USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=19 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= -6.77! C(o=-9.2!,f=-8.6!) USER MOD Set 1.2: A 144 HIS : no HD1:sc= -2.48 K(o=-9.2,f=-11) USER MOD Set 2.1: A 116 TYR OH : rot 180:sc= 0.0025 USER MOD Set 2.2: A 120 SER OG : rot 142:sc= 0.378 USER MOD Set 3.1: A 109 SER OG : rot -83:sc= 1.21 USER MOD Set 3.2: A 164 ASN : amide:sc= -0.0811 K(o=1.1,f=-0.57!) USER MOD Single : A 92 SER OG : rot -10:sc= 1.02 USER MOD Single : A 95 LYS NZ :NH3+ 168:sc= 1.27 (180deg=1.19) USER MOD Single : A 96 SER OG : rot 128:sc= -1.06 USER MOD Single : A 104 LYS NZ :NH3+ -148:sc= -0.908 (180deg=-2.52!) USER MOD Single : A 105 ASN : amide:sc= 1.09 K(o=1.1,f=-0.95) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0.331 K(o=0.33,f=-7.6!) USER MOD Single : A 113 LYS NZ :NH3+ -156:sc= -0.355 (180deg=-1.53!) USER MOD Single : A 118 THR OG1 : rot 78:sc= 0.676 USER MOD Single : A 124 ASN : amide:sc= 1.12 K(o=1.1,f=-1.2) USER MOD Single : A 127 SER OG : rot 180:sc= -0.0543 USER MOD Single : A 128 CYS SG : rot 127:sc= -3.26! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 CYS SG : rot 180:sc= 0.059 USER MOD Single : A 135 ASN : amide:sc= 1.18 K(o=1.2,f=-0.07) USER MOD Single : A 137 SER OG : rot 180:sc= 0.0786 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= -0.0755 USER MOD Single : A 148 GLN : amide:sc= -0.721 K(o=-0.72,f=-1.3) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 MET CE :methyl -168:sc= -0.237 (180deg=-0.725) USER MOD Single : A 159 ASN : amide:sc= -1.54 K(o=-1.5,f=-6.4!) USER MOD Single : A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ -153:sc= -1.94! (180deg=-3.68!) USER MOD Single : A 175 SER OG : rot -149:sc= 0.328 USER MOD Single : A 177 LYS NZ :NH3+ 155:sc= 0.872 (180deg=0.778) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 88 13.876 -12.291 -2.145 1.00 14.85 N ATOM 2 CA GLY A 88 14.167 -13.476 -2.988 1.00 14.52 C ATOM 3 C GLY A 88 14.345 -13.108 -4.445 1.00 14.06 C ATOM 4 O GLY A 88 15.348 -13.455 -5.064 1.00 14.34 O ATOM 0 HA2 GLY A 88 15.071 -13.965 -2.625 1.00 14.52 H new ATOM 0 HA3 GLY A 88 13.354 -14.196 -2.893 1.00 14.52 H new ATOM 10 N ALA A 89 13.375 -12.391 -4.994 1.00 13.50 N ATOM 11 CA ALA A 89 13.448 -11.938 -6.378 1.00 13.18 C ATOM 12 C ALA A 89 13.961 -10.502 -6.431 1.00 12.18 C ATOM 13 O ALA A 89 13.712 -9.763 -7.385 1.00 12.38 O ATOM 14 CB ALA A 89 12.082 -12.049 -7.035 1.00 13.38 C ATOM 0 H ALA A 89 12.527 -12.110 -4.503 1.00 13.50 H new ATOM 0 HA ALA A 89 14.145 -12.572 -6.926 1.00 13.18 H new ATOM 0 HB1 ALA A 89 12.147 -11.708 -8.068 1.00 13.38 H new ATOM 0 HB2 ALA A 89 11.752 -13.088 -7.015 1.00 13.38 H new ATOM 0 HB3 ALA A 89 11.366 -11.431 -6.493 1.00 13.38 H new ATOM 20 N ASP A 90 14.695 -10.125 -5.400 1.00 11.25 N ATOM 21 CA ASP A 90 15.199 -8.770 -5.261 1.00 10.32 C ATOM 22 C ASP A 90 16.675 -8.690 -5.640 1.00 10.04 C ATOM 23 O ASP A 90 17.488 -9.493 -5.184 1.00 9.96 O ATOM 24 CB ASP A 90 15.001 -8.283 -3.818 1.00 9.53 C ATOM 25 CG ASP A 90 15.782 -9.098 -2.796 1.00 9.74 C ATOM 26 OD1 ASP A 90 15.576 -10.332 -2.725 1.00 9.92 O ATOM 27 OD2 ASP A 90 16.583 -8.507 -2.045 1.00 9.91 O ATOM 0 H ASP A 90 14.958 -10.748 -4.636 1.00 11.25 H new ATOM 0 HA ASP A 90 14.639 -8.127 -5.940 1.00 10.32 H new ATOM 0 HB2 ASP A 90 15.305 -7.239 -3.749 1.00 9.53 H new ATOM 0 HB3 ASP A 90 13.940 -8.323 -3.571 1.00 9.53 H new ATOM 32 N PRO A 91 17.032 -7.745 -6.519 1.00 10.16 N ATOM 33 CA PRO A 91 18.429 -7.437 -6.811 1.00 10.16 C ATOM 34 C PRO A 91 19.059 -6.676 -5.649 1.00 9.18 C ATOM 35 O PRO A 91 19.952 -7.182 -4.965 1.00 9.15 O ATOM 36 CB PRO A 91 18.365 -6.554 -8.069 1.00 10.77 C ATOM 37 CG PRO A 91 16.944 -6.611 -8.534 1.00 11.14 C ATOM 38 CD PRO A 91 16.117 -6.924 -7.320 1.00 10.63 C ATOM 0 HA PRO A 91 19.036 -8.330 -6.960 1.00 10.16 H new ATOM 0 HB2 PRO A 91 18.662 -5.530 -7.844 1.00 10.77 H new ATOM 0 HB3 PRO A 91 19.044 -6.921 -8.839 1.00 10.77 H new ATOM 0 HG2 PRO A 91 16.641 -5.662 -8.977 1.00 11.14 H new ATOM 0 HG3 PRO A 91 16.816 -7.376 -9.300 1.00 11.14 H new ATOM 0 HD2 PRO A 91 15.813 -6.020 -6.791 1.00 10.63 H new ATOM 0 HD3 PRO A 91 15.206 -7.464 -7.577 1.00 10.63 H new ATOM 46 N SER A 92 18.578 -5.460 -5.435 1.00 8.61 N ATOM 47 CA SER A 92 18.956 -4.654 -4.282 1.00 7.83 C ATOM 48 C SER A 92 17.862 -3.624 -4.004 1.00 6.91 C ATOM 49 O SER A 92 17.869 -2.526 -4.565 1.00 6.95 O ATOM 50 CB SER A 92 20.302 -3.954 -4.515 1.00 8.48 C ATOM 51 OG SER A 92 21.335 -4.900 -4.732 1.00 9.30 O ATOM 0 H SER A 92 17.912 -5.003 -6.058 1.00 8.61 H new ATOM 0 HA SER A 92 19.068 -5.309 -3.418 1.00 7.83 H new ATOM 0 HB2 SER A 92 20.226 -3.289 -5.375 1.00 8.48 H new ATOM 0 HB3 SER A 92 20.547 -3.333 -3.653 1.00 8.48 H new ATOM 0 HG SER A 92 21.001 -5.800 -4.533 1.00 9.30 H new ATOM 57 N LEU A 93 16.896 -3.996 -3.174 1.00 6.42 N ATOM 58 CA LEU A 93 15.787 -3.107 -2.858 1.00 5.85 C ATOM 59 C LEU A 93 16.231 -2.050 -1.854 1.00 4.94 C ATOM 60 O LEU A 93 16.800 -2.386 -0.815 1.00 5.05 O ATOM 61 CB LEU A 93 14.599 -3.889 -2.285 1.00 6.31 C ATOM 62 CG LEU A 93 13.957 -4.905 -3.231 1.00 7.36 C ATOM 63 CD1 LEU A 93 12.775 -5.590 -2.542 1.00 7.82 C ATOM 64 CD2 LEU A 93 13.496 -4.220 -4.512 1.00 7.89 C ATOM 0 H LEU A 93 16.858 -4.903 -2.710 1.00 6.42 H new ATOM 0 HA LEU A 93 15.472 -2.623 -3.782 1.00 5.85 H new ATOM 0 HB2 LEU A 93 14.931 -4.413 -1.389 1.00 6.31 H new ATOM 0 HB3 LEU A 93 13.835 -3.177 -1.973 1.00 6.31 H new ATOM 0 HG LEU A 93 14.700 -5.660 -3.490 1.00 7.36 H new ATOM 0 HD11 LEU A 93 12.325 -6.311 -3.224 1.00 7.82 H new ATOM 0 HD12 LEU A 93 13.124 -6.105 -1.647 1.00 7.82 H new ATOM 0 HD13 LEU A 93 12.033 -4.842 -2.263 1.00 7.82 H new ATOM 0 HD21 LEU A 93 13.041 -4.956 -5.175 1.00 7.89 H new ATOM 0 HD22 LEU A 93 12.764 -3.449 -4.269 1.00 7.89 H new ATOM 0 HD23 LEU A 93 14.352 -3.764 -5.009 1.00 7.89 H new ATOM 76 N ARG A 94 15.981 -0.780 -2.151 1.00 4.45 N ATOM 77 CA ARG A 94 16.344 0.289 -1.236 1.00 3.96 C ATOM 78 C ARG A 94 15.099 0.867 -0.581 1.00 3.05 C ATOM 79 O ARG A 94 15.053 2.042 -0.215 1.00 3.26 O ATOM 80 CB ARG A 94 17.148 1.369 -1.962 1.00 4.35 C ATOM 81 CG ARG A 94 18.404 0.812 -2.610 1.00 5.15 C ATOM 82 CD ARG A 94 19.368 1.898 -3.060 1.00 5.75 C ATOM 83 NE ARG A 94 20.496 1.323 -3.787 1.00 6.33 N ATOM 84 CZ ARG A 94 21.593 0.841 -3.203 1.00 7.04 C ATOM 85 NH1 ARG A 94 21.771 0.977 -1.894 1.00 7.28 N ATOM 86 NH2 ARG A 94 22.518 0.237 -3.933 1.00 7.78 N ATOM 0 H ARG A 94 15.532 -0.469 -3.012 1.00 4.45 H new ATOM 0 HA ARG A 94 16.978 -0.120 -0.449 1.00 3.96 H new ATOM 0 HB2 ARG A 94 16.523 1.833 -2.725 1.00 4.35 H new ATOM 0 HB3 ARG A 94 17.423 2.152 -1.255 1.00 4.35 H new ATOM 0 HG2 ARG A 94 18.910 0.154 -1.904 1.00 5.15 H new ATOM 0 HG3 ARG A 94 18.124 0.203 -3.469 1.00 5.15 H new ATOM 0 HD2 ARG A 94 18.846 2.613 -3.696 1.00 5.75 H new ATOM 0 HD3 ARG A 94 19.732 2.449 -2.193 1.00 5.75 H new ATOM 0 HE ARG A 94 20.441 1.288 -4.805 1.00 6.33 H new ATOM 0 HH11 ARG A 94 21.066 1.452 -1.330 1.00 7.28 H new ATOM 0 HH12 ARG A 94 22.612 0.606 -1.452 1.00 7.28 H new ATOM 0 HH21 ARG A 94 22.390 0.141 -4.940 1.00 7.78 H new ATOM 0 HH22 ARG A 94 23.358 -0.132 -3.488 1.00 7.78 H new ATOM 100 N LYS A 95 14.082 0.023 -0.446 1.00 2.37 N ATOM 101 CA LYS A 95 12.902 0.357 0.336 1.00 1.60 C ATOM 102 C LYS A 95 13.234 0.162 1.821 1.00 1.26 C ATOM 103 O LYS A 95 12.910 -0.881 2.390 1.00 1.52 O ATOM 104 CB LYS A 95 11.707 -0.534 -0.039 1.00 1.56 C ATOM 105 CG LYS A 95 11.176 -0.338 -1.457 1.00 1.15 C ATOM 106 CD LYS A 95 11.995 -1.101 -2.490 1.00 1.36 C ATOM 107 CE LYS A 95 11.327 -1.084 -3.862 1.00 1.24 C ATOM 108 NZ LYS A 95 11.332 0.269 -4.481 1.00 1.91 N ATOM 0 H LYS A 95 14.054 -0.903 -0.872 1.00 2.37 H new ATOM 0 HA LYS A 95 12.626 1.391 0.130 1.00 1.60 H new ATOM 0 HB2 LYS A 95 11.999 -1.577 0.083 1.00 1.56 H new ATOM 0 HB3 LYS A 95 10.897 -0.345 0.666 1.00 1.56 H new ATOM 0 HG2 LYS A 95 10.138 -0.668 -1.503 1.00 1.15 H new ATOM 0 HG3 LYS A 95 11.184 0.724 -1.702 1.00 1.15 H new ATOM 0 HD2 LYS A 95 12.989 -0.661 -2.564 1.00 1.36 H new ATOM 0 HD3 LYS A 95 12.126 -2.132 -2.162 1.00 1.36 H new ATOM 0 HE2 LYS A 95 11.841 -1.784 -4.521 1.00 1.24 H new ATOM 0 HE3 LYS A 95 10.299 -1.433 -3.766 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 11.057 0.194 -5.481 1.00 1.91 H new ATOM 0 HZ2 LYS A 95 10.657 0.882 -3.981 1.00 1.91 H new ATOM 0 HZ3 LYS A 95 12.286 0.678 -4.414 1.00 1.91 H new ATOM 122 N SER A 96 13.910 1.140 2.435 1.00 1.02 N ATOM 123 CA SER A 96 14.447 0.990 3.782 1.00 0.93 C ATOM 124 C SER A 96 13.363 0.730 4.831 1.00 0.89 C ATOM 125 O SER A 96 13.660 0.269 5.934 1.00 1.75 O ATOM 126 CB SER A 96 15.234 2.246 4.139 1.00 1.13 C ATOM 127 OG SER A 96 16.017 2.678 3.034 1.00 1.79 O ATOM 0 H SER A 96 14.096 2.049 2.012 1.00 1.02 H new ATOM 0 HA SER A 96 15.096 0.114 3.787 1.00 0.93 H new ATOM 0 HB2 SER A 96 14.548 3.039 4.437 1.00 1.13 H new ATOM 0 HB3 SER A 96 15.881 2.046 4.993 1.00 1.13 H new ATOM 0 HG SER A 96 15.838 3.625 2.857 1.00 1.79 H new ATOM 133 N GLY A 97 12.113 1.034 4.497 1.00 0.44 N ATOM 134 CA GLY A 97 11.018 0.731 5.400 1.00 0.29 C ATOM 135 C GLY A 97 10.782 -0.772 5.520 1.00 0.27 C ATOM 136 O GLY A 97 10.296 -1.242 6.546 1.00 0.36 O ATOM 0 H GLY A 97 11.840 1.482 3.622 1.00 0.44 H new ATOM 0 HA2 GLY A 97 11.234 1.145 6.385 1.00 0.29 H new ATOM 0 HA3 GLY A 97 10.108 1.214 5.044 1.00 0.29 H new ATOM 140 N VAL A 98 11.159 -1.516 4.470 1.00 0.29 N ATOM 141 CA VAL A 98 10.935 -2.969 4.376 1.00 0.33 C ATOM 142 C VAL A 98 