 0 HG11 VAL A 131 -1.937 11.146 1.210 1.00 0.34 H new ATOM 0 HG12 VAL A 131 -3.643 11.483 1.591 1.00 0.34 H new ATOM 0 HG13 VAL A 131 -2.497 11.102 2.899 1.00 0.34 H new ATOM 0 HG21 VAL A 131 -1.049 8.823 1.437 1.00 0.25 H new ATOM 0 HG22 VAL A 131 -1.624 8.709 3.117 1.00 0.25 H new ATOM 0 HG23 VAL A 131 -2.138 7.500 1.916 1.00 0.25 H new ATOM 674 N CYS A 132 -6.220 10.324 3.056 1.00 0.43 N ATOM 675 CA CYS A 132 -7.586 10.752 2.845 1.00 0.55 C ATOM 676 C CYS A 132 -7.656 12.216 2.460 1.00 0.58 C ATOM 677 O CYS A 132 -6.902 13.045 2.964 1.00 0.66 O ATOM 678 CB CYS A 132 -8.415 10.502 4.107 1.00 0.75 C ATOM 679 SG CYS A 132 -8.362 8.792 4.698 1.00 1.58 S ATOM 0 H CYS A 132 -5.812 10.635 3.937 1.00 0.43 H new ATOM 0 HA CYS A 132 -7.996 10.169 2.021 1.00 0.55 H new ATOM 0 HB2 CYS A 132 -8.059 11.160 4.899 1.00 0.75 H new ATOM 0 HB3 CYS A 132 -9.451 10.775 3.908 1.00 0.75 H new ATOM 0 HG CYS A 132 -7.137 8.357 4.659 1.00 1.58 H new ATOM 685 N ASP A 133 -8.554 12.514 1.541 1.00 0.59 N ATOM 686 CA ASP A 133 -8.833 13.872 1.152 1.00 0.72 C ATOM 687 C ASP A 133 -9.866 14.428 2.123 1.00 0.93 C ATOM 688 O ASP A 133 -10.533 13.651 2.805 1.00 0.99 O ATOM 689 CB ASP A 133 -9.364 13.894 -0.289 1.00 0.70 C ATOM 690 CG ASP A 133 -9.465 15.281 -0.871 1.00 1.09 C ATOM 691 OD1 ASP A 133 -8.434 15.807 -1.335 1.00 2.08 O ATOM 692 OD2 ASP A 133 -10.578 15.835 -0.897 1.00 1.20 O ATOM 0 H ASP A 133 -9.109 11.816 1.046 1.00 0.59 H new ATOM 0 HA ASP A 133 -7.932 14.484 1.185 1.00 0.72 H new ATOM 0 HB2 ASP A 133 -8.709 13.291 -0.918 1.00 0.70 H new ATOM 0 HB3 ASP A 133 -10.348 13.426 -0.312 1.00 0.70 H new ATOM 697 N GLU A 134 -10.004 15.742 2.221 1.00 1.12 N ATOM 698 CA GLU A 134 -11.055 16.309 3.070 1.00 1.35 C ATOM 699 C GLU A 134 -12.432 15.927 2.531 1.00 1.36 C ATOM 700 O GLU A 134 -13.432 15.990 3.244 1.00 1.52 O ATOM 701 CB GLU A 134 -10.941 17.834 3.204 1.00 1.57 C ATOM 702 CG GLU A 134 -11.021 18.589 1.891 1.00 1.60 C ATOM 703 CD GLU A 134 -9.654 18.900 1.317 1.00 1.96 C ATOM 704 OE1 GLU A 134 -8.742 18.051 1.430 1.00 2.45 O ATOM 705 OE2 GLU A 134 -9.474 20.009 0.772 1.00 2.09 O ATOM 0 H GLU A 134 -9.420 16.426 1.739 1.00 1.12 H new ATOM 0 HA GLU A 134 -10.925 15.889 4.067 1.00 1.35 H new ATOM 0 HB2 GLU A 134 -11.735 18.189 3.861 1.00 1.57 H new ATOM 0 HB3 GLU A 134 -9.995 18.074 3.689 1.00 1.57 H new ATOM 0 HG2 GLU A 134 -11.589 18.000 1.171 1.00 1.60 H new ATOM 0 HG3 GLU A 134 -11.568 19.519 2.043 1.00 1.60 H new ATOM 712 N ASN A 135 -12.471 15.533 1.261 1.00 1.25 N ATOM 713 CA ASN A 135 -13.706 15.078 0.638 1.00 1.31 C ATOM 714 C ASN A 135 -13.849 13.563 0.767 1.00 1.25 C ATOM 715 O ASN A 135 -14.813 12.978 0.271 1.00 1.36 O ATOM 716 CB ASN A 135 -13.763 15.481 -0.841 1.00 1.32 C ATOM 717 CG ASN A 135 -13.775 16.986 -1.047 1.00 1.47 C ATOM 718 OD1 ASN A 135 -14.822 17.628 -0.950 1.00 1.65 O ATOM 719 ND2 ASN A 135 -12.624 17.557 -1.367 1.00 1.46 N ATOM 0 H ASN A 135 -11.659 15.520 0.644 1.00 1.25 H new ATOM 0 HA ASN A 135 -14.534 15.559 1.159 1.00 1.31 H new ATOM 0 HB2 ASN A 135 -12.905 15.056 -1.361 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -14.656 15.051 -1.295 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -12.584 18.561 -1.543 1.00 1.46 H new ATOM 0 HD22 ASN A 135 -11.777 16.993 -1.438 1.00 1.46 H new ATOM 726 N GLY A 136 -12.891 12.933 1.441 1.00 1.12 N ATOM 727 CA GLY A 136 -12.963 11.495 1.671 1.00 1.11 C ATOM 728 C GLY A 136 -11.610 10.795 1.605 1.00 0.89 C ATOM 729 O GLY A 136 -11.015 10.516 2.638 1.00 0.86 O ATOM 0 H GLY A 136 -12.067 13.389 1.832 1.00 1.12 H new ATOM 0 HA2 GLY A 136 -13.408 11.314 2.649 1.00 1.11 H new ATOM 0 HA3 GLY A 136 -13.629 11.051 0.931 1.00 1.11 H new ATOM 733 N SER A 137 -11.112 10.509 0.402 1.00 0.77 N ATOM 734 CA SER A 137 -9.854 9.782 0.250 1.00 0.57 C ATOM 735 C SER A 137 -9.071 10.354 -0.927 1.00 0.47 C ATOM 736 O SER A 137 -9.661 10.930 -1.843 1.00 0.53 O ATOM 737 CB SER A 137 -10.125 8.290 0.034 1.00 0.67 C ATOM 738 OG SER A 137 -8.914 7.553 -0.020 1.00 1.61 O ATOM 0 H SER A 137 -11.559 10.769 -0.477 1.00 0.77 H new ATOM 0 HA SER A 137 -9.264 9.896 1.159 1.00 0.57 H new ATOM 0 HB2 SER A 137 -10.750 7.910 0.842 1.00 0.67 H new ATOM 0 HB3 SER A 137 -10.682 8.149 -0.892 1.00 0.67 H new ATOM 0 HG SER A 137 -9.115 6.604 -0.157 1.00 1.61 H new ATOM 744 N LYS A 138 -7.747 10.225 -0.896 1.00 0.38 N ATOM 745 CA LYS A 138 -6.925 10.733 -1.986 1.00 0.36 C ATOM 746 C LYS A 138 -6.776 9.680 -3.066 1.00 0.34 C ATOM 747 O LYS A 138 -6.291 9.958 -4.166 1.00 0.47 O ATOM 748 CB LYS A 138 -5.541 11.183 -1.505 1.00 0.36 C ATOM 749 CG LYS A 138 -5.568 12.178 -0.355 1.00 0.44 C ATOM 750 CD LYS A 138 -4.416 13.160 -0.442 1.00 0.67 C ATOM 751 CE LYS A 138 -4.595 14.121 -1.612 1.00 0.89 C ATOM 752 NZ LYS A 138 -5.631 15.153 -1.338 1.00 1.51 N ATOM 0 H LYS A 138 -7.228 9.780 -0.139 1.00 0.38 H new ATOM 0 HA LYS A 138 -7.434 11.607 -2.393 1.00 0.36 H new ATOM 0 HB2 LYS A 138 -4.974 10.305 -1.196 1.00 0.36 H new ATOM 0 HB3 LYS A 138 -5.006 11.629 -2.343 1.00 0.36 H new ATOM 0 HG2 LYS A 138 -6.513 12.722 -0.365 1.00 0.44 H new ATOM 0 HG3 LYS A 138 -5.519 11.642 0.593 1.00 0.44 H new ATOM 0 HD2 LYS A 138 -4.346 13.725 0.488 1.00 0.67 H new ATOM 0 HD3 LYS A 138 -3.479 12.615 -0.556 1.00 0.67 H new ATOM 0 HE2 LYS A 138 -3.645 14.610 -1.827 1.00 0.89 H new ATOM 0 HE3 LYS A 138 -4.872 13.558 -2.503 1.00 0.89 H new ATOM 0 HZ1 LYS A 138 -5.433 16.002 -1.905 1.00 1.51 H new ATOM 0 HZ2 LYS A 138 -6.568 14.779 -1.590 1.00 1.51 H new ATOM 0 HZ3 LYS A 138 -5.617 15.400 -0.328 1.00 1.51 H new ATOM 766 N GLY A 139 -7.191 8.472 -2.741 1.00 0.27 N ATOM 767 CA GLY A 139 -7.172 7.404 -3.715 1.00 0.26 C ATOM 768 C GLY A 139 -6.105 6.371 -3.449 1.00 0.21 C ATOM 769 O GLY A 139 -6.232 5.222 -3.859 1.00 0.31 O ATOM 0 H GLY A 139 -7.542 8.209 -1.820 1.00 0.27 H new ATOM 0 HA2 GLY A 139 -8.146 6.915 -3.726 1.00 0.26 H new ATOM 0 HA3 GLY A 139 -7.017 7.829 -4.707 1.00 0.26 H new ATOM 773 N TYR A 140 -5.060 6.762 -2.749 1.00 0.19 N ATOM 774 CA TYR A 140 -3.911 5.893 -2.587 1.00 0.15 C ATOM 775 C TYR A 140 -3.586 5.646 -1.121 1.00 0.13 C ATOM 776 O TYR A 140 -3.886 6.465 -0.248 1.00 0.16 O ATOM 777 CB TYR A 140 -2.698 6.471 -3.322 1.00 0.19 C ATOM 778 CG TYR A 140 -2.430 7.933 -3.036 1.00 0.23 C ATOM 779 CD1 TYR A 140 -3.027 8.926 -3.804 1.00 0.26 C ATOM 780 CD2 TYR A 140 -1.573 8.320 -2.014 1.00 0.31 C ATOM 781 CE1 TYR A 140 -2.777 10.263 -3.558 1.00 0.34 C ATOM 782 CE2 TYR A 140 -1.317 9.655 -1.765 1.00 0.39 C ATOM 783 CZ TYR A 140 -1.923 10.621 -2.539 1.00 0.41 C ATOM 784 OH TYR A 140 -1.660 11.952 -2.302 1.00 0.49 O ATOM 0 H TYR A 140 -4.981 7.668 -2.286 1.00 0.19 H new ATOM 0 HA TYR A 140 -4.163 4.928 -3.027 1.00 0.15 H new ATOM 0 HB2 TYR A 140 -1.815 5.893 -3.050 1.00 0.19 H new ATOM 0 HB3 TYR A 140 -2.845 6.344 -4.395 1.00 0.19 H new ATOM 0 HD1 TYR A 140 -3.696 8.649 -4.605 1.00 0.26 H new ATOM 0 HD2 TYR A 140 -1.099 7.565 -1.404 1.00 0.31 H new ATOM 0 HE1 TYR A 140 -3.249 11.023 -4.162 1.00 0.34 H new ATOM 0 HE2 TYR A 140 -0.646 9.940 -0.968 1.00 0.39 H new ATOM 0 HH TYR A 140 -1.039 12.034 -1.548 1.00 0.49 H new ATOM 794 N GLY A 141 -2.977 4.499 -0.870 1.00 0.11 N ATOM 795 CA GLY A 141 -2.592 4.120 0.469 1.00 0.11 C ATOM 796 C GLY A 141 -1.269 3.389 0.474 1.00 0.10 C ATOM 797 O GLY A 141 -0.723 3.094 -0.587 1.00 0.12 O ATOM 0 H GLY A 141 -2.739 3.813 -1.586 1.00 0.11 H new ATOM 0 HA2 GLY A 141 -2.521 5.010 1.095 1.00 0.11 H new ATOM 0 HA3 GLY A 141 -3.363 3.484 0.905 1.00 0.11 H new ATOM 801 N PHE A 142 -0.752 3.090 1.655 1.00 0.10 N ATOM 802 CA PHE A 142 0.549 2.446 1.782 1.00 0.10 C ATOM 803 C PHE A 142 0.516 1.371 2.865 1.00 0.10 C ATOM 804 O PHE A 142 -0.129 1.548 3.900 1.00 0.14 O ATOM 805 CB PHE A 142 1.625 3.480 2.132 1.00 0.12 C ATOM 806 CG PHE A 142 1.678 4.659 1.198 1.00 0.14 C ATOM 807 CD1 PHE A 142 2.134 4.515 -0.106 1.00 0.16 C ATOM 808 CD2 PHE A 142 1.264 5.909 1.623 1.00 0.21 C ATOM 809 CE1 PHE A 142 2.173 5.601 -0.961 1.00 0.19 C ATOM 810 CE2 PHE A 142 1.301 6.996 0.770 1.00 0.25 C ATOM 811 CZ PHE A 142 1.794 6.833 -0.531 1.00 0.22 C ATOM 0 H PHE A 142 -1.214 3.283 2.544 1.00 0.10 H new ATOM 0 HA PHE A 142 0.788 1.982 0.825 1.00 0.10 H new ATOM 0 HB2 PHE A 142 1.449 3.842 3.145 1.00 0.12 H new ATOM 0 HB3 PHE A 142 2.598 2.988 2.133 1.00 0.12 H new ATOM 0 HD1 PHE A 142 2.461 3.547 -0.455 1.00 0.16 H new ATOM 0 HD2 PHE A 142 0.907 6.037 2.634 1.00 0.21 H new ATOM 0 HE1 PHE A 142 2.508 5.469 -1.979 1.00 0.19 H new ATOM 0 HE2 PHE A 142 0.953 7.962 1.104 1.00 0.25 H new ATOM 0 HZ PHE A 142 1.873 7.684 -1.191 1.00 0.22 H new ATOM 821 N VAL A 143 1.189 0.252 2.619 1.00 0.08 N ATOM 822 CA VAL A 143 1.359 -0.769 3.647 1.00 0.08 C ATOM 823 C VAL A 143 2.820 -0.915 4.012 1.00 0.08 C ATOM 824 O VAL A 143 3.681 -1.047 3.140 1.00 0.09 O ATOM 825 CB VAL A 143 0.853 -2.160 3.212 1.00 0.08 C ATOM 826 CG1 VAL A 143 0.960 -3.167 4.360 1.00 0.07 C ATOM 827 CG2 VAL A 143 -0.570 -2.076 2.712 1.00 0.10 C ATOM 0 H VAL A 143 1.623 0.030 1.723 1.00 0.08 H new ATOM 0 HA VAL A 143 0.766 -0.429 4.496 1.00 0.08 H new ATOM 0 HB VAL A 143 1.486 -2.509 2.396 1.00 0.08 H new ATOM 0 HG11 VAL A 143 0.597 -4.139 4.026 1.00 0.07 H new ATOM 0 HG12 VAL A 143 2.001 -3.256 4.670 1.00 0.07 H new ATOM 0 HG13 VAL A 143 0.358 -2.824 5.202 1.00 0.07 H new ATOM 0 HG21 VAL A 143 -0.909 -3.067 2.410 1.00 0.10 H new ATOM 0 HG22 VAL A 143 -1.213 -1.699 3.507 1.00 0.10 H new ATOM 0 HG23 VAL A 143 -0.616 -1.401 1.858 1.00 0.10 H new ATOM 837 N HIS A 144 3.099 -0.863 5.295 1.00 0.09 N ATOM 838 CA HIS A 144 4.394 -1.258 5.793 1.00 0.10 C ATOM 839 C HIS A 144 4.305 -2.655 6.360 1.00 0.10 C ATOM 840 O HIS A 144 3.769 -2.850 7.448 1.00 0.11 O ATOM 841 CB HIS A 144 4.863 -0.300 6.878 1.00 0.12 C ATOM 842 CG HIS A 144 5.824 0.719 6.384 1.00 0.14 C ATOM 843 ND1 HIS A 144 6.034 1.192 5.141 1.00 0.18 N flip ATOM 844 CD2 HIS A 144 6.731 1.350 7.199 1.00 0.17 C flip ATOM 845 CE1 HIS A 144 7.060 2.103 5.224 1.00 0.21 C flip ATOM 846 NE2 HIS A 144 7.465 2.171 6.479 1.00 0.21 N flip ATOM 0 H HIS A 144 2.444 -0.550 6.012 1.00 0.09 H new ATOM 0 HA HIS A 144 5.110 -1.234 4.972 1.00 0.10 H new ATOM 0 HB2 HIS A 144 3.997 0.204 7.307 1.00 0.12 H new ATOM 0 HB3 HIS A 144 5.330 -0.871 7.681 1.00 0.12 H new ATOM 0 HD2 HIS A 144 6.827 1.197 8.264 1.00 0.17 H new ATOM 0 HE1 HIS A 144 7.467 2.669 4.399 1.00 0.21 H new ATOM 0 HE2 HIS A 144 8.219 2.760 6.831 1.00 0.21 H new ATOM 855 N PHE A 145 4.829 -3.621 5.638 1.00 0.10 N ATOM 856 CA PHE A 145 4.820 -4.984 6.115 1.00 0.10 C ATOM 857 C PHE A 145 6.031 -5.249 6.968 1.00 0.13 C ATOM 858 O PHE A 145 7.115 -4.721 6.715 1.00 0.17 O ATOM 859 CB PHE A 145 4.758 -5.986 4.965 1.00 0.10 C ATOM 860 CG PHE A 145 3.363 -6.284 4.503 1.00 0.09 C ATOM 861 CD1 PHE A 145 2.526 -7.077 5.270 1.00 0.10 C ATOM 862 CD2 PHE A 145 2.890 -5.780 3.306 1.00 0.09 C ATOM 863 CE1 PHE A 145 1.242 -7.362 4.850 1.00 0.11 C ATOM 864 CE2 PHE A 145 1.609 -6.062 2.880 1.00 0.10 C ATOM 865 CZ PHE A 145 0.783 -6.853 3.652 1.00 0.10 C ATOM 0 H PHE A 145 5.264 -3.489 4.725 1.00 0.10 H new ATOM 0 HA PHE A 145 3.921 -5.114 6.718 1.00 0.10 H new ATOM 0 HB2 PHE A 145 5.335 -5.599 4.125 1.00 0.10 H new ATOM 0 HB3 PHE A 145 5.235 -6.915 5.278 1.00 0.10 H new ATOM 0 HD1 PHE A 145 2.882 -7.477 6.208 1.00 0.10 H new ATOM 0 HD2 PHE A 145 3.531 -5.159 2.698 1.00 0.09 H new ATOM 0 HE1 PHE A 145 0.599 -7.981 5.457 1.00 0.11 H new ATOM 0 HE2 PHE A 145 1.252 -5.664 1.942 1.00 0.10 H new ATOM 0 HZ PHE A 145 -0.221 -7.073 3.319 1.00 0.10 H new ATOM 875 N GLU A 146 5.809 -6.039 7.999 1.00 0.13 N ATOM 876 CA GLU A 146 6.867 -6.443 8.923 1.00 0.17 C ATOM 877 C GLU