9.458 -3.319 4.298 1.00 0.25 C ATOM 143 O VAL A 98 8.668 -2.926 5.149 1.00 0.27 O ATOM 144 CB VAL A 98 11.553 -3.761 5.541 1.00 0.49 C ATOM 145 CG1 VAL A 98 11.073 -5.205 5.507 1.00 0.47 C ATOM 146 CG2 VAL A 98 13.060 -3.723 5.479 1.00 0.71 C ATOM 0 H VAL A 98 11.632 -1.125 3.655 1.00 0.29 H new ATOM 0 HA VAL A 98 11.436 -3.258 3.452 1.00 0.33 H new ATOM 0 HB VAL A 98 11.233 -3.297 6.474 1.00 0.49 H new ATOM 0 HG11 VAL A 98 11.517 -5.756 6.336 1.00 0.47 H new ATOM 0 HG12 VAL A 98 9.987 -5.230 5.595 1.00 0.47 H new ATOM 0 HG13 VAL A 98 11.371 -5.665 4.565 1.00 0.47 H new ATOM 0 HG21 VAL A 98 13.473 -4.290 6.313 1.00 0.71 H new ATOM 0 HG22 VAL A 98 13.397 -4.162 4.540 1.00 0.71 H new ATOM 0 HG23 VAL A 98 13.401 -2.689 5.539 1.00 0.71 H new ATOM 156 N GLY A 99 9.086 -4.071 3.278 1.00 0.21 N ATOM 157 CA GLY A 99 7.715 -4.509 3.172 1.00 0.20 C ATOM 158 C GLY A 99 6.799 -3.371 2.793 1.00 0.15 C ATOM 159 O GLY A 99 5.607 -3.390 3.083 1.00 0.18 O ATOM 0 H GLY A 99 9.703 -4.384 2.528 1.00 0.21 H new ATOM 0 HA2 GLY A 99 7.641 -5.301 2.426 1.00 0.20 H new ATOM 0 HA3 GLY A 99 7.394 -4.935 4.122 1.00 0.20 H new ATOM 163 N ASN A 100 7.375 -2.366 2.160 1.00 0.13 N ATOM 164 CA ASN A 100 6.650 -1.151 1.826 1.00 0.14 C ATOM 165 C ASN A 100 5.984 -1.329 0.468 1.00 0.14 C ATOM 166 O ASN A 100 6.652 -1.676 -0.511 1.00 0.19 O ATOM 167 CB ASN A 100 7.645 0.013 1.777 1.00 0.21 C ATOM 168 CG ASN A 100 8.177 0.401 3.141 1.00 0.28 C ATOM 169 OD1 ASN A 100 8.677 1.510 3.323 1.00 0.63 O ATOM 170 ND2 ASN A 100 8.041 -0.488 4.121 1.00 0.20 N ATOM 0 H ASN A 100 8.351 -2.367 1.864 1.00 0.13 H new ATOM 0 HA ASN A 100 5.884 -0.943 2.573 1.00 0.14 H new ATOM 0 HB2 ASN A 100 8.481 -0.259 1.132 1.00 0.21 H new ATOM 0 HB3 ASN A 100 7.161 0.878 1.324 1.00 0.21 H new ATOM 0 HD21 ASN A 100 8.357 -0.260 5.064 1.00 0.20 H new ATOM 0 HD22 ASN A 100 7.621 -1.398 3.930 1.00 0.20 H new ATOM 177 N ILE A 101 4.682 -1.106 0.409 1.00 0.12 N ATOM 178 CA ILE A 101 3.945 -1.165 -0.849 1.00 0.13 C ATOM 179 C ILE A 101 2.997 0.016 -0.954 1.00 0.12 C ATOM 180 O ILE A 101 2.685 0.653 0.055 1.00 0.15 O ATOM 181 CB ILE A 101 3.143 -2.478 -1.000 1.00 0.13 C ATOM 182 CG1 ILE A 101 2.124 -2.624 0.133 1.00 0.11 C ATOM 183 CG2 ILE A 101 4.081 -3.673 -1.041 1.00 0.15 C ATOM 184 CD1 ILE A 101 1.334 -3.914 0.082 1.00 0.13 C ATOM 0 H ILE A 101 4.108 -0.881 1.221 1.00 0.12 H new ATOM 0 HA ILE A 101 4.682 -1.129 -1.652 1.00 0.13 H new ATOM 0 HB ILE A 101 2.596 -2.440 -1.942 1.00 0.13 H new ATOM 0 HG12 ILE A 101 2.646 -2.566 1.088 1.00 0.11 H new ATOM 0 HG13 ILE A 101 1.431 -1.783 0.097 1.00 0.11 H new ATOM 0 HG21 ILE A 101 3.499 -4.589 -1.148 1.00 0.15 H new ATOM 0 HG22 ILE A 101 4.760 -3.574 -1.888 1.00 0.15 H new ATOM 0 HG23 ILE A 101 4.657 -3.715 -0.117 1.00 0.15 H new ATOM 0 HD11 ILE A 101 0.633 -3.945 0.916 1.00 0.13 H new ATOM 0 HD12 ILE A 101 0.783 -3.966 -0.857 1.00 0.13 H new ATOM 0 HD13 ILE A 101 2.016 -4.761 0.150 1.00 0.13 H new ATOM 196 N PHE A 102 2.532 0.306 -2.158 1.00 0.11 N ATOM 197 CA PHE A 102 1.571 1.378 -2.347 1.00 0.11 C ATOM 198 C PHE A 102 0.353 0.859 -3.106 1.00 0.09 C ATOM 199 O PHE A 102 0.477 0.038 -4.019 1.00 0.11 O ATOM 200 CB PHE A 102 2.228 2.580 -3.051 1.00 0.16 C ATOM 201 CG PHE A 102 1.819 2.798 -4.481 1.00 0.13 C ATOM 202 CD1 PHE A 102 0.687 3.540 -4.781 1.00 0.14 C ATOM 203 CD2 PHE A 102 2.573 2.280 -5.519 1.00 0.17 C ATOM 204 CE1 PHE A 102 0.312 3.756 -6.089 1.00 0.17 C ATOM 205 CE2 PHE A 102 2.206 2.495 -6.831 1.00 0.21 C ATOM 206 CZ PHE A 102 1.073 3.232 -7.118 1.00 0.20 C ATOM 0 H PHE A 102 2.802 -0.182 -3.012 1.00 0.11 H new ATOM 0 HA PHE A 102 1.228 1.730 -1.374 1.00 0.11 H new ATOM 0 HB2 PHE A 102 1.996 3.482 -2.484 1.00 0.16 H new ATOM 0 HB3 PHE A 102 3.310 2.451 -3.017 1.00 0.16 H new ATOM 0 HD1 PHE A 102 0.092 3.954 -3.980 1.00 0.14 H new ATOM 0 HD2 PHE A 102 3.458 1.701 -5.300 1.00 0.17 H new ATOM 0 HE1 PHE A 102 -0.574 4.333 -6.310 1.00 0.17 H new ATOM 0 HE2 PHE A 102 2.804 2.088 -7.633 1.00 0.21 H new ATOM 0 HZ PHE A 102 0.782 3.399 -8.145 1.00 0.20 H new ATOM 216 N ILE A 103 -0.816 1.320 -2.695 1.00 0.08 N ATOM 217 CA ILE A 103 -2.078 0.882 -3.268 1.00 0.08 C ATOM 218 C ILE A 103 -2.764 2.046 -3.970 1.00 0.08 C ATOM 219 O ILE A 103 -2.730 3.170 -3.480 1.00 0.15 O ATOM 220 CB ILE A 103 -3.012 0.339 -2.170 1.00 0.08 C ATOM 221 CG1 ILE A 103 -2.296 -0.722 -1.338 1.00 0.08 C ATOM 222 CG2 ILE A 103 -4.279 -0.241 -2.777 1.00 0.10 C ATOM 223 CD1 ILE A 103 -2.639 -0.652 0.128 1.00 0.09 C ATOM 0 H ILE A 103 -0.917 2.011 -1.952 1.00 0.08 H new ATOM 0 HA ILE A 103 -1.868 0.089 -3.986 1.00 0.08 H new ATOM 0 HB ILE A 103 -3.289 1.169 -1.520 1.00 0.08 H new ATOM 0 HG12 ILE A 103 -2.554 -1.710 -1.719 1.00 0.08 H new ATOM 0 HG13 ILE A 103 -1.219 -0.605 -1.459 1.00 0.08 H new ATOM 0 HG21 ILE A 103 -4.923 -0.618 -1.983 1.00 0.10 H new ATOM 0 HG22 ILE A 103 -4.805 0.536 -3.333 1.00 0.10 H new ATOM 0 HG23 ILE A 103 -4.019 -1.057 -3.452 1.00 0.10 H new ATOM 0 HD11 ILE A 103 -2.099 -1.431 0.666 1.00 0.09 H new ATOM 0 HD12 ILE A 103 -2.355 0.324 0.522 1.00 0.09 H new ATOM 0 HD13 ILE A 103 -3.711 -0.798 0.258 1.00 0.09 H new ATOM 235 N LYS A 104 -3.386 1.777 -5.108 1.00 0.13 N ATOM 236 CA LYS A 104 -4.034 2.820 -5.888 1.00 0.13 C ATOM 237 C LYS A 104 -5.509 2.494 -6.105 1.00 0.12 C ATOM 238 O LYS A 104 -5.876 1.324 -6.191 1.00 0.14 O ATOM 239 CB LYS A 104 -3.334 2.955 -7.242 1.00 0.19 C ATOM 240 CG LYS A 104 -3.410 4.350 -7.839 1.00 0.28 C ATOM 241 CD LYS A 104 -2.551 4.482 -9.091 1.00 0.39 C ATOM 242 CE LYS A 104 -3.238 3.948 -10.342 1.00 0.66 C ATOM 243 NZ LYS A 104 -3.414 2.470 -10.334 1.00 1.46 N ATOM 0 H LYS A 104 -3.456 0.843 -5.512 1.00 0.13 H new ATOM 0 HA LYS A 104 -3.963 3.760 -5.340 1.00 0.13 H new ATOM 0 HB2 LYS A 104 -2.286 2.676 -7.128 1.00 0.19 H new ATOM 0 HB3 LYS A 104 -3.778 2.247 -7.941 1.00 0.19 H new ATOM 0 HG2 LYS A 104 -4.446 4.584 -8.084 1.00 0.28 H new ATOM 0 HG3 LYS A 104 -3.085 5.080 -7.098 1.00 0.28 H new ATOM 0 HD2 LYS A 104 -2.297 5.531 -9.242 1.00 0.39 H new ATOM 0 HD3 LYS A 104 -1.614 3.946 -8.941 1.00 0.39 H new ATOM 0 HE2 LYS A 104 -4.214 4.422 -10.442 1.00 0.66 H new ATOM 0 HE3 LYS A 104 -2.654 4.232 -11.218 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 -3.358 2.108 -11.308 1.00 1.46 H new ATOM 0 HZ2 LYS A 104 -2.665 2.034 -9.759 1.00 1.46 H new ATOM 0 HZ3 LYS A 104 -4.342 2.233 -9.929 1.00 1.46 H new ATOM 257 N ASN A 105 -6.331 3.540 -6.197 1.00 0.12 N ATOM 258 CA ASN A 105 -7.763 3.426 -6.508 1.00 0.13 C ATOM 259 C ASN A 105 -8.557 2.853 -5.333 1.00 0.15 C ATOM 260 O ASN A 105 -9.363 1.938 -5.496 1.00 0.25 O ATOM 261 CB ASN A 105 -7.991 2.567 -7.756 1.00 0.16 C ATOM 262 CG ASN A 105 -9.348 2.818 -8.392 1.00 0.23 C ATOM 263 OD1 ASN A 105 -9.858 3.938 -8.380 1.00 0.49 O ATOM 264 ND2 ASN A 105 -9.945 1.776 -8.941 1.00 0.34 N ATOM 0 H ASN A 105 -6.022 4.502 -6.057 1.00 0.12 H new ATOM 0 HA ASN A 105 -8.124 4.436 -6.703 1.00 0.13 H new ATOM 0 HB2 ASN A 105 -7.207 2.774 -8.485 1.00 0.16 H new ATOM 0 HB3 ASN A 105 -7.907 1.514 -7.489 1.00 0.16 H new ATOM 0 HD21 ASN A 105 -10.862 1.884 -9.375 1.00 0.34 H new ATOM 0 HD22 ASN A 105 -9.490 0.863 -8.931 1.00 0.34 H new ATOM 271 N LEU A 106 -8.330 3.401 -4.151 1.00 0.14 N ATOM 272 CA LEU A 106 -9.086 3.013 -2.968 1.00 0.17 C ATOM 273 C LEU A 106 -10.329 3.880 -2.813 1.00 0.22 C ATOM 274 O LEU A 106 -10.422 4.962 -3.395 1.00 0.26 O ATOM 275 CB LEU A 106 -8.211 3.117 -1.717 1.00 0.16 C ATOM 276 CG LEU A 106 -7.194 1.989 -1.552 1.00 0.14 C ATOM 277 CD1 LEU A 106 -6.098 2.388 -0.586 1.00 0.15 C ATOM 278 CD2 LEU A 106 -7.885 0.730 -1.058 1.00 0.16 C ATOM 0 H LEU A 106 -7.625 4.119 -3.983 1.00 0.14 H new ATOM 0 HA LEU A 106 -9.401 1.977 -3.091 1.00 0.17 H new ATOM 0 HB2 LEU A 106 -7.678 4.067 -1.741 1.00 0.16 H new ATOM 0 HB3 LEU A 106 -8.857 3.136 -0.839 1.00 0.16 H new ATOM 0 HG LEU A 106 -6.743 1.792 -2.524 1.00 0.14 H new ATOM 0 HD11 LEU A 106 -5.386 1.569 -0.485 1.00 0.15 H new ATOM 0 HD12 LEU A 106 -5.583 3.271 -0.964 1.00 0.15 H new ATOM 0 HD13 LEU A 106 -6.535 2.611 0.387 1.00 0.15 H new ATOM 0 HD21 LEU A 106 -7.151 -0.067 -0.944 1.00 0.16 H new ATOM 0 HD22 LEU A 106 -8.358 0.928 -0.096 1.00 0.16 H new ATOM 0 HD23 LEU A 106 -8.643 0.424 -1.779 1.00 0.16 H new ATOM 290 N ASP A 107 -11.284 3.392 -2.034 1.00 0.27 N ATOM 291 CA ASP A 107 -12.522 4.121 -1.791 1.00 0.32 C ATOM 292 C ASP A 107 -12.399 4.945 -0.518 1.00 0.30 C ATOM 293 O ASP A 107 -11.601 4.619 0.361 1.00 0.26 O ATOM 294 CB ASP A 107 -13.706 3.152 -1.681 1.00 0.37 C ATOM 295 CG ASP A 107 -15.047 3.868 -1.617 1.00 0.50 C ATOM 296 OD1 ASP A 107 -15.505 4.185 -0.500 1.00 0.71 O ATOM 297 OD2 ASP A 107 -15.649 4.112 -2.683 1.00 0.62 O ATOM 0 H ASP A 107 -11.225 2.492 -1.558 1.00 0.27 H new ATOM 0 HA ASP A 107 -12.702 4.791 -2.632 1.00 0.32 H new ATOM 0 HB2 ASP A 107 -13.699 2.478 -2.538 1.00 0.37 H new ATOM 0 HB3 ASP A 107 -13.585 2.536 -0.790 1.00 0.37 H new ATOM 302 N LYS A 108 -13.189 6.006 -0.423 1.00 0.38 N ATOM 303 CA LYS A 108 -13.176 6.884 0.744 1.00 0.43 C ATOM 304 C LYS A 108 -13.532 6.130 2.027 1.00 0.36 C ATOM 305 O LYS A 108 -13.104 6.513 3.115 1.00 0.46 O ATOM 306 CB LYS A 108 -14.138 8.062 0.556 1.00 0.55 C ATOM 307 CG LYS A 108 -15.591 7.657 0.335 1.00 0.57 C ATOM 308 CD LYS A 108 -16.528 8.798 0.676 1.00 0.90 C ATOM 309 CE LYS A 108 -17.982 8.456 0.384 1.00 1.21 C ATOM 310 NZ LYS A 108 -18.902 9.516 0.872 1.00 2.20 N ATOM 0 H LYS A 108 -13.853 6.283 -1.146 1.00 0.38 H new ATOM 0 HA LYS A 108 -12.159 7.264 0.841 1.00 