A 146 8.045 -7.039 8.165 1.00 0.19 C ATOM 878 O GLU A 146 9.206 -6.874 8.550 1.00 0.22 O ATOM 879 CB GLU A 146 6.331 -7.470 9.923 1.00 0.22 C ATOM 880 CG GLU A 146 7.291 -7.765 11.065 1.00 0.30 C ATOM 881 CD GLU A 146 6.763 -8.812 12.016 1.00 0.37 C ATOM 882 OE1 GLU A 146 6.061 -8.446 12.979 1.00 0.38 O ATOM 883 OE2 GLU A 146 7.056 -10.006 11.813 1.00 0.57 O ATOM 0 H GLU A 146 4.892 -6.423 8.226 1.00 0.13 H new ATOM 0 HA GLU A 146 7.205 -5.557 9.460 1.00 0.17 H new ATOM 0 HB2 GLU A 146 5.390 -7.107 10.335 1.00 0.22 H new ATOM 0 HB3 GLU A 146 6.111 -8.398 9.395 1.00 0.22 H new ATOM 0 HG2 GLU A 146 8.244 -8.100 10.655 1.00 0.30 H new ATOM 0 HG3 GLU A 146 7.487 -6.845 11.616 1.00 0.30 H new ATOM 890 N THR A 147 7.731 -7.728 7.084 1.00 0.22 N ATOM 891 CA THR A 147 8.742 -8.372 6.266 1.00 0.26 C ATOM 892 C THR A 147 8.566 -8.023 4.792 1.00 0.23 C ATOM 893 O THR A 147 7.457 -7.729 4.334 1.00 0.21 O ATOM 894 CB THR A 147 8.697 -9.902 6.429 1.00 0.33 C ATOM 895 OG1 THR A 147 7.391 -10.393 6.094 1.00 0.40 O ATOM 896 CG2 THR A 147 9.048 -10.306 7.852 1.00 0.35 C ATOM 0 H THR A 147 6.776 -7.857 6.750 1.00 0.22 H new ATOM 0 HA THR A 147 9.709 -8.003 6.607 1.00 0.26 H new ATOM 0 HB THR A 147 9.433 -10.339 5.754 1.00 0.33 H new ATOM 0 HG1 THR A 147 7.371 -11.367 6.199 1.00 0.40 H new ATOM 0 HG21 THR A 147 9.009 -11.392 7.942 1.00 0.35 H new ATOM 0 HG22 THR A 147 10.053 -9.958 8.092 1.00 0.35 H new ATOM 0 HG23 THR A 147 8.334 -9.859 8.544 1.00 0.35 H new ATOM 904 N GLN A 148 9.670 -8.051 4.059 1.00 0.24 N ATOM 905 CA GLN A 148 9.667 -7.774 2.628 1.00 0.23 C ATOM 906 C GLN A 148 8.818 -8.798 1.867 1.00 0.21 C ATOM 907 O GLN A 148 8.137 -8.452 0.899 1.00 0.21 O ATOM 908 CB GLN A 148 11.110 -7.789 2.109 1.00 0.28 C ATOM 909 CG GLN A 148 11.272 -7.313 0.670 1.00 0.31 C ATOM 910 CD GLN A 148 10.695 -5.931 0.427 1.00 0.34 C ATOM 911 OE1 GLN A 148 11.373 -4.914 0.575 1.00 0.47 O ATOM 912 NE2 GLN A 148 9.434 -5.887 0.043 1.00 0.38 N ATOM 0 H GLN A 148 10.592 -8.266 4.438 1.00 0.24 H new ATOM 0 HA GLN A 148 9.226 -6.791 2.462 1.00 0.23 H new ATOM 0 HB2 GLN A 148 11.722 -7.161 2.757 1.00 0.28 H new ATOM 0 HB3 GLN A 148 11.500 -8.804 2.188 1.00 0.28 H new ATOM 0 HG2 GLN A 148 12.331 -7.307 0.414 1.00 0.31 H new ATOM 0 HG3 GLN A 148 10.786 -8.025 0.002 1.00 0.31 H new ATOM 0 HE21 GLN A 148 8.904 -6.752 -0.069 1.00 0.38 H new ATOM 0 HE22 GLN A 148 8.988 -4.988 -0.142 1.00 0.38 H new ATOM 921 N GLU A 149 8.849 -10.048 2.322 1.00 0.22 N ATOM 922 CA GLU A 149 8.156 -11.139 1.639 1.00 0.22 C ATOM 923 C GLU A 149 6.633 -11.008 1.746 1.00 0.18 C ATOM 924 O GLU A 149 5.910 -11.323 0.799 1.00 0.17 O ATOM 925 CB GLU A 149 8.633 -12.485 2.182 1.00 0.28 C ATOM 926 CG GLU A 149 8.178 -12.763 3.590 1.00 0.35 C ATOM 927 CD GLU A 149 8.861 -13.966 4.202 1.00 0.47 C ATOM 928 OE1 GLU A 149 8.451 -15.109 3.919 1.00 0.74 O ATOM 929 OE2 GLU A 149 9.832 -13.772 4.965 1.00 0.62 O ATOM 0 H GLU A 149 9.349 -10.332 3.165 1.00 0.22 H new ATOM 0 HA GLU A 149 8.403 -11.081 0.579 1.00 0.22 H new ATOM 0 HB2 GLU A 149 8.272 -13.279 1.529 1.00 0.28 H new ATOM 0 HB3 GLU A 149 9.722 -12.515 2.148 1.00 0.28 H new ATOM 0 HG2 GLU A 149 8.372 -11.887 4.209 1.00 0.35 H new ATOM 0 HG3 GLU A 149 7.100 -12.923 3.593 1.00 0.35 H new ATOM 936 N ALA A 150 6.147 -10.519 2.883 1.00 0.17 N ATOM 937 CA ALA A 150 4.713 -10.339 3.088 1.00 0.15 C ATOM 938 C ALA A 150 4.167 -9.274 2.144 1.00 0.13 C ATOM 939 O ALA A 150 3.042 -9.376 1.653 1.00 0.13 O ATOM 940 CB ALA A 150 4.428 -9.968 4.535 1.00 0.18 C ATOM 0 H ALA A 150 6.725 -10.240 3.676 1.00 0.17 H new ATOM 0 HA ALA A 150 4.211 -11.281 2.868 1.00 0.15 H new ATOM 0 HB1 ALA A 150 3.355 -9.837 4.672 1.00 0.18 H new ATOM 0 HB2 ALA A 150 4.784 -10.762 5.191 1.00 0.18 H new ATOM 0 HB3 ALA A 150 4.941 -9.038 4.780 1.00 0.18 H new ATOM 946 N ALA A 151 4.987 -8.265 1.878 1.00 0.13 N ATOM 947 CA ALA A 151 4.611 -7.185 0.979 1.00 0.13 C ATOM 948 C ALA A 151 4.431 -7.698 -0.442 1.00 0.12 C ATOM 949 O ALA A 151 3.489 -7.315 -1.134 1.00 0.13 O ATOM 950 CB ALA A 151 5.661 -6.090 1.015 1.00 0.16 C ATOM 0 H ALA A 151 5.922 -8.174 2.276 1.00 0.13 H new ATOM 0 HA ALA A 151 3.658 -6.775 1.314 1.00 0.13 H new ATOM 0 HB1 ALA A 151 5.371 -5.286 0.339 1.00 0.16 H new ATOM 0 HB2 ALA A 151 5.745 -5.699 2.029 1.00 0.16 H new ATOM 0 HB3 ALA A 151 6.623 -6.498 0.703 1.00 0.16 H new ATOM 956 N GLU A 152 5.334 -8.575 -0.867 1.00 0.13 N ATOM 957 CA GLU A 152 5.260 -9.168 -2.194 1.00 0.14 C ATOM 958 C GLU A 152 3.949 -9.924 -2.376 1.00 0.12 C ATOM 959 O GLU A 152 3.324 -9.851 -3.434 1.00 0.15 O ATOM 960 CB GLU A 152 6.443 -10.108 -2.432 1.00 0.18 C ATOM 961 CG GLU A 152 7.792 -9.430 -2.268 1.00 0.26 C ATOM 962 CD GLU A 152 8.940 -10.267 -2.792 1.00 0.75 C ATOM 963 OE1 GLU A 152 9.050 -10.419 -4.026 1.00 0.95 O ATOM 964 OE2 GLU A 152 9.765 -10.733 -1.981 1.00 1.42 O ATOM 0 H GLU A 152 6.127 -8.891 -0.309 1.00 0.13 H new ATOM 0 HA GLU A 152 5.301 -8.361 -2.925 1.00 0.14 H new ATOM 0 HB2 GLU A 152 6.378 -10.945 -1.737 1.00 0.18 H new ATOM 0 HB3 GLU A 152 6.372 -10.522 -3.438 1.00 0.18 H new ATOM 0 HG2 GLU A 152 7.778 -8.474 -2.791 1.00 0.26 H new ATOM 0 HG3 GLU A 152 7.959 -9.214 -1.213 1.00 0.26 H new ATOM 971 N ARG A 153 3.528 -10.630 -1.332 1.00 0.10 N ATOM 972 CA ARG A 153 2.285 -11.389 -1.366 1.00 0.12 C ATOM 973 C ARG A 153 1.083 -10.469 -1.507 1.00 0.11 C ATOM 974 O ARG A 153 0.141 -10.773 -2.235 1.00 0.16 O ATOM 975 CB ARG A 153 2.149 -12.244 -0.111 1.00 0.16 C ATOM 976 CG ARG A 153 3.275 -13.246 0.035 1.00 0.21 C ATOM 977 CD ARG A 153 3.200 -13.987 1.351 1.00 0.26 C ATOM 978 NE ARG A 153 4.346 -14.871 1.519 1.00 0.38 N ATOM 979 CZ ARG A 153 5.019 -15.007 2.653 1.00 0.80 C ATOM 980 NH1 ARG A 153 4.622 -14.373 3.748 1.00 1.48 N ATOM 981 NH2 ARG A 153 6.088 -15.787 2.698 1.00 0.84 N ATOM 0 H ARG A 153 4.033 -10.692 -0.448 1.00 0.10 H new ATOM 0 HA ARG A 153 2.316 -12.043 -2.238 1.00 0.12 H new ATOM 0 HB2 ARG A 153 2.128 -11.596 0.765 1.00 0.16 H new ATOM 0 HB3 ARG A 153 1.197 -12.774 -0.138 1.00 0.16 H new ATOM 0 HG2 ARG A 153 3.235 -13.960 -0.787 1.00 0.21 H new ATOM 0 HG3 ARG A 153 4.232 -12.730 -0.038 1.00 0.21 H new ATOM 0 HD2 ARG A 153 3.164 -13.272 2.173 1.00 0.26 H new ATOM 0 HD3 ARG A 153 2.279 -14.568 1.393 1.00 0.26 H new ATOM 0 HE ARG A 153 4.649 -15.419 0.714 1.00 0.38 H new ATOM 0 HH11 ARG A 153 3.795 -13.777 3.721 1.00 1.48 H new ATOM 0 HH12 ARG A 153 5.144 -14.482 4.618 1.00 1.48 H new ATOM 0 HH21 ARG A 153 6.393 -16.283 1.860 1.00 0.84 H new ATOM 0 HH22 ARG A 153 6.606 -15.892 3.570 1.00 0.84 H new ATOM 995 N ALA A 154 1.120 -9.340 -0.815 1.00 0.09 N ATOM 996 CA ALA A 154 0.050 -8.360 -0.917 1.00 0.09 C ATOM 997 C ALA A 154 -0.024 -7.797 -2.333 1.00 0.09 C ATOM 998 O ALA A 154 -1.108 -7.548 -2.853 1.00 0.10 O ATOM 999 CB ALA A 154 0.245 -7.245 0.096 1.00 0.10 C ATOM 0 H ALA A 154 1.875 -9.081 -0.180 1.00 0.09 H new ATOM 0 HA ALA A 154 -0.894 -8.857 -0.696 1.00 0.09 H new ATOM 0 HB1 ALA A 154 -0.566 -6.523 0.003 1.00 0.10 H new ATOM 0 HB2 ALA A 154 0.244 -7.664 1.102 1.00 0.10 H new ATOM 0 HB3 ALA A 154 1.197 -6.747 -0.089 1.00 0.10 H new ATOM 1005 N ILE A 155 1.134 -7.620 -2.955 1.00 0.09 N ATOM 1006 CA ILE A 155 1.204 -7.113 -4.322 1.00 0.10 C ATOM 1007 C ILE A 155 0.513 -8.062 -5.298 1.00 0.11 C ATOM 1008 O ILE A 155 -0.364 -7.653 -6.054 1.00 0.14 O ATOM 1009 CB ILE A 155 2.666 -6.889 -4.764 1.00 0.11 C ATOM 1010 CG1 ILE A 155 3.311 -5.809 -3.897 1.00 0.12 C ATOM 1011 CG2 ILE A 155 2.733 -6.506 -6.237 1.00 0.14 C ATOM 1012 CD1 ILE A 155 4.779 -5.595 -4.180 1.00 0.15 C ATOM 0 H ILE A 155 2.041 -7.820 -2.534 1.00 0.09 H new ATOM 0 HA ILE A 155 0.685 -6.155 -4.335 1.00 0.10 H new ATOM 0 HB ILE A 155 3.217 -7.821 -4.634 1.00 0.11 H new ATOM 0 HG12 ILE A 155 2.781 -4.869 -4.050 1.00 0.12 H new ATOM 0 HG13 ILE A 155 3.188 -6.077 -2.848 1.00 0.12 H new ATOM 0 HG21 ILE A 155 3.773 -6.353 -6.526 1.00 0.14 H new ATOM 0 HG22 ILE A 155 2.302 -7.305 -6.841 1.00 0.14 H new ATOM 0 HG23 ILE A 155 2.172 -5.586 -6.400 1.00 0.14 H new ATOM 0 HD11 ILE A 155 5.166 -4.814 -3.526 1.00 0.15 H new ATOM 0 HD12 ILE A 155 5.323 -6.522 -3.999 1.00 0.15 H new ATOM 0 HD13 ILE A 155 4.909 -5.295 -5.220 1.00 0.15 H new ATOM 1024 N GLU A 156 0.900 -9.331 -5.274 1.00 0.11 N ATOM 1025 CA GLU A 156 0.318 -10.316 -6.177 1.00 0.13 C ATOM 1026 C GLU A 156 -1.164 -10.523 -5.911 1.00 0.12 C ATOM 1027 O GLU A 156 -1.966 -10.631 -6.837 1.00 0.15 O ATOM 1028 CB GLU A 156 1.033 -11.672 -6.092 1.00 0.17 C ATOM 1029 CG GLU A 156 1.584 -12.021 -4.722 1.00 0.21 C ATOM 1030 CD GLU A 156 1.998 -13.471 -4.615 1.00 0.62 C ATOM 1031 OE1 GLU A 156 3.151 -13.790 -4.962 1.00 0.63 O ATOM 1032 OE2 GLU A 156 1.165 -14.301 -4.191 1.00 1.08 O ATOM 0 H GLU A 156 1.611 -9.701 -4.643 1.00 0.11 H new ATOM 0 HA GLU A 156 0.448 -9.910 -7.180 1.00 0.13 H new ATOM 0 HB2 GLU A 156 0.336 -12.453 -6.397 1.00 0.17 H new ATOM 0 HB3 GLU A 156 1.853 -11.679 -6.810 1.00 0.17 H new ATOM 0 HG2 GLU A 156 2.443 -11.385 -4.507 1.00 0.21 H new ATOM 0 HG3 GLU A 156 0.830 -11.805 -3.965 1.00 0.21 H new ATOM 1039 N LYS A 157 -1.517 -10.581 -4.647 1.00 0.09 N ATOM 1040 CA LYS A 157 -2.855 -10.960 -4.256 1.00 0.10 C ATOM 1041 C LYS A 157 -3.851 -9.801 -4.325 1.00 0.08 C ATOM 1042 O LYS A 157 -4.993 -9.990 -4.735 1.00 0.10 O ATOM 1043 CB LYS A 157 -2.828 -11.547 -2.848 1.00 0.12 C ATOM 1044 CG LYS A 157 -3.612 -12.844 -2.733 1.00 0.17 C ATOM 1045 CD LYS A 157 -5.080 -12.663 -3.117 1.00 0.21 C ATOM 1046 CE LYS A 157 -5.953 -12.285 -1.925 1.00 0.29 C ATOM 1047 NZ LYS A 157 -7.394 -12.228 -2.288 1.00 1.16 N ATOM 0 H LYS A 157 -0.892 -10.369 -3.869 1.00 0.09 H new ATOM 0 HA LYS A 157 -3.200 -11.708 -4.970 1.00 0.10 H new ATOM 0 HB2 LYS A 157 -1.794 -11.726 -2.554 1.00 0.12 H new ATOM 0 HB3 LYS A 157 -3.236 -10.818 -2.148 1.00 0.12 H new ATOM 0 HG2 LYS A 157 -3.160 -13.599 -3.376 1.00 0.17 H new ATOM 0 HG3 LYS A 157 -3.548 -13.216 -1.711 1.00 0.17 H new ATOM 0 HD2 LYS A 157 -5.160 -11.890 -3.881 1.00 0.21 H new ATOM 0 HD3 LYS A 157 -5.453 -13.587 -3.558 1.00 0.21 H new ATOM 0 HE2 LYS A 157 -5.809 -13.011 -1.125 1.00 0.29 H new ATOM 0 HE3 LYS A 157 -5.638 -11.316 -1.537 1.00 0.29 H new ATOM 0 HZ1 LYS A 157 -7.953 -11.968 -1.450 1.00 1.16 H new ATOM 0 HZ2 LYS A 157 -7.536 -11.517 -3.034 1.00 1.16 H new ATOM 0 HZ3 LYS A 157 -7.702 -13.159 -2.634 1.00 1.16 H new ATOM 1061 N MET A 158 -3.425 -8.610 -3.944 1.00 0.07 N ATOM 1062 CA MET A 158 -4.351 -7.485 -3.832 1.00 0.08 C ATOM 1063 C MET A 158 -4.406 -6.639 -5.092 1.00 0.09 C ATOM 1064 O MET A 158 -5.370 -5.904 -5.301 1.00 0.13 O ATOM 1065 CB MET A 158 -4.006 -6.602 -2.635 1.00 0.09 C ATOM 1066 CG MET A 158 -4.247 -7.284 -1.305 1.00 0.10 C ATOM 1067 SD MET A 158 -5.956 -7.829 -1.117 1.00 0.35 S ATOM 1068 CE MET A 158 -6.817 -6.269 -1.293 1.00 0.18 C ATOM 0 H MET A 158 -2.457 -8.393 -3.708 1.00 0.07 H new ATOM 0 HA MET A 158 -5.338 -7.923 -3.685 1.00 0.08 H new ATOM 0 HB2 MET A 158 -2.959 -6.305 -2.700 1.00 0.09 H new ATOM 0 HB3 MET A 158 -4.600 -5.689 -2.681 1.00 0.09 H new ATOM 0 HG2 MET A 158 -3.582 -8.143 -1.213 1.00 0.10 H new ATOM 0 HG3 MET A 158 -3.995 -6.598 -0.496 1.00 0.10 H new ATOM 0 HE1 MET A 158 -7.888 -6.428 -1.166 1.00 0.18 H new ATOM 0 HE2 MET A 158 -6.461 -5.570 -0.536 1.00 0.18 H new ATOM 0 HE3 MET A 158 -6.627 -5.858 -2.284 1.00 0.18 H new ATOM 1078 N ASN A 159 -3.386 -6.722 -5.930 1.00 0.09 N ATOM 1079 CA ASN A 159 -3.392 -5.948 -7.159 1.00 0.10 C ATOM 1080 C ASN A 159 -4.467 -6.488 -8.095 1.00 0.13 C ATOM 1081 O ASN A 159 -4.473 -7.678 -8.422 1.00 0.16 O ATOM 1082 CB ASN A 159 -2.023 -5.993 -7.842 1.00 0.14 C ATOM 1083 CG ASN A 159 -1.933 -5.064 -9.042 