0.43 H new ATOM 0 HB2 LYS A 108 -14.082 8.705 1.434 1.00 0.55 H new ATOM 0 HB3 LYS A 108 -13.805 8.655 -0.296 1.00 0.55 H new ATOM 0 HG2 LYS A 108 -15.736 7.360 -0.704 1.00 0.57 H new ATOM 0 HG3 LYS A 108 -15.829 6.790 0.951 1.00 0.57 H new ATOM 0 HD2 LYS A 108 -16.421 9.051 1.731 1.00 0.90 H new ATOM 0 HD3 LYS A 108 -16.243 9.682 0.106 1.00 0.90 H new ATOM 0 HE2 LYS A 108 -18.116 8.323 -0.689 1.00 1.21 H new ATOM 0 HE3 LYS A 108 -18.235 7.507 0.857 1.00 1.21 H new ATOM 0 HZ1 LYS A 108 -19.884 9.250 0.656 1.00 2.20 H new ATOM 0 HZ2 LYS A 108 -18.791 9.626 1.900 1.00 2.20 H new ATOM 0 HZ3 LYS A 108 -18.676 10.416 0.402 1.00 2.20 H new ATOM 324 N SER A 109 -14.318 5.066 1.896 1.00 0.31 N ATOM 325 CA SER A 109 -14.712 4.260 3.050 1.00 0.40 C ATOM 326 C SER A 109 -13.549 3.415 3.579 1.00 0.34 C ATOM 327 O SER A 109 -13.655 2.792 4.639 1.00 0.43 O ATOM 328 CB SER A 109 -15.895 3.358 2.687 1.00 0.56 C ATOM 329 OG SER A 109 -15.628 2.612 1.510 1.00 1.41 O ATOM 0 H SER A 109 -14.695 4.741 1.005 1.00 0.31 H new ATOM 0 HA SER A 109 -15.010 4.946 3.843 1.00 0.40 H new ATOM 0 HB2 SER A 109 -16.104 2.678 3.513 1.00 0.56 H new ATOM 0 HB3 SER A 109 -16.788 3.966 2.541 1.00 0.56 H new ATOM 0 HG SER A 109 -15.817 3.164 0.723 1.00 1.41 H new ATOM 335 N ILE A 110 -12.443 3.391 2.845 1.00 0.23 N ATOM 336 CA ILE A 110 -11.274 2.638 3.266 1.00 0.20 C ATOM 337 C ILE A 110 -10.435 3.461 4.242 1.00 0.20 C ATOM 338 O ILE A 110 -9.942 4.535 3.903 1.00 0.26 O ATOM 339 CB ILE A 110 -10.412 2.205 2.056 1.00 0.20 C ATOM 340 CG1 ILE A 110 -11.180 1.200 1.188 1.00 0.21 C ATOM 341 CG2 ILE A 110 -9.088 1.607 2.514 1.00 0.22 C ATOM 342 CD1 ILE A 110 -11.436 -0.126 1.874 1.00 0.23 C ATOM 0 H ILE A 110 -12.334 3.884 1.958 1.00 0.23 H new ATOM 0 HA ILE A 110 -11.624 1.736 3.768 1.00 0.20 H new ATOM 0 HB ILE A 110 -10.194 3.091 1.460 1.00 0.20 H new ATOM 0 HG12 ILE A 110 -12.134 1.639 0.898 1.00 0.21 H new ATOM 0 HG13 ILE A 110 -10.619 1.022 0.271 1.00 0.21 H new ATOM 0 HG21 ILE A 110 -8.502 1.311 1.644 1.00 0.22 H new ATOM 0 HG22 ILE A 110 -8.534 2.348 3.090 1.00 0.22 H new ATOM 0 HG23 ILE A 110 -9.279 0.733 3.137 1.00 0.22 H new ATOM 0 HD11 ILE A 110 -11.983 -0.785 1.200 1.00 0.23 H new ATOM 0 HD12 ILE A 110 -10.485 -0.588 2.140 1.00 0.23 H new ATOM 0 HD13 ILE A 110 -12.024 0.039 2.777 1.00 0.23 H new ATOM 354 N ASP A 111 -10.305 2.955 5.459 1.00 0.17 N ATOM 355 CA ASP A 111 -9.501 3.604 6.486 1.00 0.18 C ATOM 356 C ASP A 111 -8.247 2.767 6.716 1.00 0.14 C ATOM 357 O ASP A 111 -8.053 1.756 6.036 1.00 0.13 O ATOM 358 CB ASP A 111 -10.309 3.737 7.785 1.00 0.23 C ATOM 359 CG ASP A 111 -9.722 4.752 8.751 1.00 1.01 C ATOM 360 OD1 ASP A 111 -8.854 4.371 9.568 1.00 1.59 O ATOM 361 OD2 ASP A 111 -10.129 5.932 8.705 1.00 1.23 O ATOM 0 H ASP A 111 -10.750 2.089 5.762 1.00 0.17 H new ATOM 0 HA ASP A 111 -9.219 4.606 6.164 1.00 0.18 H new ATOM 0 HB2 ASP A 111 -11.332 4.025 7.542 1.00 0.23 H new ATOM 0 HB3 ASP A 111 -10.360 2.765 8.275 1.00 0.23 H new ATOM 366 N ASN A 112 -7.419 3.142 7.683 1.00 0.15 N ATOM 367 CA ASN A 112 -6.171 2.428 7.928 1.00 0.13 C ATOM 368 C ASN A 112 -6.490 1.044 8.434 1.00 0.11 C ATOM 369 O ASN A 112 -5.757 0.086 8.194 1.00 0.12 O ATOM 370 CB ASN A 112 -5.309 3.142 8.966 1.00 0.16 C ATOM 371 CG ASN A 112 -4.892 4.538 8.542 1.00 0.19 C ATOM 372 OD1 ASN A 112 -4.814 4.847 7.356 1.00 0.60 O ATOM 373 ND2 ASN A 112 -4.593 5.385 9.512 1.00 0.55 N ATOM 0 H ASN A 112 -7.587 3.931 8.307 1.00 0.15 H new ATOM 0 HA ASN A 112 -5.616 2.385 6.991 1.00 0.13 H new ATOM 0 HB2 ASN A 112 -5.860 3.204 9.905 1.00 0.16 H new ATOM 0 HB3 ASN A 112 -4.417 2.547 9.159 1.00 0.16 H new ATOM 0 HD21 ASN A 112 -4.286 6.331 9.286 1.00 0.55 H new ATOM 0 HD22 ASN A 112 -4.670 5.093 10.486 1.00 0.55 H new ATOM 380 N LYS A 113 -7.613 0.960 9.124 1.00 0.12 N ATOM 381 CA LYS A 113 -8.098 -0.263 9.679 1.00 0.12 C ATOM 382 C LYS A 113 -8.514 -1.188 8.567 1.00 0.11 C ATOM 383 O LYS A 113 -8.151 -2.345 8.536 1.00 0.11 O ATOM 384 CB LYS A 113 -9.322 0.069 10.478 1.00 0.15 C ATOM 385 CG LYS A 113 -9.519 -0.766 11.737 1.00 0.28 C ATOM 386 CD LYS A 113 -9.543 -2.280 11.479 1.00 0.54 C ATOM 387 CE LYS A 113 -10.958 -2.826 11.270 1.00 1.63 C ATOM 388 NZ LYS A 113 -11.907 -2.312 12.289 1.00 2.58 N ATOM 0 H LYS A 113 -8.215 1.762 9.310 1.00 0.12 H new ATOM 0 HA LYS A 113 -7.327 -0.737 10.287 1.00 0.12 H new ATOM 0 HB2 LYS A 113 -9.277 1.121 10.762 1.00 0.15 H new ATOM 0 HB3 LYS A 113 -10.197 -0.052 9.840 1.00 0.15 H new ATOM 0 HG2 LYS A 113 -8.718 -0.539 12.441 1.00 0.28 H new ATOM 0 HG3 LYS A 113 -10.455 -0.473 12.213 1.00 0.28 H new ATOM 0 HD2 LYS A 113 -8.939 -2.503 10.599 1.00 0.54 H new ATOM 0 HD3 LYS A 113 -9.081 -2.795 12.322 1.00 0.54 H new ATOM 0 HE2 LYS A 113 -11.310 -2.551 10.276 1.00 1.63 H new ATOM 0 HE3 LYS A 113 -10.936 -3.915 11.311 1.00 1.63 H new ATOM 0 HZ1 LYS A 113 -12.706 -2.971 12.383 1.00 2.58 H new ATOM 0 HZ2 LYS A 113 -11.420 -2.224 13.204 1.00 2.58 H new ATOM 0 HZ3 LYS A 113 -12.261 -1.379 11.995 1.00 2.58 H new ATOM 402 N ALA A 114 -9.305 -0.636 7.667 1.00 0.11 N ATOM 403 CA ALA A 114 -9.838 -1.383 6.537 1.00 0.12 C ATOM 404 C ALA A 114 -8.711 -1.891 5.651 1.00 0.11 C ATOM 405 O ALA A 114 -8.744 -3.020 5.152 1.00 0.13 O ATOM 406 CB ALA A 114 -10.778 -0.495 5.740 1.00 0.15 C ATOM 0 H ALA A 114 -9.598 0.341 7.696 1.00 0.11 H new ATOM 0 HA ALA A 114 -10.390 -2.246 6.911 1.00 0.12 H new ATOM 0 HB1 ALA A 114 -11.177 -1.054 4.894 1.00 0.15 H new ATOM 0 HB2 ALA A 114 -11.599 -0.168 6.379 1.00 0.15 H new ATOM 0 HB3 ALA A 114 -10.234 0.376 5.375 1.00 0.15 H new ATOM 412 N LEU A 115 -7.709 -1.049 5.473 1.00 0.09 N ATOM 413 CA LEU A 115 -6.538 -1.410 4.700 1.00 0.09 C ATOM 414 C LEU A 115 -5.765 -2.499 5.442 1.00 0.08 C ATOM 415 O LEU A 115 -5.406 -3.528 4.865 1.00 0.09 O ATOM 416 CB LEU A 115 -5.674 -0.156 4.498 1.00 0.10 C ATOM 417 CG LEU A 115 -4.687 -0.185 3.328 1.00 0.11 C ATOM 418 CD1 LEU A 115 -3.976 1.151 3.206 1.00 0.16 C ATOM 419 CD2 LEU A 115 -3.674 -1.289 3.504 1.00 0.11 C ATOM 0 H LEU A 115 -7.685 -0.104 5.857 1.00 0.09 H new ATOM 0 HA LEU A 115 -6.824 -1.798 3.723 1.00 0.09 H new ATOM 0 HB2 LEU A 115 -6.338 0.697 4.362 1.00 0.10 H new ATOM 0 HB3 LEU A 115 -5.111 0.021 5.414 1.00 0.10 H new ATOM 0 HG LEU A 115 -5.251 -0.375 2.415 1.00 0.11 H new ATOM 0 HD11 LEU A 115 -3.277 1.116 2.370 1.00 0.16 H new ATOM 0 HD12 LEU A 115 -4.709 1.939 3.034 1.00 0.16 H new ATOM 0 HD13 LEU A 115 -3.430 1.358 4.127 1.00 0.16 H new ATOM 0 HD21 LEU A 115 -2.985 -1.288 2.660 1.00 0.11 H new ATOM 0 HD22 LEU A 115 -3.117 -1.128 4.427 1.00 0.11 H new ATOM 0 HD23 LEU A 115 -4.187 -2.249 3.552 1.00 0.11 H new ATOM 431 N TYR A 116 -5.553 -2.282 6.734 1.00 0.08 N ATOM 432 CA TYR A 116 -4.903 -3.269 7.578 1.00 0.09 C ATOM 433 C TYR A 116 -5.686 -4.569 7.587 1.00 0.10 C ATOM 434 O TYR A 116 -5.118 -5.638 7.401 1.00 0.11 O ATOM 435 CB TYR A 116 -4.750 -2.745 9.012 1.00 0.10 C ATOM 436 CG TYR A 116 -4.302 -3.809 9.990 1.00 0.13 C ATOM 437 CD1 TYR A 116 -2.959 -4.111 10.138 1.00 0.19 C ATOM 438 CD2 TYR A 116 -5.222 -4.525 10.745 1.00 0.18 C ATOM 439 CE1 TYR A 116 -2.539 -5.097 11.010 1.00 0.24 C ATOM 440 CE2 TYR A 116 -4.814 -5.509 11.621 1.00 0.23 C ATOM 441 CZ TYR A 116 -3.472 -5.795 11.751 1.00 0.23 C ATOM 442 OH TYR A 116 -3.063 -6.781 12.624 1.00 0.30 O ATOM 0 H TYR A 116 -5.824 -1.427 7.219 1.00 0.08 H new ATOM 0 HA TYR A 116 -3.912 -3.458 7.166 1.00 0.09 H new ATOM 0 HB2 TYR A 116 -4.029 -1.928 9.018 1.00 0.10 H new ATOM 0 HB3 TYR A 116 -5.702 -2.332 9.345 1.00 0.10 H new ATOM 0 HD1 TYR A 116 -2.226 -3.566 9.561 1.00 0.19 H new ATOM 0 HD2 TYR A 116 -6.275 -4.307 10.644 1.00 0.18 H new ATOM 0 HE1 TYR A 116 -1.487 -5.320 11.111 1.00 0.24 H new ATOM 0 HE2 TYR A 116 -5.543 -6.053 12.203 1.00 0.23 H new ATOM 0 HH TYR A 116 -3.846 -7.172 13.066 1.00 0.30 H new ATOM 452 N ASP A 117 -6.995 -4.464 7.759 1.00 0.10 N ATOM 453 CA ASP A 117 -7.853 -5.634 7.876 1.00 0.12 C ATOM 454 C ASP A 117 -7.699 -6.550 6.671 1.00 0.12 C ATOM 455 O ASP A 117 -7.682 -7.776 6.807 1.00 0.15 O ATOM 456 CB ASP A 117 -9.312 -5.188 7.999 1.00 0.16 C ATOM 457 CG ASP A 117 -10.283 -6.350 8.051 1.00 0.27 C ATOM 458 OD1 ASP A 117 -10.458 -6.931 9.143 1.00 0.36 O ATOM 459 OD2 ASP A 117 -10.866 -6.696 7.001 1.00 0.40 O ATOM 0 H ASP A 117 -7.489 -3.574 7.821 1.00 0.10 H new ATOM 0 HA ASP A 117 -7.558 -6.189 8.767 1.00 0.12 H new ATOM 0 HB2 ASP A 117 -9.427 -4.585 8.899 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -9.564 -4.549 7.153 1.00 0.16 H new ATOM 464 N THR A 118 -7.573 -5.954 5.502 1.00 0.11 N ATOM 465 CA THR A 118 -7.439 -6.718 4.280 1.00 0.11 C ATOM 466 C THR A 118 -6.014 -7.266 4.083 1.00 0.10 C ATOM 467 O THR A 118 -5.824 -8.473 3.910 1.00 0.12 O ATOM 468 CB THR A 118 -7.839 -5.847 3.076 1.00 0.13 C ATOM 469 OG1 THR A 118 -9.132 -5.262 3.313 1.00 0.22 O ATOM 470 CG2 THR A 118 -7.881 -6.673 1.802 1.00 0.17 C ATOM 0 H THR A 118 -7.561 -4.942 5.374 1.00 0.11 H new ATOM 0 HA THR A 118 -8.106 -7.577 4.357 1.00 0.11 H new ATOM 0 HB THR A 118 -7.094 -5.061 2.955 1.00 0.13 H new ATOM 0 HG1 THR A 118 -9.041 -4.505 3.929 1.00 0.22 H new ATOM 0 HG21 THR A 118 -8.166 -6.036 0.965 1.00 0.17 H new ATOM 0 HG22 THR A 118 -6.897 -7.101 1.613 1.00 0.17 H new ATOM 0 HG23 THR A 118 -8.611 -7.475 1.912 1.00 0.17 H new ATOM 478 N PHE A 119 -5.022 -6.379 4.129 1.00 0.08 N ATOM 479 CA PHE A 119 -3.633 -6.739 3.824 1.00 0.08 C ATOM 480 C PHE A 119 -2.971 -7.577 4.929 1.00 0.08 C ATOM 481 O PHE A 119 -2.059 -8.352 4.657 1.00 0.09 O ATOM 482 