1.00 0.16 C ATOM 1084 OD1 ASN A 159 -2.660 -4.076 -9.128 1.00 0.44 O ATOM 1085 ND2 ASN A 159 -1.018 -5.351 -9.960 1.00 0.38 N ATOM 0 H ASN A 159 -2.561 -7.304 -5.787 1.00 0.09 H new ATOM 0 HA ASN A 159 -3.611 -4.908 -6.916 1.00 0.10 H new ATOM 0 HB2 ASN A 159 -1.253 -5.722 -7.120 1.00 0.14 H new ATOM 0 HB3 ASN A 159 -1.815 -7.014 -8.162 1.00 0.14 H new ATOM 0 HD21 ASN A 159 -0.900 -4.743 -10.770 1.00 0.38 H new ATOM 0 HD22 ASN A 159 -0.433 -6.180 -9.855 1.00 0.38 H new ATOM 1092 N GLY A 160 -5.375 -5.620 -8.511 1.00 0.14 N ATOM 1093 CA GLY A 160 -6.447 -6.035 -9.390 1.00 0.19 C ATOM 1094 C GLY A 160 -7.666 -6.537 -8.633 1.00 0.22 C ATOM 1095 O GLY A 160 -8.523 -7.212 -9.205 1.00 0.29 O ATOM 0 H GLY A 160 -5.389 -4.633 -8.255 1.00 0.14 H new ATOM 0 HA2 GLY A 160 -6.737 -5.196 -10.023 1.00 0.19 H new ATOM 0 HA3 GLY A 160 -6.085 -6.823 -10.051 1.00 0.19 H new ATOM 1099 N MET A 161 -7.742 -6.215 -7.346 1.00 0.22 N ATOM 1100 CA MET A 161 -8.869 -6.611 -6.512 1.00 0.27 C ATOM 1101 C MET A 161 -9.847 -5.466 -6.316 1.00 0.24 C ATOM 1102 O MET A 161 -9.505 -4.310 -6.526 1.00 0.23 O ATOM 1103 CB MET A 161 -8.374 -7.075 -5.154 1.00 0.32 C ATOM 1104 CG MET A 161 -7.773 -8.472 -5.128 1.00 0.68 C ATOM 1105 SD MET A 161 -8.947 -9.766 -5.584 1.00 1.18 S ATOM 1106 CE MET A 161 -8.526 -10.040 -7.305 1.00 1.04 C ATOM 0 H MET A 161 -7.029 -5.676 -6.855 1.00 0.22 H new ATOM 0 HA MET A 161 -9.384 -7.425 -7.022 1.00 0.27 H new ATOM 0 HB2 MET A 161 -7.626 -6.368 -4.797 1.00 0.32 H new ATOM 0 HB3 MET A 161 -9.206 -7.041 -4.451 1.00 0.32 H new ATOM 0 HG2 MET A 161 -6.923 -8.507 -5.809 1.00 0.68 H new ATOM 0 HG3 MET A 161 -7.389 -8.676 -4.128 1.00 0.68 H new ATOM 0 HE1 MET A 161 -9.439 -10.151 -7.890 1.00 1.04 H new ATOM 0 HE2 MET A 161 -7.956 -9.190 -7.680 1.00 1.04 H new ATOM 0 HE3 MET A 161 -7.927 -10.946 -7.393 1.00 1.04 H new ATOM 1116 N LEU A 162 -11.051 -5.800 -5.874 1.00 0.26 N ATOM 1117 CA LEU A 162 -12.091 -4.814 -5.644 1.00 0.26 C ATOM 1118 C LEU A 162 -12.243 -4.566 -4.162 1.00 0.28 C ATOM 1119 O LEU A 162 -12.791 -5.396 -3.440 1.00 0.44 O ATOM 1120 CB LEU A 162 -13.447 -5.268 -6.194 1.00 0.31 C ATOM 1121 CG LEU A 162 -13.629 -5.183 -7.708 1.00 0.34 C ATOM 1122 CD1 LEU A 162 -15.043 -5.587 -8.076 1.00 0.42 C ATOM 1123 CD2 LEU A 162 -13.351 -3.779 -8.204 1.00 0.34 C ATOM 0 H LEU A 162 -11.331 -6.758 -5.666 1.00 0.26 H new ATOM 0 HA LEU A 162 -11.789 -3.905 -6.164 1.00 0.26 H new ATOM 0 HB2 LEU A 162 -13.611 -6.301 -5.888 1.00 0.31 H new ATOM 0 HB3 LEU A 162 -14.225 -4.668 -5.722 1.00 0.31 H new ATOM 0 HG LEU A 162 -12.921 -5.863 -8.181 1.00 0.34 H new ATOM 0 HD11 LEU A 162 -15.169 -5.525 -9.157 1.00 0.42 H new ATOM 0 HD12 LEU A 162 -15.226 -6.610 -7.747 1.00 0.42 H new ATOM 0 HD13 LEU A 162 -15.751 -4.917 -7.589 1.00 0.42 H new ATOM 0 HD21 LEU A 162 -13.487 -3.741 -9.285 1.00 0.34 H new ATOM 0 HD22 LEU A 162 -14.040 -3.082 -7.727 1.00 0.34 H new ATOM 0 HD23 LEU A 162 -12.326 -3.502 -7.957 1.00 0.34 H new ATOM 1135 N LEU A 163 -11.756 -3.440 -3.698 1.00 0.25 N ATOM 1136 CA LEU A 163 -11.950 -3.088 -2.316 1.00 0.33 C ATOM 1137 C LEU A 163 -13.197 -2.231 -2.171 1.00 0.45 C ATOM 1138 O LEU A 163 -13.214 -1.069 -2.582 1.00 1.02 O ATOM 1139 CB LEU A 163 -10.720 -2.388 -1.742 1.00 0.29 C ATOM 1140 CG LEU A 163 -9.621 -3.335 -1.265 1.00 0.31 C ATOM 1141 CD1 LEU A 163 -8.403 -2.559 -0.806 1.00 0.31 C ATOM 1142 CD2 LEU A 163 -10.142 -4.218 -0.141 1.00 0.34 C ATOM 0 H LEU A 163 -11.230 -2.762 -4.249 1.00 0.25 H new ATOM 0 HA LEU A 163 -12.091 -4.003 -1.741 1.00 0.33 H new ATOM 0 HB2 LEU A 163 -10.307 -1.725 -2.502 1.00 0.29 H new ATOM 0 HB3 LEU A 163 -11.031 -1.761 -0.906 1.00 0.29 H new ATOM 0 HG LEU A 163 -9.325 -3.968 -2.102 1.00 0.31 H new ATOM 0 HD11 LEU A 163 -7.634 -3.254 -0.471 1.00 0.31 H new ATOM 0 HD12 LEU A 163 -8.018 -1.963 -1.634 1.00 0.31 H new ATOM 0 HD13 LEU A 163 -8.680 -1.900 0.017 1.00 0.31 H new ATOM 0 HD21 LEU A 163 -9.350 -4.889 0.191 1.00 0.34 H new ATOM 0 HD22 LEU A 163 -10.463 -3.594 0.693 1.00 0.34 H new ATOM 0 HD23 LEU A 163 -10.987 -4.804 -0.501 1.00 0.34 H new ATOM 1154 N ASN A 164 -14.249 -2.849 -1.636 1.00 0.41 N ATOM 1155 CA ASN A 164 -15.559 -2.220 -1.449 1.00 0.42 C ATOM 1156 C ASN A 164 -16.317 -2.094 -2.758 1.00 0.45 C ATOM 1157 O ASN A 164 -17.471 -2.511 -2.856 1.00 0.72 O ATOM 1158 CB ASN A 164 -15.462 -0.864 -0.739 1.00 0.49 C ATOM 1159 CG ASN A 164 -15.183 -1.005 0.746 1.00 1.06 C ATOM 1160 OD1 ASN A 164 -15.469 -2.039 1.351 1.00 1.71 O ATOM 1161 ND2 ASN A 164 -14.667 0.050 1.351 1.00 1.07 N ATOM 0 H ASN A 164 -14.216 -3.816 -1.315 1.00 0.41 H new ATOM 0 HA ASN A 164 -16.125 -2.885 -0.797 1.00 0.42 H new ATOM 0 HB2 ASN A 164 -14.671 -0.272 -1.200 1.00 0.49 H new ATOM 0 HB3 ASN A 164 -16.394 -0.316 -0.880 1.00 0.49 H new ATOM 0 HD21 ASN A 164 -14.492 0.027 2.356 1.00 1.07 H new ATOM 0 HD22 ASN A 164 -14.444 0.888 0.814 1.00 1.07 H new ATOM 1168 N ASP A 165 -15.660 -1.535 -3.750 1.00 0.42 N ATOM 1169 CA ASP A 165 -16.236 -1.381 -5.085 1.00 0.44 C ATOM 1170 C ASP A 165 -15.246 -0.729 -6.059 1.00 0.43 C ATOM 1171 O ASP A 165 -15.636 -0.186 -7.088 1.00 0.65 O ATOM 1172 CB ASP A 165 -17.527 -0.550 -5.017 1.00 0.55 C ATOM 1173 CG ASP A 165 -18.344 -0.610 -6.295 1.00 0.71 C ATOM 1174 OD1 ASP A 165 -18.862 -1.699 -6.624 1.00 0.82 O ATOM 1175 OD2 ASP A 165 -18.472 0.428 -6.973 1.00 0.85 O ATOM 0 H ASP A 165 -14.711 -1.172 -3.663 1.00 0.42 H new ATOM 0 HA ASP A 165 -16.467 -2.378 -5.459 1.00 0.44 H new ATOM 0 HB2 ASP A 165 -18.137 -0.905 -4.186 1.00 0.55 H new ATOM 0 HB3 ASP A 165 -17.272 0.488 -4.804 1.00 0.55 H new ATOM 1180 N ARG A 166 -13.957 -0.810 -5.760 1.00 0.32 N ATOM 1181 CA ARG A 166 -12.944 -0.186 -6.604 1.00 0.27 C ATOM 1182 C ARG A 166 -11.752 -1.108 -6.748 1.00 0.24 C ATOM 1183 O ARG A 166 -11.301 -1.702 -5.767 1.00 0.24 O ATOM 1184 CB ARG A 166 -12.500 1.163 -6.033 1.00 0.24 C ATOM 1185 CG ARG A 166 -13.601 2.208 -6.022 1.00 0.27 C ATOM 1186 CD ARG A 166 -13.086 3.563 -5.577 1.00 0.27 C ATOM 1187 NE ARG A 166 -14.172 4.535 -5.461 1.00 0.42 N ATOM 1188 CZ ARG A 166 -14.081 5.696 -4.817 1.00 0.58 C ATOM 1189 NH1 ARG A 166 -12.950 6.055 -4.225 1.00 0.96 N ATOM 1190 NH2 ARG A 166 -15.137 6.496 -4.770 1.00 0.70 N ATOM 0 H ARG A 166 -13.588 -1.299 -4.944 1.00 0.32 H new ATOM 0 HA ARG A 166 -13.383 -0.008 -7.586 1.00 0.27 H new ATOM 0 HB2 ARG A 166 -12.139 1.017 -5.015 1.00 0.24 H new ATOM 0 HB3 ARG A 166 -11.660 1.538 -6.618 1.00 0.24 H new ATOM 0 HG2 ARG A 166 -14.032 2.293 -7.020 1.00 0.27 H new ATOM 0 HG3 ARG A 166 -14.401 1.886 -5.355 1.00 0.27 H new ATOM 0 HD2 ARG A 166 -12.580 3.464 -4.617 1.00 0.27 H new ATOM 0 HD3 ARG A 166 -12.346 3.925 -6.291 1.00 0.27 H new ATOM 0 HE ARG A 166 -15.062 4.307 -5.905 1.00 0.42 H new ATOM 0 HH11 ARG A 166 -12.138 5.439 -4.260 1.00 0.96 H new ATOM 0 HH12 ARG A 166 -12.892 6.947 -3.734 1.00 0.96 H new ATOM 0 HH21 ARG A 166 -16.007 6.219 -5.224 1.00 0.70 H new ATOM 0 HH22 ARG A 166 -15.079 7.388 -4.279 1.00 0.70 H new ATOM 1204 N LYS A 167 -11.254 -1.239 -7.966 1.00 0.22 N ATOM 1205 CA LYS A 167 -10.150 -2.143 -8.235 1.00 0.20 C ATOM 1206 C LYS A 167 -8.839 -1.456 -7.898 1.00 0.17 C ATOM 1207 O LYS A 167 -8.472 -0.462 -8.523 1.00 0.22 O ATOM 1208 CB LYS A 167 -10.163 -2.595 -9.699 1.00 0.23 C ATOM 1209 CG LYS A 167 -9.350 -3.860 -9.946 1.00 0.40 C ATOM 1210 CD LYS A 167 -9.595 -4.451 -11.330 1.00 0.47 C ATOM 1211 CE LYS A 167 -10.669 -5.533 -11.298 1.00 0.53 C ATOM 1212 NZ LYS A 167 -10.766 -6.258 -12.591 1.00 1.00 N ATOM 0 H LYS A 167 -11.596 -0.732 -8.782 1.00 0.22 H new ATOM 0 HA LYS A 167 -10.258 -3.030 -7.611 1.00 0.20 H new ATOM 0 HB2 LYS A 167 -11.193 -2.767 -10.010 1.00 0.23 H new ATOM 0 HB3 LYS A 167 -9.772 -1.792 -10.324 1.00 0.23 H new ATOM 0 HG2 LYS A 167 -8.290 -3.634 -9.834 1.00 0.40 H new ATOM 0 HG3 LYS A 167 -9.600 -4.602 -9.188 1.00 0.40 H new ATOM 0 HD2 LYS A 167 -9.896 -3.659 -12.016 1.00 0.47 H new ATOM 0 HD3 LYS A 167 -8.666 -4.871 -11.716 1.00 0.47 H new ATOM 0 HE2 LYS A 167 -10.446 -6.242 -10.501 1.00 0.53 H new ATOM 0 HE3 LYS A 167 -11.632 -5.081 -11.062 1.00 0.53 H new ATOM 0 HZ1 LYS A 167 -11.507 -6.985 -12.527 1.00 1.00 H new ATOM 0 HZ2 LYS A 167 -11.004 -5.586 -13.349 1.00 1.00 H new ATOM 0 HZ3 LYS A 167 -9.855 -6.711 -12.804 1.00 1.00 H new ATOM 1226 N VAL A 168 -8.117 -2.004 -6.941 1.00 0.13 N ATOM 1227 CA VAL A 168 -6.942 -1.337 -6.419 1.00 0.12 C ATOM 1228 C VAL A 168 -5.673 -1.910 -7.009 1.00 0.11 C ATOM 1229 O VAL A 168 -5.596 -3.093 -7.351 1.00 0.13 O ATOM 1230 CB VAL A 168 -6.847 -1.420 -4.880 1.00 0.13 C ATOM 1231 CG1 VAL A 168 -7.884 -0.529 -4.221 1.00 0.17 C ATOM 1232 CG2 VAL A 168 -6.990 -2.857 -4.396 1.00 0.13 C ATOM 0 H VAL A 168 -8.322 -2.906 -6.511 1.00 0.13 H new ATOM 0 HA VAL A 168 -7.047 -0.291 -6.707 1.00 0.12 H new ATOM 0 HB VAL A 168 -5.858 -1.063 -4.592 1.00 0.13 H new ATOM 0 HG11 VAL A 168 -7.795 -0.607 -3.137 1.00 0.17 H new ATOM 0 HG12 VAL A 168 -7.721 0.505 -4.525 1.00 0.17 H new ATOM 0 HG13 VAL A 168 -8.882 -0.844 -4.526 1.00 0.17 H new ATOM 0 HG21 VAL A 168 -6.919 -2.883 -3.309 1.00 0.13 H new ATOM 0 HG22 VAL A 168 -7.958 -3.251 -4.706 1.00 0.13 H new ATOM 0 HG23 VAL A 168 -6.196 -3.467 -4.826 1.00 0.13 H new ATOM 1242 N PHE A 169 -4.689 -1.045 -7.140 1.00 0.11 N ATOM 1243 CA PHE A 169 -3.399 -1.417 -7.670 1.00 0.12 C ATOM 1244 C PHE A 169 -2.389 -1.466 -6.541 1.00 0.10 C ATOM 1245 O PHE A 169 -2.172 -0.469 -5.860 1.00 0.12 O ATOM 1246 CB PHE A 169 -2.967 -0.405 -8.734 1.00 0.18 C ATOM 1247 CG PHE A 169 -1.554 -0.575 -9.209 1.00 0.14 C ATOM 1248 CD1 PHE A 169 -1.246 -1.486 -10.202 1.00 0.25 C ATOM 1249 CD2 PHE A 169 -0.536 0.181 -8.658 1.00 0.18 C ATOM 1250 CE1 PHE A 169 0.055 -1.643 -10.638 1.00 0.30 C ATOM 1251 CE2 PHE A 169 0.768 0.030 -9.089 1.00 0.23 C ATOM 1252 CZ PHE A 169 1.065 -0.883 -10.080 1.00 0.26 C ATOM 0 H PHE A 169 -4.764 -0.061 -6.880 1.00 0.11 H new ATOM 0 HA PHE A 169 -3.460 -2.402 -8.133 1.00 0.12 H new ATOM 0 HB2 PHE A 169 -3.638 -0.486 -9.589 1.00 0.18 H new ATOM 0 HB3 PHE A 169 -3.084 0.601 -8.331 1.00 0.18 H new ATOM 0 HD1 PHE A 169 -2.032 -2.082 -10.642 1.00 0.25 H new ATOM 0 HD2 PHE A 169 -0.763 0.897 -7.882 1.00 0.18 H new ATOM 0 HE1 PHE A 169 0.283 -2.359 -11.414 1.00 0.30 H new ATOM 0 HE2 PHE A 169 1.554 0.626 -8.650 1.00 0.23 H new ATOM 0 HZ PHE A 169 2.084 -1.003 -10.418 1.00 0.26 H new ATOM 1262 N VAL A 170 -1.787 -2.620 -6.338 1.00 0.09 N ATOM 1263 CA VAL A 170 -0.768 -2.765 -5.316 1.00 0.10 C ATOM 1264 C VAL A 170 0.562 -3.090 -5.971 1.00 0.11 C ATOM 1265 O VAL A 170 0.664 -4.022 -6.771 1.00 0.13 O ATOM 1266 CB VAL A 170 -1.100 -3.873 -4.286 1.00 0.10 C ATOM 1267 CG1 VAL A 170 -0.053 -3.913 -3.185 1.00 0.11 C ATOM 1268 CG2 VAL A 170 -2.484 -3.681 -3.687 1.00 0.09 C ATOM 0 H VAL A 170 -1.984 -3.470 -6.866 1.00 0.09 H new ATOM 0 HA VAL A 170 -0.722 -1.818 -4.778 1.00 0.10 H new ATOM 0 HB VAL A 170 -1.092 -4.826 -4.816 1.00 0.10 H new ATOM 0 HG11 VAL A 170 -0.305 -4.698 -2.472 1.00 0.11 H new ATOM 0 HG12 VAL A 170 0.925 -4.118 -3.620 1.00 0.11 H new ATOM 0 HG13 VAL A 170 -0.027 -2.952 -2.672 1.00 0.11 H new ATOM 0 HG21 VAL A 170 -2.683 -4.476 -2.969 1.00 0.09 H new ATOM 0 HG22 VAL A 170 -2.531 -2.716 -3.182 1.00 0.09 H new ATOM 0 HG23 VAL A 170 -3.231 -3.713 -4.480 1.00 0.09 H new ATOM 1278 N GLY A 171 1.566 -2.300 -5.651 1.00 0.12 N ATOM 1279 CA GLY A 171 2.884 -2.529 -6.188 1.00 0.14 C ATOM 1280 C GLY A 171 3.957 -2.089 -5.227 1.00 0.14 C ATOM 1281 O GLY A 171 3.656 -1.665 -4.107 1.00 0.18 O ATOM 0 H GLY A 171 1.492 -1.498 -5.025 1.00 0.12 H new ATOM 0 HA2 GLY A 171 3.007 -3.589 -6.412 1.00 0.14 H new ATOM 0 HA3 GLY A 171 2.993 -1.989 -7.129 1.00 