CB PHE A 119 -2.806 -5.492 3.482 1.00 0.08 C ATOM 483 CG PHE A 119 -3.227 -4.836 2.183 1.00 0.08 C ATOM 484 CD1 PHE A 119 -4.472 -4.225 2.044 1.00 0.10 C ATOM 485 CD2 PHE A 119 -2.371 -4.834 1.095 1.00 0.08 C ATOM 486 CE1 PHE A 119 -4.838 -3.636 0.851 1.00 0.11 C ATOM 487 CE2 PHE A 119 -2.735 -4.243 -0.097 1.00 0.10 C ATOM 488 CZ PHE A 119 -4.029 -3.620 -0.188 1.00 0.09 C ATOM 0 H PHE A 119 -5.153 -5.398 4.376 1.00 0.08 H new ATOM 0 HA PHE A 119 -3.661 -7.380 2.943 1.00 0.08 H new ATOM 0 HB2 PHE A 119 -2.897 -4.769 4.293 1.00 0.08 H new ATOM 0 HB3 PHE A 119 -1.753 -5.768 3.418 1.00 0.08 H new ATOM 0 HD1 PHE A 119 -5.157 -4.212 2.879 1.00 0.10 H new ATOM 0 HD2 PHE A 119 -1.402 -5.303 1.181 1.00 0.08 H new ATOM 0 HE1 PHE A 119 -5.812 -3.177 0.767 1.00 0.11 H new ATOM 0 HE2 PHE A 119 -2.064 -4.248 -0.943 1.00 0.10 H new ATOM 0 HZ PHE A 119 -4.336 -3.141 -1.106 1.00 0.09 H new ATOM 498 N SER A 120 -3.431 -7.418 6.171 1.00 0.09 N ATOM 499 CA SER A 120 -2.821 -8.088 7.329 1.00 0.09 C ATOM 500 C SER A 120 -2.777 -9.608 7.149 1.00 0.08 C ATOM 501 O SER A 120 -1.907 -10.279 7.701 1.00 0.09 O ATOM 502 CB SER A 120 -3.573 -7.726 8.617 1.00 0.13 C ATOM 503 OG SER A 120 -3.080 -8.441 9.736 1.00 0.19 O ATOM 0 H SER A 120 -4.229 -6.828 6.405 1.00 0.09 H new ATOM 0 HA SER A 120 -1.793 -7.735 7.406 1.00 0.09 H new ATOM 0 HB2 SER A 120 -3.482 -6.656 8.802 1.00 0.13 H new ATOM 0 HB3 SER A 120 -4.634 -7.939 8.489 1.00 0.13 H new ATOM 0 HG SER A 120 -3.070 -7.854 10.521 1.00 0.19 H new ATOM 509 N ALA A 121 -3.726 -10.147 6.395 1.00 0.09 N ATOM 510 CA ALA A 121 -3.769 -11.581 6.117 1.00 0.11 C ATOM 511 C ALA A 121 -2.472 -12.076 5.461 1.00 0.11 C ATOM 512 O ALA A 121 -2.151 -13.264 5.520 1.00 0.13 O ATOM 513 CB ALA A 121 -4.958 -11.904 5.225 1.00 0.14 C ATOM 0 H ALA A 121 -4.480 -9.613 5.963 1.00 0.09 H new ATOM 0 HA ALA A 121 -3.876 -12.098 7.071 1.00 0.11 H new ATOM 0 HB1 ALA A 121 -4.981 -12.975 5.023 1.00 0.14 H new ATOM 0 HB2 ALA A 121 -5.880 -11.609 5.726 1.00 0.14 H new ATOM 0 HB3 ALA A 121 -4.866 -11.360 4.285 1.00 0.14 H new ATOM 519 N PHE A 122 -1.730 -11.165 4.840 1.00 0.08 N ATOM 520 CA PHE A 122 -0.512 -11.525 4.121 1.00 0.09 C ATOM 521 C PHE A 122 0.720 -11.419 5.017 1.00 0.10 C ATOM 522 O PHE A 122 1.794 -11.908 4.664 1.00 0.18 O ATOM 523 CB PHE A 122 -0.349 -10.628 2.894 1.00 0.09 C ATOM 524 CG PHE A 122 -1.572 -10.608 2.030 1.00 0.09 C ATOM 525 CD1 PHE A 122 -2.030 -11.767 1.426 1.00 0.13 C ATOM 526 CD2 PHE A 122 -2.246 -9.424 1.798 1.00 0.10 C ATOM 527 CE1 PHE A 122 -3.141 -11.744 0.607 1.00 0.16 C ATOM 528 CE2 PHE A 122 -3.359 -9.394 0.984 1.00 0.12 C ATOM 529 CZ PHE A 122 -3.867 -10.589 0.472 1.00 0.13 C ATOM 0 H PHE A 122 -1.951 -10.169 4.820 1.00 0.08 H new ATOM 0 HA PHE A 122 -0.603 -12.564 3.803 1.00 0.09 H new ATOM 0 HB2 PHE A 122 -0.121 -9.613 3.218 1.00 0.09 H new ATOM 0 HB3 PHE A 122 0.501 -10.973 2.306 1.00 0.09 H new ATOM 0 HD1 PHE A 122 -1.512 -12.699 1.598 1.00 0.13 H new ATOM 0 HD2 PHE A 122 -1.897 -8.512 2.259 1.00 0.10 H new ATOM 0 HE1 PHE A 122 -3.438 -12.635 0.073 1.00 0.16 H new ATOM 0 HE2 PHE A 122 -3.833 -8.454 0.745 1.00 0.12 H new ATOM 0 HZ PHE A 122 -4.825 -10.604 -0.027 1.00 0.13 H new ATOM 539 N GLY A 123 0.557 -10.788 6.170 1.00 0.09 N ATOM 540 CA GLY A 123 1.660 -10.630 7.100 1.00 0.10 C ATOM 541 C GLY A 123 1.405 -9.508 8.083 1.00 0.09 C ATOM 542 O GLY A 123 0.421 -8.777 7.951 1.00 0.11 O ATOM 0 H GLY A 123 -0.324 -10.380 6.481 1.00 0.09 H new ATOM 0 HA2 GLY A 123 1.815 -11.562 7.643 1.00 0.10 H new ATOM 0 HA3 GLY A 123 2.577 -10.428 6.546 1.00 0.10 H new ATOM 546 N ASN A 124 2.278 -9.365 9.070 1.00 0.13 N ATOM 547 CA ASN A 124 2.118 -8.317 10.067 1.00 0.14 C ATOM 548 C ASN A 124 2.420 -6.954 9.458 1.00 0.11 C ATOM 549 O ASN A 124 3.363 -6.800 8.682 1.00 0.14 O ATOM 550 CB ASN A 124 3.025 -8.553 11.279 1.00 0.18 C ATOM 551 CG ASN A 124 2.770 -7.540 12.382 1.00 0.21 C ATOM 552 OD1 ASN A 124 1.643 -7.078 12.564 1.00 0.24 O ATOM 553 ND2 ASN A 124 3.806 -7.181 13.121 1.00 0.25 N ATOM 0 H ASN A 124 3.098 -9.957 9.201 1.00 0.13 H new ATOM 0 HA ASN A 124 1.082 -8.341 10.405 1.00 0.14 H new ATOM 0 HB2 ASN A 124 2.861 -9.559 11.665 1.00 0.18 H new ATOM 0 HB3 ASN A 124 4.068 -8.497 10.968 1.00 0.18 H new ATOM 0 HD21 ASN A 124 3.686 -6.500 13.871 1.00 0.25 H new ATOM 0 HD22 ASN A 124 4.725 -7.585 12.941 1.00 0.25 H new ATOM 560 N ILE A 125 1.611 -5.975 9.813 1.00 0.11 N ATOM 561 CA ILE A 125 1.771 -4.626 9.307 1.00 0.10 C ATOM 562 C ILE A 125 2.203 -3.698 10.435 1.00 0.11 C ATOM 563 O ILE A 125 1.583 -3.679 11.499 1.00 0.14 O ATOM 564 CB ILE A 125 0.452 -4.113 8.696 1.00 0.11 C ATOM 565 CG1 ILE A 125 0.010 -5.019 7.543 1.00 0.10 C ATOM 566 CG2 ILE A 125 0.598 -2.674 8.224 1.00 0.14 C ATOM 567 CD1 ILE A 125 -1.318 -4.623 6.933 1.00 0.11 C ATOM 0 H ILE A 125 0.828 -6.091 10.457 1.00 0.11 H new ATOM 0 HA ILE A 125 2.536 -4.639 8.530 1.00 0.10 H new ATOM 0 HB ILE A 125 -0.316 -4.138 9.469 1.00 0.11 H new ATOM 0 HG12 ILE A 125 0.775 -5.004 6.767 1.00 0.10 H new ATOM 0 HG13 ILE A 125 -0.058 -6.045 7.904 1.00 0.10 H new ATOM 0 HG21 ILE A 125 -0.345 -2.334 7.797 1.00 0.14 H new ATOM 0 HG22 ILE A 125 0.863 -2.039 9.069 1.00 0.14 H new ATOM 0 HG23 ILE A 125 1.381 -2.617 7.467 1.00 0.14 H new ATOM 0 HD11 ILE A 125 -1.566 -5.309 6.123 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.096 -4.666 7.695 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.250 -3.608 6.540 1.00 0.11 H new ATOM 579 N LEU A 126 3.264 -2.933 10.207 1.00 0.13 N ATOM 580 CA LEU A 126 3.773 -2.029 11.229 1.00 0.15 C ATOM 581 C LEU A 126 3.036 -0.703 11.135 1.00 0.16 C ATOM 582 O LEU A 126 2.696 -0.083 12.142 1.00 0.24 O ATOM 583 CB LEU A 126 5.283 -1.754 11.081 1.00 0.19 C ATOM 584 CG LEU A 126 6.227 -2.952 10.875 1.00 0.21 C ATOM 585 CD1 LEU A 126 5.677 -4.239 11.465 1.00 0.53 C ATOM 586 CD2 LEU A 126 6.559 -3.122 9.405 1.00 0.54 C ATOM 0 H LEU A 126 3.785 -2.921 9.330 1.00 0.13 H new ATOM 0 HA LEU A 126 3.611 -2.511 12.193 1.00 0.15 H new ATOM 0 HB2 LEU A 126 5.416 -1.077 10.237 1.00 0.19 H new ATOM 0 HB3 LEU A 126 5.613 -1.221 11.973 1.00 0.19 H new ATOM 0 HG LEU A 126 7.146 -2.732 11.418 1.00 0.21 H new ATOM 0 HD11 LEU A 126 6.384 -5.050 11.291 1.00 0.53 H new ATOM 0 HD12 LEU A 126 5.527 -4.113 12.537 1.00 0.53 H new ATOM 0 HD13 LEU A 126 4.725 -4.479 10.991 1.00 0.53 H new ATOM 0 HD21 LEU A 126 7.227 -3.974 9.279 1.00 0.54 H new ATOM 0 HD22 LEU A 126 5.642 -3.294 8.842 1.00 0.54 H new ATOM 0 HD23 LEU A 126 7.047 -2.220 9.036 1.00 0.54 H new ATOM 598 N SER A 127 2.791 -0.278 9.905 1.00 0.14 N ATOM 599 CA SER A 127 2.184 1.014 9.646 1.00 0.17 C ATOM 600 C SER A 127 1.393 0.996 8.340 1.00 0.19 C ATOM 601 O SER A 127 1.972 0.982 7.255 1.00 0.37 O ATOM 602 CB SER A 127 3.275 2.090 9.584 1.00 0.19 C ATOM 603 OG SER A 127 4.013 2.144 10.794 1.00 0.76 O ATOM 0 H SER A 127 3.006 -0.816 9.066 1.00 0.14 H new ATOM 0 HA SER A 127 1.492 1.241 10.457 1.00 0.17 H new ATOM 0 HB2 SER A 127 3.949 1.881 8.753 1.00 0.19 H new ATOM 0 HB3 SER A 127 2.821 3.061 9.389 1.00 0.19 H new ATOM 0 HG SER A 127 4.702 2.837 10.726 1.00 0.76 H new ATOM 609 N CYS A 128 0.078 0.959 8.440 1.00 0.18 N ATOM 610 CA CYS A 128 -0.774 1.062 7.265 1.00 0.17 C ATOM 611 C CYS A 128 -1.380 2.454 7.203 1.00 0.16 C ATOM 612 O CYS A 128 -1.721 3.034 8.236 1.00 0.28 O ATOM 613 CB CYS A 128 -1.873 0.003 7.306 1.00 0.21 C ATOM 614 SG CYS A 128 -2.698 -0.123 8.911 1.00 0.72 S ATOM 0 H CYS A 128 -0.426 0.859 9.321 1.00 0.18 H new ATOM 0 HA CYS A 128 -0.174 0.891 6.371 1.00 0.17 H new ATOM 0 HB2 CYS A 128 -2.616 0.233 6.542 1.00 0.21 H new ATOM 0 HB3 CYS A 128 -1.443 -0.965 7.051 1.00 0.21 H new ATOM 0 HG CYS A 128 -3.984 -0.025 8.747 1.00 0.72 H new ATOM 620 N LYS A 129 -1.499 3.002 6.006 1.00 0.13 N ATOM 621 CA LYS A 129 -1.991 4.358 5.865 1.00 0.14 C ATOM 622 C LYS A 129 -2.860 4.524 4.628 1.00 0.12 C ATOM 623 O LYS A 129 -2.488 4.116 3.532 1.00 0.12 O ATOM 624 CB LYS A 129 -0.812 5.337 5.815 1.00 0.18 C ATOM 625 CG LYS A 129 -1.209 6.796 5.627 1.00 0.23 C ATOM 626 CD LYS A 129 -2.047 7.312 6.786 1.00 0.36 C ATOM 627 CE LYS A 129 -2.296 8.807 6.673 1.00 0.47 C ATOM 628 NZ LYS A 129 -3.171 9.299 7.770 1.00 1.00 N ATOM 0 H LYS A 129 -1.265 2.535 5.130 1.00 0.13 H new ATOM 0 HA LYS A 129 -2.613 4.576 6.733 1.00 0.14 H new ATOM 0 HB2 LYS A 129 -0.241 5.245 6.739 1.00 0.18 H new ATOM 0 HB3 LYS A 129 -0.149 5.046 5.000 1.00 0.18 H new ATOM 0 HG2 LYS A 129 -0.311 7.406 5.529 1.00 0.23 H new ATOM 0 HG3 LYS A 129 -1.770 6.902 4.698 1.00 0.23 H new ATOM 0 HD2 LYS A 129 -3.000 6.784 6.810 1.00 0.36 H new ATOM 0 HD3 LYS A 129 -1.540 7.097 7.727 1.00 0.36 H new ATOM 0 HE2 LYS A 129 -1.345 9.338 6.699 1.00 0.47 H new ATOM 0 HE3 LYS A 129 -2.758 9.028 5.711 1.00 0.47 H new ATOM 0 HZ1 LYS A 129 -3.320 10.323 7.662 1.00 1.00 H new ATOM 0 HZ2 LYS A 129 -4.088 8.809 7.729 1.00 1.00 H new ATOM 0 HZ3 LYS A 129 -2.718 9.110 8.687 1.00 1.00 H new ATOM 642 N VAL A 130 -4.016 5.126 4.833 1.00 0.15 N ATOM 643 CA VAL A 130 -4.890 5.546 3.762 1.00 0.17 C ATOM 644 C VAL A 130 -4.937 7.053 3.803 1.00 0.20 C ATOM 645 O VAL A 130 -5.463 7.643 4.748 1.00 0.24 O ATOM 646 CB VAL A 130 -6.330 5.003 3.891 1.00 0.21 C ATOM 647 CG1 VAL A 130 -7.177 5.479 2.718 1.00 0.28 C ATOM 648 CG2 VAL A 130 -6.340 3.486 3.973 1.00 0.21 C ATOM 0 H VAL A 130 -4.377 5.339 5.763 1.00 0.15 H new ATOM 0 HA VAL A 130 -4.496 5.153 2.825 1.00 0.17 H new ATOM 0 HB VAL A 130 -6.758 5.390 4.816 1.00 0.21 H new ATOM 0 HG11 VAL A 130 -8.190 5.090 2.819 1.00 0.28 H new ATOM 0 HG12 VAL A 130 -7.206 6.569 2.708 1.00 0.28 H new ATOM 0 HG13 VAL A 130 -6.742 5.119 1.786 1.00 0.28 H new ATOM 0 HG21 VAL A 130 -7.367 3.133 4.063 1.00 0.21 H new ATOM 0 HG22 VAL A 130 -5.891 3.070 3.071 1.00 0.21 H new ATOM 0 HG23 VAL A 130 -5.768 3.165 4.844 1.00 0.21 H new ATOM 658 N VAL A 131 -4.353 7.665 2.810 1.00 0.21 N ATOM 659 CA VAL A 131 -4.202 9.098 2.792 1.00 0.27 C ATOM 660 C VAL A 131 -5.532 9.739 2.437 1.00 0.33 C ATOM 661 O VAL A 131 -6.101 9.465 1.381 1.00 0.33 O ATOM 662 CB VAL A 131 -3.095 9.472 1.802 1.00 0.28 C ATOM 663 CG1 VAL A 131 -2.683 10.926 1.953 1.00 0.34 C ATOM 664 CG2 VAL A 131 -1.914 8.541 2.030 1.00 0.25 C ATOM 0 H VAL A 131 -3.969 7.190 1.993 1.00 0.21 H new ATOM 0 HA VAL A 131 -3.910 9.469 3.774 1.00 0.27 H new ATOM 0 HB VAL A 131 -3.465 9.357 0.783 1.00 0.28 H new ATOM 0 HG11 VAL A 131 -1.896 11.158 1.235 1.00 0.34 H new ATOM 0 HG12 VAL A 131 -3.543 11.569 1.768 1.00 0.34 H new ATOM 0 HG13 VAL A 131 -2.314 11.096 2.964 1.00 0.34 H new ATOM 0 HG21 VAL A 131 -1.114 8.791 1.334 1.00 0.25 H new ATOM 0 HG22 VAL A 131 -1.554 8.654 3.053 1.00 0.25 H new ATOM 0 HG23 VAL A 131 -2.227 7.510 1.867 1.00 0.25 H new ATOM 674 N CYS A 132 -6.035 10.571 3.334 1.00 0.43 N ATOM 675 CA CYS A 132 -7.421 10.996 3.266 1.00 0.55 C ATOM 676 C CYS A 132 -7.594 12.346 2.588 1.00 0.58 C ATOM 677 O CYS A 132 -6.869 13.305 2.857 1.00 0.66 O ATOM 678 CB CYS A 132 -8.015 11.036 4.674 1.00 0.75 C ATOM 679 SG CYS A 132 -7.070 12.031 5.850 1.00 1.58 S ATOM 0 H CYS A 132 -5.507 10.963 4.113 1.00 0.43 H new ATOM 0 HA CYS A 132 -7.952 10.267 2.654 1.00 0.55 H new ATOM 0 HB2 CYS A 132 -9.030 11.429 4.617 1.00 0.75 H new ATOM 0 HB3 CYS A 132 -8.088 10.017 5.054 1.00 0.75 H new ATOM 0 HG CYS A 132 -7.655 12.003 7.011 1.00 1.58 H new ATOM 685 N ASP A 133 -8.574 12.395 1.698 1.00 0.59 N ATOM 686 CA ASP A 133 -8.975 13.619 1.039 1.00 0.72 C ATOM 687 C ASP A 133 -10.006 14.313 1.916 1.00 0.93 C ATOM 688 O ASP A 133 -10.514 13.704 2.860 1.00 0.99 O ATOM 689 CB ASP A 133 -9.572 13.292 -0.341 1.00 0.70 C ATOM 690 CG ASP A 133 -9.927 14.512 -1.165 1.00 1.09 C ATOM 691 OD1 ASP A 133 -9.037 15.051 -1.845 1.00 1.20 O ATOM 692 OD2 ASP A 133 -11.090 14.958 -1.111 1.00 2.08 O ATOM 0 H ASP A 133 -9.114 11.578 1.414 1.00 0.59 H new ATOM 0 HA ASP A 133 -8.117 14.275 0.892 1.00 0.72 H new ATOM 0 HB2 ASP A 133 -8.859 12.685 -0.899 1.00 0.70 H new ATOM 0 HB3 ASP A 133 -10.468 12.686 -0.203 1.00 0.70 H new ATOM 697 N GLU A 134 -10.313 15.566 1.629 1.00 1.12 N ATOM 698 CA GLU A 134 -11.406 16.251 2.321 1.00 1.35 C ATOM 699 C GLU A 134 -12.719 15.487 2.117 1.00 1.36 C ATOM 700 O GLU A 134 -13.633 15.566 2.937 1.00 1.52 O ATOM 701 CB GLU A 134 -11.574 17.690 1.813 1.00 1.57 C ATOM 702 CG GLU A 134 -12.139 17.777 0.404 1.00 1.60 C ATOM 703 CD GLU A 134 -12.552 19.180 0.022 1.00 1.96 C ATOM 704 OE1 GLU A 134 -13.703 19.568 0.319 1.00 2.45 O ATOM 705 OE2 GLU A 134 -11.729 19.905 -0.574 1.00 2.09 O ATOM 0 H GLU A 134 -9.830 16.130 0.930 1.00 1.12 H new ATOM 0 HA GLU A 134 -11.158 16.284 3.382 1.00 1.35 H new ATOM 0 HB2 GLU A 134 -12.231 18.232 2.493 1.00 1.57 H new ATOM 0 HB3 GLU A 134 -10.606 18.191 1.839 1.00 1.57 H new ATOM 0 HG2 GLU A 134 -11.392 17.418 -0.304 1.00 1.60 H new ATOM 0 HG3 GLU A 134 -13.001 17.115 0.322 1.00 1.60 H new ATOM 712 N ASN A 135 -12.789 14.742 1.015 1.00 1.25 N ATOM 713 CA ASN A 135 -13.979 13.975 0.660 1.00 1.31 C ATOM 714 C ASN A 135 -13.899 12.556 1.204 1.00 1.25 C ATOM 715 O ASN A 135 -14.826 11.768 1.034 1.00 1.36 O ATOM 716 CB ASN A 135 -14.165 13.914 -0.865 1.00 1.32 C ATOM 717 CG ASN A 135 -14.477 15.262 -1.488 1.00 1.47 C ATOM 718 OD1 ASN A 135 -15.632 15.685 -1.525 1.00 1.65 O ATOM 719 ND2 ASN A 135 -13.463 15.926 -2.017 1.00 1.46 N ATOM 0 H ASN A 135 -12.024 14.654 0.346 1.00 1.25 H new ATOM 0 HA ASN A 135 -14.832 14.485 1.107 1.00 1.31 H new ATOM 0 HB2 ASN A 135 -13.258 13.513 -1.319 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -14.972 13.219 -1.098 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -13.624 16.822 -2.476 1.00 1.46 H new ATOM 0 HD22 ASN A 135 -12.520 15.542 -1.966 1.00 1.46 H new ATOM 726 N GLY A 136 -12.792 12.231 1.856 1.00 1.12 N ATOM 727 CA GLY A 136 -12.623 10.891 2.391 1.00 1.11 C ATOM 728 C GLY A 136 -11.231 10.318 2.173 1.00 0.89 C ATOM 729 O GLY A 136 -10.490 10.115 3.128 1.00 0.86 O ATOM 0 H GLY A 136 -12.011 12.865 2.025 1.00 1.12 H new ATOM 0 HA2 GLY A 136 -12.837 10.906 3.460 1.00 1.11 H new ATOM 0 HA3 GLY A 136 -13.355 10.229 1.929 1.00 1.11 H new ATOM 733 N SER A 137 -10.865 10.054 0.923 1.00 0.77 N ATOM 734 CA SER A 137 -9.572 9.442 0.618 1.00 0.57 C ATOM 735 C SER A 137 -8.983 10.031 -0.658 1.00 0.47 C ATOM 736 O SER A 137 -9.720 10.428 -1.561 1.00 0.53 O ATOM 737 CB SER A 137 -9.724 7.922 0.471 1.00 0.67 C ATOM 738 OG SER A 137 -8.480 7.306 0.177 1.00 1.61 O ATOM 0 H SER A 137 -11.442 10.253 0.106 1.00 0.77 H new ATOM 0 HA SER A 137 -8.892 9.653 1.444 1.00 0.57 H new ATOM 0 HB2 SER A 137 -10.131 7.504 1.392 1.00 0.67 H new ATOM 0 HB3 SER A 137 -10.438 7.701 -0.322 1.00 0.67 H new ATOM 0 HG SER A 137 -8.607 6.338 0.091 1.00 1.61 H new ATOM 744 N LYS A 138 -7.656 10.095 -0.723 1.00 0.38 N ATOM 745 CA LYS A 138 -6.980 10.646 -1.891 1.00 0.36 C ATOM 746 C LYS A 138 -6.854 9.592 -2.977 1.00 0.34 C ATOM 747 O LYS A 138 -6.410 9.870 -4.091 1.00 0.47 O ATOM 748 CB LYS A 138 -5.595 11.198 -1.529 1.00 0.36 C ATOM 749 CG LYS A 138 -5.605 12.167 -0.353 1.00 0.44 C ATOM 750 CD LYS A 138 -4.369 13.054 -0.316 1.00 0.67 C ATOM 751 CE LYS A 138 -4.375 14.063 -1.457 1.00 0.89 C ATOM 752 NZ LYS A 138 -3.269 15.050 -1.337 1.00 1.51 N ATOM 0 H LYS A 138 -7.031 9.774 0.016 1.00 0.38 H new ATOM 0 HA LYS A 138 -7.585 11.472 -2.265 1.00 0.36 H new ATOM 0 HB2 LYS A 138 -4.932 10.365 -1.295 1.00 0.36 H new ATOM 0 HB3 LYS A 138 -5.177 11.703 -2.400 1.00 0.36 H new ATOM 0 HG2 LYS A 138 -6.495 12.793 -0.410 1.00 0.44 H new ATOM 0 HG3 LYS A 138 -5.671 11.603 0.577 1.00 0.44 H new ATOM 0 HD2 LYS A 138 -4.326 13.581 0.637 1.00 0.67 H new ATOM 0 HD3 LYS A 138 -3.474 12.436 -0.380 1.00 0.67 H new ATOM 0 HE2 LYS A 138 -4.288 13.536 -2.407 1.00 0.89 H new ATOM 0 HE3 LYS A 138 -5.330 14.589 -1.470 1.00 0.89 H new ATOM 0 HZ1 LYS A 138 -3.311 15.717 -2.134 1.00 1.51 H new ATOM 0 HZ2 LYS A 138 -3.365 15.572 -0.443 1.00 1.51 H new ATOM 0 HZ3 LYS A 138 -2.356 14.552 -1.350 1.00 1.51 H new ATOM 766 N GLY A 139 -7.247 8.377 -2.642 1.00 0.27 N ATOM 767 CA GLY A 139 -7.269 7.318 -3.626 1.00 0.26 C ATOM 768 C GLY A 139 -6.188 6.282 -3.423 1.00 0.21 C ATOM 769 O GLY A 139 -6.306 5.161 -3.905 1.00 0.31 O ATOM 0 H GLY A 139 -7.551 8.104 -1.708 1.00 0.27 H new ATOM 0 HA2 GLY A 139 -8.242 6.827 -3.597 1.00 0.26 H new ATOM 0 HA3 GLY A 139 -7.161 7.754 -4.619 1.00 0.26 H new ATOM 773 N TYR A 140 -5.135 6.637 -2.712 1.00 0.19 N ATOM 774 CA TYR A 140 -3.997 5.741 -2.581 1.00 0.15 C ATOM 775 C TYR A 140 -3.605 5.542 -1.121 1.00 0.13 C ATOM 776 O TYR A 140 -3.829 6.413 -0.275 1.00 0.16 O ATOM 777 CB TYR A 140 -2.811 6.259 -3.403 1.00 0.19 C ATOM 778 CG TYR A 140 -2.333 7.640 -3.024 1.00 0.23 C ATOM 779 CD1 TYR A 140 -3.029 8.765 -3.439 1.00 0.26 C ATOM 780 CD2 TYR A 140 -1.202 7.819 -2.235 1.00 0.31 C ATOM 781 CE1 TYR A 140 -2.614 10.031 -3.086 1.00 0.34 C ATOM 782 CE2 TYR A 140 -0.783 9.085 -1.871 1.00 0.39 C ATOM 783 CZ TYR A 140 -1.414 10.173 -2.354 1.00 0.41 C ATOM 784 OH TYR A 140 -1.093 11.451 -1.940 1.00 0.49 O ATOM 0 H TYR A 140 -5.041 7.526 -2.221 1.00 0.19 H new ATOM 0 HA TYR A 140 -4.290 4.767 -2.973 1.00 0.15 H new ATOM 0 HB2 TYR A 140 -1.981 5.561 -3.297 1.00 0.19 H new ATOM 0 HB3 TYR A 140 -3.091 6.263 -4.456 1.00 0.19 H new ATOM 0 HD1 TYR A 140 -3.912 8.647 -4.050 1.00 0.26 H new ATOM 0 HD2 TYR A 140 -0.643 6.957 -1.902 1.00 0.31 H new ATOM 0 HE1 TYR A 140 -3.195 10.898 -3.364 1.00 0.34 H new ATOM 0 HE2 TYR A 140 0.053 9.202 -1.197 1.00 0.39 H new ATOM 0 HH TYR A 140 -0.248 11.432 -1.444 1.00 0.49 H new ATOM 794 N GLY A 141 -3.029 4.383 -0.841 1.00 0.11 N ATOM 795 CA GLY A 141 -2.625 4.046 0.506 1.00 0.11 C ATOM 796 C GLY A 141 -1.308 3.300 0.523 1.00 0.10 C ATOM 797 O GLY A 141 -0.797 2.926 -0.532 1.00 0.12 O ATOM 0 H GLY A 141 -2.832 3.661 -1.534 1.00 0.11 H new ATOM 0 HA2 GLY A 141 -2.536 4.957 1.098 1.00 0.11 H new ATOM 0 HA3 GLY A 141 -3.396 3.435 0.976 1.00 0.11 H new ATOM 801 N PHE A 142 -0.757 3.079 1.708 1.00 0.10 N ATOM 802 CA PHE A 142 0.543 2.429 1.838 1.00 0.10 C ATOM 803 C PHE A 142 0.519 1.379 2.945 1.00 0.10 C ATOM 804 O PHE A 142 -0.062 1.604 4.010 1.00 0.14 O ATOM 805 CB PHE A 142 1.632 3.462 2.157 1.00 0.12 C ATOM 806 CG PHE A 142 1.618 4.678 1.270 1.00 0.14 C ATOM 807 CD1 PHE A 142 1.977 4.575 -0.062 1.00 0.16 C ATOM 808 CD2 PHE A 142 1.255 5.924 1.768 1.00 0.21 C ATOM 809 CE1 PHE A 142 1.975 5.683 -0.884 1.00 0.19 C ATOM 810 CE2 PHE A 142 1.256 7.035 0.949 1.00 0.25 C ATOM 811 CZ PHE A 142 1.615 6.915 -0.377 1.00 0.22 C ATOM 0 H PHE A 142 -1.189 3.340 2.595 1.00 0.10 H new ATOM 0 HA PHE A 142 0.765 1.944 0.887 1.00 0.10 H new ATOM 0 HB2 PHE A 142 1.519 3.782 3.193 1.00 0.12 H new ATOM 0 HB3 PHE A 142 2.607 2.980 2.077 1.00 0.12 H new ATOM 0 HD1 PHE A 142 2.263 3.614 -0.464 1.00 0.16 H new ATOM 0 HD2 PHE A 142 0.970 6.024 2.805 1.00 0.21 H new ATOM 0 HE1 PHE A 142 2.255 5.586 -1.923 1.00 0.19 H new ATOM 0 HE2 PHE A 142 0.975 7.999 1.347 1.00 0.25 H new ATOM 0 HZ PHE A 142 1.614 7.784 -1.018 1.00 0.22 H new ATOM 821 N VAL A 143 1.137 0.229 2.692 1.00 0.08 N ATOM 822 CA VAL