0.14 H new ATOM 1285 N ARG A 172 5.206 -2.179 -5.660 1.00 0.18 N ATOM 1286 CA ARG A 172 6.334 -1.788 -4.825 1.00 0.19 C ATOM 1287 C ARG A 172 6.229 -0.305 -4.500 1.00 0.22 C ATOM 1288 O ARG A 172 5.803 0.483 -5.344 1.00 0.36 O ATOM 1289 CB ARG A 172 7.667 -2.060 -5.539 1.00 0.23 C ATOM 1290 CG ARG A 172 7.865 -3.500 -6.000 1.00 0.32 C ATOM 1291 CD ARG A 172 8.161 -4.451 -4.852 1.00 0.39 C ATOM 1292 NE ARG A 172 8.006 -5.839 -5.273 1.00 1.03 N ATOM 1293 CZ ARG A 172 8.662 -6.867 -4.748 1.00 1.26 C ATOM 1294 NH1 ARG A 172 9.610 -6.667 -3.838 1.00 1.34 N ATOM 1295 NH2 ARG A 172 8.385 -8.094 -5.161 1.00 1.93 N ATOM 0 H ARG A 172 5.465 -2.520 -6.586 1.00 0.18 H new ATOM 0 HA ARG A 172 6.307 -2.377 -3.908 1.00 0.19 H new ATOM 0 HB2 ARG A 172 7.739 -1.403 -6.406 1.00 0.23 H new ATOM 0 HB3 ARG A 172 8.483 -1.793 -4.868 1.00 0.23 H new ATOM 0 HG2 ARG A 172 6.969 -3.836 -6.522 1.00 0.32 H new ATOM 0 HG3 ARG A 172 8.685 -3.537 -6.717 1.00 0.32 H new ATOM 0 HD2 ARG A 172 9.177 -4.287 -4.492 1.00 0.39 H new ATOM 0 HD3 ARG A 172 7.490 -4.242 -4.019 1.00 0.39 H new ATOM 0 HE ARG A 172 7.346 -6.034 -6.025 1.00 1.03 H new ATOM 0 HH11 ARG A 172 9.838 -5.719 -3.539 1.00 1.34 H new ATOM 0 HH12 ARG A 172 10.110 -7.462 -3.439 1.00 1.34 H new ATOM 0 HH21 ARG A 172 7.673 -8.243 -5.876 1.00 1.93 H new ATOM 0 HH22 ARG A 172 8.883 -8.890 -4.764 1.00 1.93 H new ATOM 1309 N PHE A 173 6.584 0.062 -3.277 1.00 0.23 N ATOM 1310 CA PHE A 173 6.589 1.463 -2.877 1.00 0.29 C ATOM 1311 C PHE A 173 7.509 2.255 -3.800 1.00 0.80 C ATOM 1312 O PHE A 173 8.733 2.150 -3.708 1.00 1.44 O ATOM 1313 CB PHE A 173 7.050 1.597 -1.423 1.00 0.48 C ATOM 1314 CG PHE A 173 6.814 2.956 -0.828 1.00 0.42 C ATOM 1315 CD1 PHE A 173 7.774 3.952 -0.925 1.00 0.72 C ATOM 1316 CD2 PHE A 173 5.632 3.233 -0.165 1.00 0.35 C ATOM 1317 CE1 PHE A 173 7.554 5.199 -0.374 1.00 0.71 C ATOM 1318 CE2 PHE A 173 5.407 4.476 0.389 1.00 0.37 C ATOM 1319 CZ PHE A 173 6.368 5.461 0.285 1.00 0.42 C ATOM 0 H PHE A 173 6.872 -0.588 -2.546 1.00 0.23 H new ATOM 0 HA PHE A 173 5.577 1.861 -2.955 1.00 0.29 H new ATOM 0 HB2 PHE A 173 6.532 0.853 -0.819 1.00 0.48 H new ATOM 0 HB3 PHE A 173 8.114 1.368 -1.368 1.00 0.48 H new ATOM 0 HD1 PHE A 173 8.703 3.750 -1.437 1.00 0.72 H new ATOM 0 HD2 PHE A 173 4.876 2.467 -0.080 1.00 0.35 H new ATOM 0 HE1 PHE A 173 8.308 5.968 -0.458 1.00 0.71 H new ATOM 0 HE2 PHE A 173 4.479 4.678 0.904 1.00 0.37 H new ATOM 0 HZ PHE A 173 6.193 6.435 0.718 1.00 0.42 H new ATOM 1329 N LYS A 174 6.914 3.016 -4.707 1.00 1.17 N ATOM 1330 CA LYS A 174 7.678 3.760 -5.692 1.00 1.67 C ATOM 1331 C LYS A 174 8.474 4.877 -5.033 1.00 1.86 C ATOM 1332 O LYS A 174 7.913 5.776 -4.400 1.00 2.43 O ATOM 1333 CB LYS A 174 6.763 4.309 -6.799 1.00 2.20 C ATOM 1334 CG LYS A 174 5.553 5.081 -6.294 1.00 2.69 C ATOM 1335 CD LYS A 174 4.706 5.596 -7.449 1.00 3.30 C ATOM 1336 CE LYS A 174 3.462 6.325 -6.960 1.00 4.16 C ATOM 1337 NZ LYS A 174 2.643 6.849 -8.087 1.00 4.66 N ATOM 0 H LYS A 174 5.903 3.133 -4.780 1.00 1.17 H new ATOM 0 HA LYS A 174 8.387 3.074 -6.156 1.00 1.67 H new ATOM 0 HB2 LYS A 174 7.349 4.961 -7.447 1.00 2.20 H new ATOM 0 HB3 LYS A 174 6.417 3.477 -7.412 1.00 2.20 H new ATOM 0 HG2 LYS A 174 4.948 4.437 -5.655 1.00 2.69 H new ATOM 0 HG3 LYS A 174 5.883 5.919 -5.680 1.00 2.69 H new ATOM 0 HD2 LYS A 174 5.303 6.269 -8.065 1.00 3.30 H new ATOM 0 HD3 LYS A 174 4.411 4.760 -8.084 1.00 3.30 H new ATOM 0 HE2 LYS A 174 2.858 5.647 -6.358 1.00 4.16 H new ATOM 0 HE3 LYS A 174 3.757 7.150 -6.312 1.00 4.16 H new ATOM 0 HZ1 LYS A 174 1.806 7.338 -7.710 1.00 4.66 H new ATOM 0 HZ2 LYS A 174 3.211 7.516 -8.648 1.00 4.66 H new ATOM 0 HZ3 LYS A 174 2.339 6.059 -8.692 1.00 4.66 H new ATOM 1351 N SER A 175 9.787 4.797 -5.171 1.00 2.06 N ATOM 1352 CA SER A 175 10.679 5.788 -4.608 1.00 2.52 C ATOM 1353 C SER A 175 10.799 6.965 -5.570 1.00 2.93 C ATOM 1354 O SER A 175 11.645 6.964 -6.468 1.00 3.60 O ATOM 1355 CB SER A 175 12.046 5.157 -4.343 1.00 3.15 C ATOM 1356 OG SER A 175 11.915 3.952 -3.601 1.00 3.52 O ATOM 0 H SER A 175 10.259 4.046 -5.674 1.00 2.06 H new ATOM 0 HA SER A 175 10.280 6.152 -3.661 1.00 2.52 H new ATOM 0 HB2 SER A 175 12.546 4.953 -5.290 1.00 3.15 H new ATOM 0 HB3 SER A 175 12.675 5.859 -3.795 1.00 3.15 H new ATOM 0 HG SER A 175 12.802 3.566 -3.445 1.00 3.52 H new ATOM 1362 N ARG A 176 9.938 7.955 -5.387 1.00 3.11 N ATOM 1363 CA ARG A 176 9.822 9.053 -6.333 1.00 3.87 C ATOM 1364 C ARG A 176 10.991 10.026 -6.205 1.00 4.29 C ATOM 1365 O ARG A 176 11.549 10.201 -5.121 1.00 4.77 O ATOM 1366 CB ARG A 176 8.505 9.803 -6.125 1.00 4.45 C ATOM 1367 CG ARG A 176 7.273 8.921 -6.249 1.00 4.94 C ATOM 1368 CD ARG A 176 6.001 9.750 -6.263 1.00 5.64 C ATOM 1369 NE ARG A 176 5.944 10.631 -7.428 1.00 6.15 N ATOM 1370 CZ ARG A 176 4.938 11.461 -7.692 1.00 6.90 C ATOM 1371 NH1 ARG A 176 3.887 11.520 -6.880 1.00 7.24 N ATOM 1372 NH2 ARG A 176 4.980 12.224 -8.777 1.00 7.60 N ATOM 0 H ARG A 176 9.307 8.020 -4.588 1.00 3.11 H new ATOM 0 HA ARG A 176 9.840 8.624 -7.335 1.00 3.87 H new ATOM 0 HB2 ARG A 176 8.512 10.265 -5.138 1.00 4.45 H new ATOM 0 HB3 ARG A 176 8.438 10.610 -6.854 1.00 4.45 H new ATOM 0 HG2 ARG A 176 7.336 8.331 -7.164 1.00 4.94 H new ATOM 0 HG3 ARG A 176 7.242 8.217 -5.417 1.00 4.94 H new ATOM 0 HD2 ARG A 176 5.135 9.088 -6.264 1.00 5.64 H new ATOM 0 HD3 ARG A 176 5.945 10.346 -5.352 1.00 5.64 H new ATOM 0 HE ARG A 176 6.727 10.608 -8.082 1.00 6.15 H new ATOM 0 HH11 ARG A 176 3.849 10.928 -6.051 1.00 7.24 H new ATOM 0 HH12 ARG A 176 3.118 12.158 -7.086 1.00 7.24 H new ATOM 0 HH21 ARG A 176 5.782 12.173 -9.406 1.00 7.60 H new ATOM 0 HH22 ARG A 176 4.211 12.861 -8.982 1.00 7.60 H new ATOM 1386 N LYS A 177 11.354 10.653 -7.317 1.00 4.61 N ATOM 1387 CA LYS A 177 12.422 11.644 -7.334 1.00 5.47 C ATOM 1388 C LYS A 177 12.241 12.551 -8.551 