A 143 1.323 -0.779 3.731 1.00 0.08 C ATOM 823 C VAL A 143 2.783 -0.887 4.116 1.00 0.08 C ATOM 824 O VAL A 143 3.665 -0.922 3.256 1.00 0.09 O ATOM 825 CB VAL A 143 0.852 -2.185 3.298 1.00 0.08 C ATOM 826 CG1 VAL A 143 0.991 -3.195 4.440 1.00 0.07 C ATOM 827 CG2 VAL A 143 -0.575 -2.140 2.812 1.00 0.10 C ATOM 0 H VAL A 143 1.516 -0.028 1.780 1.00 0.08 H new ATOM 0 HA VAL A 143 0.716 -0.447 4.573 1.00 0.08 H new ATOM 0 HB VAL A 143 1.493 -2.511 2.479 1.00 0.08 H new ATOM 0 HG11 VAL A 143 0.651 -4.174 4.103 1.00 0.07 H new ATOM 0 HG12 VAL A 143 2.036 -3.258 4.745 1.00 0.07 H new ATOM 0 HG13 VAL A 143 0.385 -2.872 5.287 1.00 0.07 H new ATOM 0 HG21 VAL A 143 -0.889 -3.140 2.511 1.00 0.10 H new ATOM 0 HG22 VAL A 143 -1.221 -1.783 3.614 1.00 0.10 H new ATOM 0 HG23 VAL A 143 -0.648 -1.465 1.959 1.00 0.10 H new ATOM 837 N HIS A 144 3.035 -0.915 5.407 1.00 0.09 N ATOM 838 CA HIS A 144 4.337 -1.282 5.910 1.00 0.10 C ATOM 839 C HIS A 144 4.273 -2.692 6.459 1.00 0.10 C ATOM 840 O HIS A 144 3.718 -2.914 7.532 1.00 0.11 O ATOM 841 CB HIS A 144 4.766 -0.319 7.010 1.00 0.12 C ATOM 842 CG HIS A 144 5.766 0.690 6.558 1.00 0.14 C ATOM 843 ND1 HIS A 144 6.686 1.271 7.403 1.00 0.18 N ATOM 844 CD2 HIS A 144 6.014 1.188 5.331 1.00 0.17 C ATOM 845 CE1 HIS A 144 7.460 2.083 6.712 1.00 0.21 C ATOM 846 NE2 HIS A 144 7.068 2.061 5.457 1.00 0.21 N ATOM 0 H HIS A 144 2.351 -0.687 6.128 1.00 0.09 H new ATOM 0 HA HIS A 144 5.066 -1.233 5.101 1.00 0.10 H new ATOM 0 HB2 HIS A 144 3.886 0.199 7.393 1.00 0.12 H new ATOM 0 HB3 HIS A 144 5.186 -0.889 7.839 1.00 0.12 H new ATOM 0 HD2 HIS A 144 5.485 0.947 4.421 1.00 0.17 H new ATOM 0 HE1 HIS A 144 8.277 2.667 7.109 1.00 0.21 H new ATOM 0 HE2 HIS A 144 7.480 2.605 4.699 1.00 0.21 H new ATOM 855 N PHE A 145 4.826 -3.640 5.729 1.00 0.10 N ATOM 856 CA PHE A 145 4.838 -5.018 6.178 1.00 0.10 C ATOM 857 C PHE A 145 6.075 -5.302 6.995 1.00 0.13 C ATOM 858 O PHE A 145 7.168 -4.825 6.681 1.00 0.17 O ATOM 859 CB PHE A 145 4.758 -5.993 5.005 1.00 0.10 C ATOM 860 CG PHE A 145 3.357 -6.320 4.582 1.00 0.09 C ATOM 861 CD1 PHE A 145 2.547 -7.115 5.372 1.00 0.10 C ATOM 862 CD2 PHE A 145 2.847 -5.816 3.397 1.00 0.09 C ATOM 863 CE1 PHE A 145 1.253 -7.403 4.986 1.00 0.11 C ATOM 864 CE2 PHE A 145 1.553 -6.100 3.008 1.00 0.10 C ATOM 865 CZ PHE A 145 0.773 -6.960 3.792 1.00 0.10 C ATOM 0 H PHE A 145 5.272 -3.482 4.825 1.00 0.10 H new ATOM 0 HA PHE A 145 3.956 -5.162 6.802 1.00 0.10 H new ATOM 0 HB2 PHE A 145 5.294 -5.569 4.156 1.00 0.10 H new ATOM 0 HB3 PHE A 145 5.270 -6.916 5.277 1.00 0.10 H new ATOM 0 HD1 PHE A 145 2.930 -7.514 6.299 1.00 0.10 H new ATOM 0 HD2 PHE A 145 3.469 -5.194 2.770 1.00 0.09 H new ATOM 0 HE1 PHE A 145 0.617 -7.984 5.637 1.00 0.11 H new ATOM 0 HE2 PHE A 145 1.146 -5.663 2.108 1.00 0.10 H new ATOM 0 HZ PHE A 145 -0.204 -7.270 3.451 1.00 0.10 H new ATOM 875 N GLU A 146 5.874 -6.061 8.057 1.00 0.13 N ATOM 876 CA GLU A 146 6.966 -6.467 8.947 1.00 0.17 C ATOM 877 C GLU A 146 8.093 -7.095 8.143 1.00 0.19 C ATOM 878 O GLU A 146 9.273 -6.807 8.346 1.00 0.22 O ATOM 879 CB GLU A 146 6.475 -7.475 9.989 1.00 0.22 C ATOM 880 CG GLU A 146 7.502 -7.755 11.075 1.00 0.30 C ATOM 881 CD GLU A 146 6.987 -8.678 12.153 1.00 0.37 C ATOM 882 OE1 GLU A 146 6.240 -8.208 13.034 1.00 0.38 O ATOM 883 OE2 GLU A 146 7.311 -9.882 12.116 1.00 0.57 O ATOM 0 H GLU A 146 4.958 -6.416 8.333 1.00 0.13 H new ATOM 0 HA GLU A 146 7.330 -5.575 9.458 1.00 0.17 H new ATOM 0 HB2 GLU A 146 5.562 -7.098 10.449 1.00 0.22 H new ATOM 0 HB3 GLU A 146 6.218 -8.409 9.490 1.00 0.22 H new ATOM 0 HG2 GLU A 146 8.390 -8.195 10.622 1.00 0.30 H new ATOM 0 HG3 GLU A 146 7.809 -6.812 11.528 1.00 0.30 H new ATOM 890 N THR A 147 7.701 -7.946 7.221 1.00 0.22 N ATOM 891 CA THR A 147 8.645 -8.649 6.373 1.00 0.26 C ATOM 892 C THR A 147 8.537 -8.171 4.928 1.00 0.23 C ATOM 893 O THR A 147 7.468 -7.754 4.474 1.00 0.21 O ATOM 894 CB THR A 147 8.418 -10.171 6.423 1.00 0.33 C ATOM 895 OG1 THR A 147 7.072 -10.482 6.045 1.00 0.40 O ATOM 896 CG2 THR A 147 8.696 -10.722 7.813 1.00 0.35 C ATOM 0 H THR A 147 6.724 -8.171 7.036 1.00 0.22 H new ATOM 0 HA THR A 147 9.643 -8.430 6.752 1.00 0.26 H new ATOM 0 HB THR A 147 9.111 -10.636 5.721 1.00 0.33 H new ATOM 0 HG1 THR A 147 6.939 -11.452 6.078 1.00 0.40 H new ATOM 0 HG21 THR A 147 8.527 -11.799 7.818 1.00 0.35 H new ATOM 0 HG22 THR A 147 9.731 -10.515 8.086 1.00 0.35 H new ATOM 0 HG23 THR A 147 8.029 -10.247 8.533 1.00 0.35 H new ATOM 904 N GLN A 148 9.648 -8.237 4.211 1.00 0.24 N ATOM 905 CA GLN A 148 9.691 -7.821 2.819 1.00 0.23 C ATOM 906 C GLN A 148 8.877 -8.779 1.946 1.00 0.21 C ATOM 907 O GLN A 148 8.223 -8.355 0.990 1.00 0.21 O ATOM 908 CB GLN A 148 11.150 -7.768 2.341 1.00 0.28 C ATOM 909 CG GLN A 148 11.334 -7.156 0.961 1.00 0.31 C ATOM 910 CD GLN A 148 10.740 -5.767 0.858 1.00 0.34 C ATOM 911 OE1 GLN A 148 11.398 -4.765 1.123 1.00 0.47 O ATOM 912 NE2 GLN A 148 9.477 -5.705 0.488 1.00 0.38 N ATOM 0 H GLN A 148 10.538 -8.578 4.574 1.00 0.24 H new ATOM 0 HA GLN A 148 9.251 -6.827 2.733 1.00 0.23 H new ATOM 0 HB2 GLN A 148 11.735 -7.196 3.061 1.00 0.28 H new ATOM 0 HB3 GLN A 148 11.555 -8.780 2.334 1.00 0.28 H new ATOM 0 HG2 GLN A 148 12.397 -7.111 0.726 1.00 0.31 H new ATOM 0 HG3 GLN A 148 10.870 -7.802 0.216 1.00 0.31 H new ATOM 0 HE21 GLN A 148 8.965 -6.561 0.276 1.00 0.38 H new ATOM 0 HE22 GLN A 148 9.011 -4.801 0.413 1.00 0.38 H new ATOM 921 N GLU A 149 8.905 -10.063 2.297 1.00 0.22 N ATOM 922 CA GLU A 149 8.228 -11.091 1.510 1.00 0.22 C ATOM 923 C GLU A 149 6.704 -10.967 1.603 1.00 0.18 C ATOM 924 O GLU A 149 5.996 -11.238 0.631 1.00 0.17 O ATOM 925 CB GLU A 149 8.683 -12.496 1.924 1.00 0.28 C ATOM 926 CG GLU A 149 8.180 -12.932 3.280 1.00 0.35 C ATOM 927 CD GLU A 149 8.400 -14.408 3.540 1.00 0.47 C ATOM 928 OE1 GLU A 149 7.501 -15.213 3.202 1.00 0.74 O ATOM 929 OE2 GLU A 149 9.461 -14.775 4.085 1.00 0.62 O ATOM 0 H GLU A 149 9.390 -10.416 3.122 1.00 0.22 H new ATOM 0 HA GLU A 149 8.509 -10.934 0.469 1.00 0.22 H new ATOM 0 HB2 GLU A 149 8.344 -13.212 1.175 1.00 0.28 H new ATOM 0 HB3 GLU A 149 9.773 -12.528 1.925 1.00 0.28 H new ATOM 0 HG2 GLU A 149 8.684 -12.352 4.053 1.00 0.35 H new ATOM 0 HG3 GLU A 149 7.116 -12.709 3.357 1.00 0.35 H new ATOM 936 N ALA A 150 6.200 -10.550 2.765 1.00 0.17 N ATOM 937 CA ALA A 150 4.759 -10.415 2.972 1.00 0.15 C ATOM 938 C ALA A 150 4.189 -9.329 2.073 1.00 0.13 C ATOM 939 O ALA A 150 3.068 -9.439 1.574 1.00 0.13 O ATOM 940 CB ALA A 150 4.461 -10.103 4.429 1.00 0.18 C ATOM 0 H ALA A 150 6.767 -10.301 3.575 1.00 0.17 H new ATOM 0 HA ALA A 150 4.284 -11.362 2.713 1.00 0.15 H new ATOM 0 HB1 ALA A 150 3.384 -10.005 4.567 1.00 0.18 H new ATOM 0 HB2 ALA A 150 4.836 -10.910 5.058 1.00 0.18 H new ATOM 0 HB3 ALA A 150 4.949 -9.169 4.708 1.00 0.18 H new ATOM 946 N ALA A 151 4.983 -8.292 1.859 1.00 0.13 N ATOM 947 CA ALA A 151 4.594 -7.192 0.993 1.00 0.13 C ATOM 948 C ALA A 151 4.391 -7.673 -0.434 1.00 0.12 C ATOM 949 O ALA A 151 3.401 -7.331 -1.078 1.00 0.13 O ATOM 950 CB ALA A 151 5.652 -6.110 1.041 1.00 0.16 C ATOM 0 H ALA A 151 5.908 -8.190 2.277 1.00 0.13 H new ATOM 0 HA ALA A 151 3.647 -6.784 1.347 1.00 0.13 H new ATOM 0 HB1 ALA A 151 5.359 -5.286 0.391 1.00 0.16 H new ATOM 0 HB2 ALA A 151 5.755 -5.747 2.064 1.00 0.16 H new ATOM 0 HB3 ALA A 151 6.605 -6.518 0.703 1.00 0.16 H new ATOM 956 N GLU A 152 5.329 -8.477 -0.914 1.00 0.13 N ATOM 957 CA GLU A 152 5.255 -9.033 -2.257 1.00 0.14 C ATOM 958 C GLU A 152 3.981 -9.861 -2.432 1.00 0.12 C ATOM 959 O GLU A 152 3.357 -9.830 -3.491 1.00 0.15 O ATOM 960 CB GLU A 152 6.491 -9.889 -2.536 1.00 0.18 C ATOM 961 CG GLU A 152 7.796 -9.184 -2.201 1.00 0.26 C ATOM 962 CD GLU A 152 9.019 -9.967 -2.632 1.00 0.75 C ATOM 963 OE1 GLU A 152 9.190 -11.112 -2.159 1.00 1.42 O ATOM 964 OE2 GLU A 152 9.810 -9.451 -3.443 1.00 0.95 O ATOM 0 H GLU A 152 6.156 -8.760 -0.388 1.00 0.13 H new ATOM 0 HA GLU A 152 5.225 -8.211 -2.972 1.00 0.14 H new ATOM 0 HB2 GLU A 152 6.425 -10.811 -1.958 1.00 0.18 H new ATOM 0 HB3 GLU A 152 6.499 -10.173 -3.588 1.00 0.18 H new ATOM 0 HG2 GLU A 152 7.809 -8.206 -2.683 1.00 0.26 H new ATOM 0 HG3 GLU A 152 7.843 -9.010 -1.126 1.00 0.26 H new ATOM 971 N ARG A 153 3.592 -10.582 -1.378 1.00 0.10 N ATOM 972 CA ARG A 153 2.357 -11.359 -1.394 1.00 0.12 C ATOM 973 C ARG A 153 1.154 -10.441 -1.569 1.00 0.11 C ATOM 974 O ARG A 153 0.256 -10.719 -2.360 1.00 0.16 O ATOM 975 CB ARG A 153 2.179 -12.155 -0.103 1.00 0.16 C ATOM 976 CG ARG A 153 3.342 -13.066 0.241 1.00 0.21 C ATOM 977 CD ARG A 153 3.071 -13.829 1.527 1.00 0.26 C ATOM 978 NE ARG A 153 4.207 -14.649 1.939 1.00 0.38 N ATOM 979 CZ ARG A 153 4.105 -15.919 2.330 1.00 0.80 C ATOM 980 NH1 ARG A 153 2.936 -16.548 2.265 1.00 1.48 N ATOM 981 NH2 ARG A 153 5.179 -16.563 2.766 1.00 0.84 N ATOM 0 H ARG A 153 4.116 -10.642 -0.505 1.00 0.10 H new ATOM 0 HA ARG A 153 2.425 -12.053 -2.232 1.00 0.12 H new ATOM 0 HB2 ARG A 153 2.025 -11.458 0.720 1.00 0.16 H new ATOM 0 HB3 ARG A 153 1.274 -12.757 -0.184 1.00 0.16 H new ATOM 0 HG2 ARG A 153 3.512 -13.769 -0.575 1.00 0.21 H new ATOM 0 HG3 ARG A 153 4.252 -12.476 0.348 1.00 0.21 H new ATOM 0 HD2 ARG A 153 2.830 -13.123 2.321 1.00 0.26 H new ATOM 0 HD3 ARG A 153 2.197 -14.466 1.391 1.00 0.26 H new ATOM 0 HE ARG A 153 5.134 -14.224 1.927 1.00 0.38 H new ATOM 0 HH11 ARG A 153 2.112 -16.059 1.915 1.00 1.48 H new ATOM 0 HH12 ARG A 153 2.862 -17.520 2.565 1.00 1.48 H new ATOM 0 HH21 ARG A 153 6.080 -16.086 2.801 1.00 0.84 H new ATOM 0 HH22 ARG A 153 5.104 -17.535 3.066 1.00 0.84 H new ATOM 995 N ALA A 154 1.140 -9.346 -0.815 1.00 0.09 N ATOM 996 CA ALA A 154 0.059 -8.375 -0.900 1.00 0.09 C ATOM 997 C ALA A 154 -0.009 -7.772 -2.299 1.00 0.09 C ATOM 998 O ALA A 154 -1.090 -7.506 -2.816 1.00 0.10 O ATOM 999 CB ALA A 154 0.238 -7.285 0.146 1.00 0.10 C ATOM 0 H ALA A 154 1.866 -9.111 -0.139 1.00 0.09 H new ATOM 0 HA ALA A 154 -0.882 -8.888 -0.702 1.00 0.09 H new ATOM 0 HB1 ALA A 154 -0.579 -6.568 0.068 1.00 0.10 H new ATOM 0 HB2 ALA A 154 0.235 -7.731 1.141 1.00 0.10 H new ATOM 0 HB3 ALA A 154 1.186 -6.774 -0.020 1.00 0.10 H new ATOM 1005 N ILE A 155 1.154 -7.575 -2.906 1.00 0.09 N ATOM 1006 CA ILE A 155 1.234 -7.032 -4.255 1.00 0.10 C ATOM 1007 C ILE A 155 0.543 -7.946 -5.263 1.00 0.11 C ATOM 1008 O ILE A 155 -0.345 -7.514 -5.987 1.00 0.14 O ATOM 1009 CB ILE A 155 2.701 -6.816 -4.679 1.00 0.11 C ATOM 1010 CG1 ILE A 155 3.360 -5.783 -3.769 1.00 0.12 C ATOM 1011 CG2 ILE A 155 2.788 -6.379 -6.135 1.00 0.14 C ATOM 1012 CD1 ILE A 155 4.835 -5.598 -4.031 1.00 0.15 C ATOM 0 H ILE A 155 2.058 -7.784 -2.483 1.00 0.09 H new ATOM 0 HA ILE A 155 0.721 -6.070 -4.244 1.00 0.10 H new ATOM 0 HB ILE A 155 3.232 -7.763 -4.581 1.00 0.11 H new ATOM 0 HG12 ILE A 155 2.855 -4.826 -3.895 1.00 0.12 H new ATOM 0 HG13 ILE A 155 3.219 -6.084 -2.731 1.00 0.12 H new ATOM 0 HG21 ILE A 155 3.833 -6.233 -6.409 1.00 0.14 H new ATOM 0 HG22 ILE A 155 2.349 -7.147 -6.772 1.00 0.14 H new ATOM 0 HG23 ILE A 155 2.244 -5.444 -6.267 1.00 0.14 H new ATOM 0 HD11 ILE A 155 5.235 -4.849 -3.347 1.00 0.15 H new ATOM 0 HD12 ILE A 155 5.353 -6.544 -3.877 1.00 0.15 H new ATOM 0 HD13 ILE A 155 4.983 -5.267 -5.059 1.00 0.15 H new ATOM 1024 N GLU A 156 0.934 -9.210 -5.296 1.00 0.11 N ATOM 1025 CA GLU A 156 0.349 -10.156 -6.237 1.00 0.13 C ATOM 1026 C GLU A 156 -1.129 -10.382 -5.971 1.00 0.12 C ATOM 1027 O GLU A 156 -1.947 -10.427 -6.893 1.00 0.15 O ATOM 1028 CB GLU A 156 1.066 -11.505 -6.201 1.00 0.17 C ATOM 1029 CG GLU A 156 1.534 -11.947 -4.825 1.00 0.21 C ATOM 1030 CD GLU A 156 1.888 -13.412 -4.790 1.00 0.62 C ATOM 1031 OE1 GLU A 156 0.991 -14.240 -4.525 1.00 1.08 O ATOM 1032 OE2 GLU A 156 3.062 -13.745 -5.041 1.00 0.63 O ATOM 0 H GLU A 156 1.650 -9.605 -4.686 1.00 0.11 H new ATOM 0 HA GLU A 156 0.469 -9.709 -7.224 1.00 0.13 H new ATOM 0 HB2 GLU A 156 0.397 -12.266 -6.602 1.00 0.17 H new ATOM 0 HB3 GLU A 156 1.930 -11.458 -6.864 1.00 0.17 H new ATOM 0 HG2 GLU A 156 2.403 -11.358 -4.531 1.00 0.21 H new ATOM 0 HG3 GLU A 156 0.751 -11.746 -4.094 1.00 0.21 H new ATOM 1039 N LYS A 157 -1.455 -10.523 -4.707 1.00 0.09 N ATOM 1040 CA LYS A 157 -2.770 -10.955 -4.300 1.00 0.10 C ATOM 1041 C LYS A 157 -3.804 -9.832 -4.353 1.00 0.08 C ATOM 1042 O LYS A 157 -4.948 -10.058 -4.742 1.00 0.10 O ATOM 1043 CB LYS A 157 -2.686 -11.536 -2.890 1.00 0.12 C ATOM 1044 CG LYS A 157 -3.381 -12.878 -2.755 1.00 0.17 C ATOM 1045 CD LYS A 157 -4.873 -12.782 -3.048 1.00 0.21 C ATOM 1046 CE LYS A 157 -5.690 -12.411 -1.814 1.00 0.29 C ATOM 1047 NZ LYS A 157 -7.145 -12.590 -2.043 1.00 1.16 N ATOM 0 H LYS A 157 -0.816 -10.341 -3.933 1.00 0.09 H new ATOM 0 HA LYS A 157 -3.106 -11.715 -5.005 1.00 0.10 H new ATOM 0 HB2 LYS A 157 -1.638 -11.647 -2.611 1.00 0.12 H new ATOM 0 HB3 LYS A 157 -3.130 -10.832 -2.187 1.00 0.12 H new ATOM 0 HG2 LYS A 157 -2.923 -13.593 -3.438 1.00 0.17 H new ATOM 0 HG3 LYS A 157 -3.234 -13.262 -1.746 1.00 0.17 H new ATOM 0 HD2 LYS A 157 -5.040 -12.038 -3.827 1.00 0.21 H new ATOM 0 HD3 LYS A 157 -5.225 -13.737 -3.439 1.00 0.21 H new ATOM 0 HE2 LYS A 157 -5.376 -13.027 -0.971 1.00 0.29 H new ATOM 0 HE3 LYS A 157 -5.489 -11.374 -1.543 1.00 0.29 H new ATOM 0 HZ1 LYS A 157 -7.667 -12.328 -1.182 1.00 1.16 H new ATOM 0 HZ2 LYS A 157 -7.450 -11.983 -2.831 1.00 1.16 H new ATOM 0 HZ3 LYS A 157 -7.340 -13.585 -2.277 1.00 1.16 H new ATOM 1061 N MET A 158 -3.405 -8.629 -3.977 1.00 0.07 N ATOM 1062 CA MET A 158 -4.352 -7.521 -3.894 1.00 0.08 C ATOM 1063 C MET A 158 -4.405 -6.705 -5.175 1.00 0.09 C ATOM 1064 O MET A 158 -5.409 -6.045 -5.446 1.00 0.13 O ATOM 1065 CB MET A 158 -4.029 -6.602 -2.717 1.00 0.09 C ATOM 1066 CG MET A 158 -4.177 -7.278 -1.370 1.00 0.10 C ATOM 1067 SD MET A 158 -5.803 -8.025 -1.151 1.00 0.35 S ATOM 1068 CE MET A 158 -6.859 -6.614 -1.460 1.00 0.18 C ATOM 0 H MET A 158 -2.445 -8.392 -3.726 1.00 0.07 H new ATOM 0 HA MET A 158 -5.332 -7.972 -3.740 1.00 0.08 H new ATOM 0 HB2 MET A 158 -3.008 -6.235 -2.821 1.00 0.09 H new ATOM 0 HB3 MET A 158 -4.685 -5.733 -2.753 1.00 0.09 H new ATOM 0 HG2 MET A 158 -3.410 -8.046 -1.266 1.00 0.10 H new ATOM 0 HG3 MET A 158 -4.006 -6.548 -0.579 1.00 0.10 H new ATOM 0 HE1 MET A 158 -7.879 -6.850 -1.158 1.00 0.18 H new ATOM 0 HE2 MET A 158 -6.500 -5.759 -0.888 1.00 0.18 H new ATOM 0 HE3 MET A 158 -6.842 -6.372 -2.523 1.00 0.18 H new ATOM 1078 N ASN A 159 -3.337 -6.736 -5.959 1.00 0.09 N ATOM 1079 CA ASN A 159 -3.309 -5.973 -7.199 1.00 0.10 C ATOM 1080 C ASN A 159 -4.361 -6.513 -8.162 1.00 0.13 C ATOM 1081 O ASN A 159 -4.361 -7.703 -8.487 1.00 0.16 O ATOM 1082 CB ASN A 159 -1.926 -6.042 -7.853 1.00 0.14 C ATOM 1083 CG ASN A 159 -1.817 -5.182 -9.103 1.00 0.16 C ATOM 1084 OD1 ASN A 159 -2.588 -4.239 -9.290 1.00 0.44 O ATOM 1085 ND2 ASN A 159 -0.832 -5.473 -9.942 1.00 0.38 N ATOM 0 H ASN A 159 -2.491 -7.272 -5.764 1.00 0.09 H new ATOM 0 HA ASN A 159 -3.528 -4.931 -6.965 1.00 0.10 H new ATOM 0 HB2 ASN A 159 -1.173 -5.723 -7.132 1.00 0.14 H new ATOM 0 HB3 ASN A 159 -1.703 -7.077 -8.110 1.00 0.14 H new ATOM 0 HD21 ASN A 159 -0.691 -4.907 -10.779 1.00 0.38 H new ATOM 0 HD22 ASN A 159 -0.215 -6.263 -9.750 1.00 0.38 H new ATOM 1092 N GLY A 160 -5.252 -5.643 -8.608 1.00 0.14 N ATOM 1093 CA GLY A 160 -6.279 -6.046 -9.545 1.00 0.19 C ATOM 1094 C GLY A 160 -7.529 -6.571 -8.862 1.00 0.22 C ATOM 1095 O GLY A 160 -8.377 -7.193 -9.502 1.00 0.29 O ATOM 0 H GLY A 160 -5.283 -4.660 -8.337 1.00 0.14 H new ATOM 0 HA2 GLY A 160 -6.544 -5.196 -10.173 1.00 0.19 H new ATOM 0 HA3 GLY A 160 -5.880 -6.817 -10.204 1.00 0.19 H new ATOM 1099 N MET A 161 -7.655 -6.322 -7.566 1.00 0.22 N ATOM 1100 CA MET A 161 -8.821 -6.771 -6.818 1.00 0.27 C ATOM 1101 C MET A 161 -9.747 -5.619 -6.473 1.00 0.24 C ATOM 1102 O MET A 161 -9.347 -4.461 -6.504 1.00 0.23 O ATOM 1103 CB MET A 161 -8.396 -7.495 -5.550 1.00 0.32 C ATOM 1104 CG MET A 161 -8.325 -8.995 -5.738 1.00 0.68 C ATOM 1105 SD MET A 161 -9.899 -9.670 -6.304 1.00 1.18 S ATOM 1106 CE MET A 161 -9.340 -11.079 -7.253 1.00 1.04 C ATOM 0 H MET A 161 -6.966 -5.813 -7.012 1.00 0.22 H new ATOM 0 HA MET A 161 -9.370 -7.462 -7.458 1.00 0.27 H new ATOM 0 HB2 MET A 161 -7.421 -7.125 -5.233 1.00 0.32 H new ATOM 0 HB3 MET A 161 -9.100 -7.265 -4.750 1.00 0.32 H new ATOM 0 HG2 MET A 161 -7.545 -9.235 -6.461 1.00 0.68 H new ATOM 0 HG3 MET A 161 -8.044 -9.467 -4.797 1.00 0.68 H new ATOM 0 HE1 MET A 161 -10.201 -11.602 -7.670 1.00 1.04 H new ATOM 0 HE2 MET A 161 -8.695 -10.739 -8.063 1.00 1.04 H new ATOM 0 HE3 MET A 161 -8.783 -11.756 -6.605 1.00 1.04 H new ATOM 1116 N LEU A 162 -10.980 -5.954 -6.120 1.00 0.26 N ATOM 1117 CA LEU A 162 -11.986 -4.956 -5.813 1.00 0.26 C ATOM 1118 C LEU A 162 -12.091 -4.784 -4.324 1.00 0.28 C ATOM 1119 O LEU A 162 -12.579 -5.670 -3.623 1.00 0.44 O ATOM 1120 CB LEU A 162 -13.370 -5.348 -6.345 1.00 0.31 C ATOM 1121 CG LEU A 162 -13.593 -5.190 -7.847 1.00 0.34 C ATOM 1122 CD1 LEU A 162 -15.028 -5.530 -8.189 1.00 0.42 C ATOM 1123 CD2 LEU A 162 -13.289 -3.773 -8.282 1.00 0.34 C ATOM 0 H LEU A 162 -11.306 -6.917 -6.040 1.00 0.26 H new ATOM 0 HA LEU A 162 -11.675 -4.030 -6.296 1.00 0.26 H new ATOM 0 HB2 LEU A 162 -13.555 -6.389 -6.080 1.00 0.31 H new ATOM 0 HB3 LEU A 162 -14.118 -4.749 -5.824 1.00 0.31 H new ATOM 0 HG LEU A 162 -12.922 -5.869 -8.372 1.00 0.34 H new ATOM 0 HD11 LEU A 162 -15.183 -5.416 -9.262 1.00 0.42 H new ATOM 0 HD12 LEU A 162 -15.237 -6.560 -7.900 1.00 0.42 H new ATOM 0 HD13 LEU A 162 -15.699 -4.859 -7.652 1.00 0.42 H new ATOM 0 HD21 LEU A 162 -13.453 -3.679 -9.355 1.00 0.34 H new ATOM 0 HD22 LEU A 162 -13.944 -3.081 -7.752 1.00 0.34 H new ATOM 0 HD23 LEU A 162 -12.250 -3.537 -8.052 1.00 0.34 H new ATOM 1135 N LEU A 163 -11.626 -3.666 -3.829 1.00 0.25 N ATOM 1136 CA LEU A 163 -11.838 -3.356 -2.444 1.00 0.33 C ATOM 1137 C LEU A 163 -13.086 -2.506 -2.311 1.00 0.45 C ATOM 1138 O LEU A 163 -13.112 -1.354 -2.755 1.00 1.02 O ATOM 1139 CB LEU A 163 -10.626 -2.659 -1.828 1.00 0.29 C ATOM 1140 CG LEU A 163 -9.535 -3.607 -1.337 1.00 0.31 C ATOM 1141 CD1 LEU A 163 -8.337 -2.829 -0.824 1.00 0.31 C ATOM 1142 CD2 LEU A 163 -10.086 -4.513 -0.246 1.00 0.34 C ATOM 0 H LEU A 163 -11.106 -2.966 -4.357 1.00 0.25 H new ATOM 0 HA LEU A 163 -11.975 -4.287 -1.893 1.00 0.33 H new ATOM 0 HB2 LEU A 163 -10.197 -1.982 -2.567 1.00 0.29 H new ATOM 0 HB3 LEU A 163 -10.961 -2.046 -0.991 1.00 0.29 H new ATOM 0 HG LEU A 163 -9.206 -4.222 -2.175 1.00 0.31 H new ATOM 0 HD11 LEU A 163 -7.572 -3.525 -0.479 1.00 0.31 H new ATOM 0 HD12 LEU A 163 -7.932 -2.213 -1.627 1.00 0.31 H new ATOM 0 HD13 LEU A 163 -8.645 -2.190 0.003 1.00 0.31 H new ATOM 0 HD21 LEU A 163 -9.301 -5.186 0.099 1.00 0.34 H new ATOM 0 HD22 LEU A 163 -10.436 -3.906 0.589 1.00 0.34 H new ATOM 0 HD23 LEU A 163 -10.916 -5.097 -0.643 1.00 0.34 H new ATOM 1154 N ASN A 164 -14.125 -3.107 -1.740 1.00 0.41 N ATOM 1155 CA ASN A 164 -15.439 -2.483 -1.613 1.00 0.42 C ATOM 1156 C ASN A 164 -16.144 -2.428 -2.954 1.00 0.45 C ATOM 1157 O ASN A 164 -17.126 -3.134 -3.179 1.00 0.72 O ATOM 1158 CB ASN A 164 -15.357 -1.092 -0.968 1.00 0.49 C ATOM 1159 CG ASN A 164 -15.116 -1.165 0.526 1.00 1.06 