1.00 6.20 C ATOM 1389 O LYS A 177 13.176 13.207 -9.010 1.00 6.81 O ATOM 1390 CB LYS A 177 13.789 10.954 -7.383 1.00 5.99 C ATOM 1391 CG LYS A 177 14.954 11.893 -7.114 1.00 6.65 C ATOM 1392 CD LYS A 177 16.284 11.256 -7.489 1.00 7.44 C ATOM 1393 CE LYS A 177 17.433 12.246 -7.367 1.00 7.99 C ATOM 1394 NZ LYS A 177 18.694 11.695 -7.923 1.00 8.61 N ATOM 0 H LYS A 177 10.920 10.491 -8.226 1.00 4.61 H new ATOM 0 HA LYS A 177 12.376 12.243 -6.424 1.00 5.47 H new ATOM 0 HB2 LYS A 177 13.806 10.148 -6.650 1.00 5.99 H new ATOM 0 HB3 LYS A 177 13.921 10.496 -8.363 1.00 5.99 H new ATOM 0 HG2 LYS A 177 14.818 12.814 -7.681 1.00 6.65 H new ATOM 0 HG3 LYS A 177 14.965 12.167 -6.059 1.00 6.65 H new ATOM 0 HD2 LYS A 177 16.472 10.398 -6.844 1.00 7.44 H new ATOM 0 HD3 LYS A 177 16.233 10.881 -8.511 1.00 7.44 H new ATOM 0 HE2 LYS A 177 17.177 13.167 -7.890 1.00 7.99 H new ATOM 0 HE3 LYS A 177 17.580 12.505 -6.319 1.00 7.99 H new ATOM 0 HZ1 LYS A 177 19.454 12.398 -7.822 1.00 8.61 H new ATOM 0 HZ2 LYS A 177 18.952 10.830 -7.407 1.00 8.61 H new ATOM 0 HZ3 LYS A 177 18.561 11.471 -8.930 1.00 8.61 H new ATOM 1408 N GLU A 178 11.019 12.572 -9.064 1.00 6.45 N ATOM 1409 CA GLU A 178 10.689 13.333 -10.261 1.00 7.43 C ATOM 1410 C GLU A 178 10.965 14.821 -10.053 1.00 7.96 C ATOM 1411 O GLU A 178 10.314 15.476 -9.237 1.00 8.13 O ATOM 1412 CB GLU A 178 9.219 13.119 -10.645 1.00 7.79 C ATOM 1413 CG GLU A 178 8.881 11.696 -11.084 1.00 8.26 C ATOM 1414 CD GLU A 178 8.842 10.700 -9.940 1.00 8.30 C ATOM 1415 OE1 GLU A 178 9.901 10.129 -9.603 1.00 8.32 O ATOM 1416 OE2 GLU A 178 7.752 10.481 -9.373 1.00 8.55 O ATOM 0 H GLU A 178 10.230 12.064 -8.664 1.00 6.45 H new ATOM 0 HA GLU A 178 11.321 12.975 -11.073 1.00 7.43 H new ATOM 0 HB2 GLU A 178 8.592 13.382 -9.793 1.00 7.79 H new ATOM 0 HB3 GLU A 178 8.964 13.805 -11.452 1.00 7.79 H new ATOM 0 HG2 GLU A 178 7.913 11.700 -11.585 1.00 8.26 H new ATOM 0 HG3 GLU A 178 9.618 11.366 -11.817 1.00 8.26 H new ATOM 1423 N ARG A 179 11.943 15.346 -10.780 1.00 8.49 N ATOM 1424 CA ARG A 179 12.306 16.746 -10.666 1.00 9.26 C ATOM 1425 C ARG A 179 11.736 17.529 -11.842 1.00 10.11 C ATOM 1426 O ARG A 179 10.594 17.984 -11.807 1.00 10.52 O ATOM 1427 CB ARG A 179 13.831 16.903 -10.629 1.00 9.63 C ATOM 1428 CG ARG A 179 14.544 16.072 -9.565 1.00 10.21 C ATOM 1429 CD ARG A 179 14.086 16.412 -8.153 1.00 10.71 C ATOM 1430 NE ARG A 179 13.981 17.854 -7.945 1.00 11.04 N ATOM 1431 CZ ARG A 179 13.063 18.427 -7.166 1.00 11.73 C ATOM 1432 NH1 ARG A 179 12.194 17.679 -6.497 1.00 12.15 N ATOM 1433 NH2 ARG A 179 13.020 19.747 -7.053 1.00 12.18 N ATOM 0 H ARG A 179 12.498 14.820 -11.455 1.00 8.49 H new ATOM 0 HA ARG A 179 11.890 17.138 -9.738 1.00 9.26 H new ATOM 0 HB2 ARG A 179 14.232 16.634 -11.606 1.00 9.63 H new ATOM 0 HB3 ARG A 179 14.068 17.954 -10.466 1.00 9.63 H new ATOM 0 HG2 ARG A 179 14.366 15.014 -9.756 1.00 10.21 H new ATOM 0 HG3 ARG A 179 15.619 16.233 -9.643 1.00 10.21 H new ATOM 0 HD2 ARG A 179 13.119 15.947 -7.964 1.00 10.71 H new ATOM 0 HD3 ARG A 179 14.788 15.992 -7.433 1.00 10.71 H new ATOM 0 HE ARG A 179 14.649 18.458 -8.424 1.00 11.04 H new ATOM 0 HH11 ARG A 179 12.227 16.663 -6.578 1.00 12.15 H new ATOM 0 HH12 ARG A 179 11.493 18.121 -5.902 1.00 12.15 H new ATOM 0 HH21 ARG A 179 13.689 20.325 -7.562 1.00 12.18 H new ATOM 0 HH22 ARG A 179 12.318 20.185 -6.457 1.00 12.18 H new ATOM 1447 N GLU A 180 12.534 17.653 -12.889 1.00 10.55 N ATOM 1448 CA GLU A 180 12.128 18.341 -14.102 1.00 11.52 C ATOM 1449 C GLU A 180 12.970 17.822 -15.259 1.00 12.20 C ATOM 1450 O GLU A 180 14.191 17.973 -15.250 1.00 12.70 O ATOM 1451 CB GLU A 180 12.295 19.854 -13.944 1.00 11.80 C ATOM 1452 CG GLU A 180 11.831 20.651 -15.151 1.00 12.14 C ATOM 1453 CD GLU A 180 11.918 22.144 -14.924 1.00 12.44 C ATOM 1454 OE1 GLU A 180 13.017 22.714 -15.092 1.00 12.64 O ATOM 1455 OE2 GLU A 180 10.889 22.758 -14.574 1.00 12.62 O ATOM 0 H GLU A 180 13.482 17.279 -12.922 1.00 10.55 H new ATOM 0 HA GLU A 180 11.074 18.146 -14.301 1.00 11.52 H new ATOM 0 HB2 GLU A 180 11.737 20.182 -13.067 1.00 11.80 H new ATOM 0 HB3 GLU A 180 13.345 20.077 -13.755 1.00 11.80 H new ATOM 0 HG2 GLU A 180 12.437 20.382 -16.016 1.00 12.14 H new ATOM 0 HG3 GLU A 180 10.802 20.381 -15.387 1.00 12.14 H new ATOM 1462 N ALA A 181 12.312 17.182 -16.227 1.00 12.41 N ATOM 1463 CA ALA A 181 13.006 16.482 -17.319 1.00 13.20 C ATOM 1464 C ALA A 181 13.896 15.371 -16.763 1.00 13.42 C ATOM 1465 O ALA A 181 14.826 14.905 -17.423 1.00 13.65 O ATOM 1466 CB ALA A 181 13.817 17.458 -18.162 1.00 13.56 C ATOM 0 H ALA A 181 11.295 17.132 -16.280 1.00 12.41 H new ATOM 0 HA ALA A 181 12.255 16.027 -17.965 1.00 13.20 H new ATOM 0 HB1 ALA A 181 14.321 16.916 -18.963 1.00 13.56 H new ATOM 0 HB2 ALA A 181 13.152 18.206 -18.593 1.00 13.56 H new ATOM 0 HB3 ALA A 181 14.560 17.951 -17.535 1.00 13.56 H new ATOM 1472 N GLU A 182 13.571 14.933 -15.556 1.00 13.52 N ATOM 1473 CA GLU A 182 14.328 13.908 -14.862 1.00 13.92 C ATOM 1474 C GLU A 182 13.384 13.117 -13.963 1.00 14.43 C ATOM 1475 O GLU A 182 13.185 11.908 -14.213 1.00 15.05 O ATOM 1476 CB GLU A 182 15.448 14.542 -14.026 1.00 13.77 C ATOM 1477 CG GLU A 182 16.391 13.529 -13.392 1.00 14.19 C ATOM 1478 CD GLU A 182 17.329 14.153 -12.376 1.00 14.38 C ATOM 1479 OE1 GLU A 182 16.917 14.312 -11.207 1.00 14.46 O ATOM 1480 OE2 GLU A 182 18.484 14.465 -12.730 1.00 14.58 O ATOM 1481 OXT GLU A 182 12.793 13.729 -13.045 1.00 14.36 O ATOM 0 H GLU A 182 12.770 15.282 -15.030 1.00 13.52 H new ATOM 0 HA GLU A 182 14.785 13.240 -15.592 1.00 13.92 H new ATOM 0 HB2 GLU A 182 16.026 15.215 -14.660 1.00 13.77 H new ATOM 0 HB3 GLU A 182 15.001 15.150 -13.240 1.00 13.77 H new ATOM 0 HG2 GLU A 182 15.805 12.748 -12.907 1.00 14.19 H new ATOM 0 HG3 GLU A 182 16.978 13.047 -14.174 1.00 14.19 H new TER 1488 GLU A 182