C ATOM 1160 OD1 ASN A 164 -15.431 -2.165 1.172 1.00 1.71 O ATOM 1161 ND2 ASN A 164 -14.583 -0.097 1.095 1.00 1.07 N ATOM 0 H ASN A 164 -14.079 -4.048 -1.349 1.00 0.41 H new ATOM 0 HA ASN A 164 -16.031 -3.107 -0.944 1.00 0.42 H new ATOM 0 HB2 ASN A 164 -14.553 -0.524 -1.436 1.00 0.49 H new ATOM 0 HB3 ASN A 164 -16.284 -0.550 -1.158 1.00 0.49 H new ATOM 0 HD21 ASN A 164 -14.420 -0.083 2.102 1.00 1.07 H new ATOM 0 HD22 ASN A 164 -14.335 0.713 0.527 1.00 1.07 H new ATOM 1168 N ASP A 165 -15.612 -1.630 -3.847 1.00 0.42 N ATOM 1169 CA ASP A 165 -16.179 -1.471 -5.177 1.00 0.44 C ATOM 1170 C ASP A 165 -15.164 -0.864 -6.151 1.00 0.43 C ATOM 1171 O ASP A 165 -15.516 -0.439 -7.248 1.00 0.65 O ATOM 1172 CB ASP A 165 -17.437 -0.598 -5.114 1.00 0.55 C ATOM 1173 CG ASP A 165 -18.248 -0.628 -6.396 1.00 0.71 C ATOM 1174 OD1 ASP A 165 -18.917 -1.651 -6.668 1.00 0.82 O ATOM 1175 OD2 ASP A 165 -18.207 0.365 -7.151 1.00 0.85 O ATOM 0 H ASP A 165 -14.776 -1.071 -3.680 1.00 0.42 H new ATOM 0 HA ASP A 165 -16.446 -2.461 -5.547 1.00 0.44 H new ATOM 0 HB2 ASP A 165 -18.063 -0.933 -4.287 1.00 0.55 H new ATOM 0 HB3 ASP A 165 -17.148 0.431 -4.898 1.00 0.55 H new ATOM 1180 N ARG A 166 -13.895 -0.852 -5.772 1.00 0.32 N ATOM 1181 CA ARG A 166 -12.867 -0.234 -6.600 1.00 0.27 C ATOM 1182 C ARG A 166 -11.693 -1.179 -6.755 1.00 0.24 C ATOM 1183 O ARG A 166 -11.233 -1.769 -5.777 1.00 0.24 O ATOM 1184 CB ARG A 166 -12.381 1.086 -5.998 1.00 0.24 C ATOM 1185 CG ARG A 166 -13.476 2.112 -5.762 1.00 0.27 C ATOM 1186 CD ARG A 166 -12.886 3.469 -5.418 1.00 0.27 C ATOM 1187 NE ARG A 166 -13.864 4.351 -4.784 1.00 0.42 N ATOM 1188 CZ ARG A 166 -13.735 5.674 -4.699 1.00 0.58 C ATOM 1189 NH1 ARG A 166 -12.727 6.291 -5.299 1.00 0.96 N ATOM 1190 NH2 ARG A 166 -14.627 6.376 -4.015 1.00 0.70 N ATOM 0 H ARG A 166 -13.552 -1.260 -4.902 1.00 0.32 H new ATOM 0 HA ARG A 166 -13.306 -0.024 -7.575 1.00 0.27 H new ATOM 0 HB2 ARG A 166 -11.885 0.878 -5.050 1.00 0.24 H new ATOM 0 HB3 ARG A 166 -11.632 1.519 -6.661 1.00 0.24 H new ATOM 0 HG2 ARG A 166 -14.098 2.197 -6.653 1.00 0.27 H new ATOM 0 HG3 ARG A 166 -14.124 1.777 -4.952 1.00 0.27 H new ATOM 0 HD2 ARG A 166 -12.034 3.335 -4.751 1.00 0.27 H new ATOM 0 HD3 ARG A 166 -12.509 3.940 -6.326 1.00 0.27 H new ATOM 0 HE ARG A 166 -14.699 3.926 -4.381 1.00 0.42 H new ATOM 0 HH11 ARG A 166 -12.043 5.752 -5.831 1.00 0.96 H new ATOM 0 HH12 ARG A 166 -12.635 7.304 -5.229 1.00 0.96 H new ATOM 0 HH21 ARG A 166 -15.406 5.903 -3.558 1.00 0.70 H new ATOM 0 HH22 ARG A 166 -14.534 7.389 -3.946 1.00 0.70 H new ATOM 1204 N LYS A 167 -11.222 -1.335 -7.980 1.00 0.22 N ATOM 1205 CA LYS A 167 -10.104 -2.219 -8.250 1.00 0.20 C ATOM 1206 C LYS A 167 -8.810 -1.528 -7.863 1.00 0.17 C ATOM 1207 O LYS A 167 -8.466 -0.483 -8.418 1.00 0.22 O ATOM 1208 CB LYS A 167 -10.077 -2.613 -9.728 1.00 0.23 C ATOM 1209 CG LYS A 167 -9.170 -3.794 -10.023 1.00 0.40 C ATOM 1210 CD LYS A 167 -9.373 -4.328 -11.432 1.00 0.47 C ATOM 1211 CE LYS A 167 -10.298 -5.538 -11.453 1.00 0.53 C ATOM 1212 NZ LYS A 167 -10.353 -6.164 -12.799 1.00 1.00 N ATOM 0 H LYS A 167 -11.597 -0.861 -8.802 1.00 0.22 H new ATOM 0 HA LYS A 167 -10.216 -3.128 -7.659 1.00 0.20 H new ATOM 0 HB2 LYS A 167 -11.090 -2.854 -10.050 1.00 0.23 H new ATOM 0 HB3 LYS A 167 -9.750 -1.757 -10.318 1.00 0.23 H new ATOM 0 HG2 LYS A 167 -8.130 -3.494 -9.895 1.00 0.40 H new ATOM 0 HG3 LYS A 167 -9.363 -4.589 -9.302 1.00 0.40 H new ATOM 0 HD2 LYS A 167 -9.789 -3.542 -12.062 1.00 0.47 H new ATOM 0 HD3 LYS A 167 -8.408 -4.601 -11.859 1.00 0.47 H new ATOM 0 HE2 LYS A 167 -9.954 -6.272 -10.724 1.00 0.53 H new ATOM 0 HE3 LYS A 167 -11.301 -5.235 -11.151 1.00 0.53 H new ATOM 0 HZ1 LYS A 167 -10.992 -6.984 -12.775 1.00 1.00 H new ATOM 0 HZ2 LYS A 167 -10.705 -5.471 -13.490 1.00 1.00 H new ATOM 0 HZ3 LYS A 167 -9.400 -6.476 -13.076 1.00 1.00 H new ATOM 1226 N VAL A 168 -8.086 -2.115 -6.932 1.00 0.13 N ATOM 1227 CA VAL A 168 -6.905 -1.478 -6.393 1.00 0.12 C ATOM 1228 C VAL A 168 -5.644 -2.061 -6.998 1.00 0.11 C ATOM 1229 O VAL A 168 -5.555 -3.261 -7.261 1.00 0.13 O ATOM 1230 CB VAL A 168 -6.825 -1.593 -4.853 1.00 0.13 C ATOM 1231 CG1 VAL A 168 -7.921 -0.775 -4.194 1.00 0.17 C ATOM 1232 CG2 VAL A 168 -6.896 -3.047 -4.404 1.00 0.13 C ATOM 0 H VAL A 168 -8.295 -3.031 -6.534 1.00 0.13 H new ATOM 0 HA VAL A 168 -6.984 -0.423 -6.656 1.00 0.12 H new ATOM 0 HB VAL A 168 -5.861 -1.192 -4.539 1.00 0.13 H new ATOM 0 HG11 VAL A 168 -7.845 -0.871 -3.111 1.00 0.17 H new ATOM 0 HG12 VAL A 168 -7.811 0.273 -4.474 1.00 0.17 H new ATOM 0 HG13 VAL A 168 -8.894 -1.139 -4.523 1.00 0.17 H new ATOM 0 HG21 VAL A 168 -6.837 -3.095 -3.317 1.00 0.13 H new ATOM 0 HG22 VAL A 168 -7.837 -3.485 -4.736 1.00 0.13 H new ATOM 0 HG23 VAL A 168 -6.064 -3.603 -4.837 1.00 0.13 H new ATOM 1242 N PHE A 169 -4.686 -1.191 -7.236 1.00 0.11 N ATOM 1243 CA PHE A 169 -3.406 -1.587 -7.775 1.00 0.12 C ATOM 1244 C PHE A 169 -2.357 -1.513 -6.686 1.00 0.10 C ATOM 1245 O PHE A 169 -2.156 -0.463 -6.081 1.00 0.12 O ATOM 1246 CB PHE A 169 -3.038 -0.684 -8.956 1.00 0.18 C ATOM 1247 CG PHE A 169 -1.593 -0.732 -9.353 1.00 0.14 C ATOM 1248 CD1 PHE A 169 -1.138 -1.726 -10.198 1.00 0.25 C ATOM 1249 CD2 PHE A 169 -0.695 0.205 -8.878 1.00 0.18 C ATOM 1250 CE1 PHE A 169 0.191 -1.784 -10.567 1.00 0.30 C ATOM 1251 CE2 PHE A 169 0.637 0.155 -9.241 1.00 0.23 C ATOM 1252 CZ PHE A 169 1.082 -0.803 -10.087 1.00 0.26 C ATOM 0 H PHE A 169 -4.774 -0.190 -7.061 1.00 0.11 H new ATOM 0 HA PHE A 169 -3.459 -2.614 -8.137 1.00 0.12 H new ATOM 0 HB2 PHE A 169 -3.647 -0.966 -9.815 1.00 0.18 H new ATOM 0 HB3 PHE A 169 -3.298 0.344 -8.705 1.00 0.18 H new ATOM 0 HD1 PHE A 169 -1.830 -2.466 -10.574 1.00 0.25 H new ATOM 0 HD2 PHE A 169 -1.039 0.985 -8.215 1.00 0.18 H new ATOM 0 HE1 PHE A 169 0.544 -2.572 -11.216 1.00 0.30 H new ATOM 0 HE2 PHE A 169 1.328 0.885 -8.847 1.00 0.23 H new ATOM 0 HZ PHE A 169 2.117 -0.816 -10.394 1.00 0.26 H new ATOM 1262 N VAL A 170 -1.713 -2.629 -6.426 1.00 0.09 N ATOM 1263 CA VAL A 170 -0.675 -2.682 -5.416 1.00 0.10 C ATOM 1264 C VAL A 170 0.655 -3.011 -6.071 1.00 0.11 C ATOM 1265 O VAL A 170 0.768 -3.997 -6.797 1.00 0.13 O ATOM 1266 CB VAL A 170 -0.975 -3.739 -4.323 1.00 0.10 C ATOM 1267 CG1 VAL A 170 0.056 -3.678 -3.211 1.00 0.11 C ATOM 1268 CG2 VAL A 170 -2.376 -3.575 -3.751 1.00 0.09 C ATOM 0 H VAL A 170 -1.889 -3.515 -6.900 1.00 0.09 H new ATOM 0 HA VAL A 170 -0.636 -1.704 -4.936 1.00 0.10 H new ATOM 0 HB VAL A 170 -0.919 -4.718 -4.799 1.00 0.10 H new ATOM 0 HG11 VAL A 170 -0.177 -4.430 -2.457 1.00 0.11 H new ATOM 0 HG12 VAL A 170 1.047 -3.872 -3.622 1.00 0.11 H new ATOM 0 HG13 VAL A 170 0.040 -2.689 -2.754 1.00 0.11 H new ATOM 0 HG21 VAL A 170 -2.549 -4.334 -2.988 1.00 0.09 H new ATOM 0 HG22 VAL A 170 -2.474 -2.585 -3.306 1.00 0.09 H new ATOM 0 HG23 VAL A 170 -3.110 -3.689 -4.549 1.00 0.09 H new ATOM 1278 N GLY A 171 1.650 -2.177 -5.828 1.00 0.12 N ATOM 1279 CA GLY A 171 2.956 -2.398 -6.409 1.00 0.14 C ATOM 1280 C GLY A 171 4.070 -2.089 -5.434 1.00 0.14 C ATOM 1281 O GLY A 171 3.830 -1.937 -4.234 1.00 0.18 O ATOM 0 H GLY A 171 1.578 -1.349 -5.237 1.00 0.12 H new ATOM 0 HA2 GLY A 171 3.037 -3.435 -6.735 1.00 0.14 H new ATOM 0 HA3 GLY A 171 3.068 -1.775 -7.297 1.00 0.14 H new ATOM 1285 N ARG A 172 5.288 -1.981 -5.947 1.00 0.18 N ATOM 1286 CA ARG A 172 6.451 -1.741 -5.107 1.00 0.19 C ATOM 1287 C ARG A 172 6.497 -0.274 -4.694 1.00 0.22 C ATOM 1288 O ARG A 172 6.243 0.617 -5.506 1.00 0.36 O ATOM 1289 CB ARG A 172 7.739 -2.113 -5.851 1.00 0.23 C ATOM 1290 CG ARG A 172 7.738 -3.519 -6.439 1.00 0.32 C ATOM 1291 CD ARG A 172 8.034 -4.596 -5.403 1.00 0.39 C ATOM 1292 NE ARG A 172 7.772 -5.929 -5.947 1.00 1.03 N ATOM 1293 CZ ARG A 172 8.302 -7.060 -5.487 1.00 1.26 C ATOM 1294 NH1 ARG A 172 9.154 -7.043 -4.469 1.00 1.34 N ATOM 1295 NH2 ARG A 172 7.980 -8.213 -6.061 1.00 1.93 N ATOM 0 H ARG A 172 5.495 -2.056 -6.943 1.00 0.18 H new ATOM 0 HA ARG A 172 6.372 -2.365 -4.217 1.00 0.19 H new ATOM 0 HB2 ARG A 172 7.901 -1.395 -6.655 1.00 0.23 H new ATOM 0 HB3 ARG A 172 8.581 -2.019 -5.166 1.00 0.23 H new ATOM 0 HG2 ARG A 172 6.767 -3.716 -6.893 1.00 0.32 H new ATOM 0 HG3 ARG A 172 8.480 -3.575 -7.235 1.00 0.32 H new ATOM 0 HD2 ARG A 172 9.075 -4.526 -5.087 1.00 0.39 H new ATOM 0 HD3 ARG A 172 7.420 -4.433 -4.517 1.00 0.39 H new ATOM 0 HE ARG A 172 7.134 -5.997 -6.740 1.00 1.03 H new ATOM 0 HH11 ARG A 172 9.408 -6.157 -4.032 1.00 1.34 H new ATOM 0 HH12 ARG A 172 9.554 -7.916 -4.124 1.00 1.34 H new ATOM 0 HH21 ARG A 172 7.331 -8.227 -6.848 1.00 1.93 H new ATOM 0 HH22 ARG A 172 8.381 -9.085 -5.715 1.00 1.93 H new ATOM 1309 N PHE A 173 6.819 -0.030 -3.436 1.00 0.23 N ATOM 1310 CA PHE A 173 6.868 1.323 -2.906 1.00 0.29 C ATOM 1311 C PHE A 173 8.134 2.014 -3.397 1.00 0.80 C ATOM 1312 O PHE A 173 9.220 1.436 -3.336 1.00 1.44 O ATOM 1313 CB PHE A 173 6.830 1.258 -1.379 1.00 0.48 C ATOM 1314 CG PHE A 173 6.627 2.570 -0.676 1.00 0.42 C ATOM 1315 CD1 PHE A 173 7.705 3.389 -0.387 1.00 0.72 C ATOM 1316 CD2 PHE A 173 5.356 2.997 -0.328 1.00 0.35 C ATOM 1317 CE1 PHE A 173 7.519 4.604 0.241 1.00 0.71 C ATOM 1318 CE2 PHE A 173 5.168 4.215 0.299 1.00 0.37 C ATOM 1319 CZ PHE A 173 6.251 4.971 0.666 1.00 0.42 C ATOM 0 H PHE A 173 7.052 -0.756 -2.758 1.00 0.23 H new ATOM 0 HA PHE A 173 6.010 1.900 -3.252 1.00 0.29 H new ATOM 0 HB2 PHE A 173 6.030 0.580 -1.082 1.00 0.48 H new ATOM 0 HB3 PHE A 173 7.765 0.820 -1.029 1.00 0.48 H new ATOM 0 HD1 PHE A 173 8.702 3.074 -0.656 1.00 0.72 H new ATOM 0 HD2 PHE A 173 4.503 2.372 -0.549 1.00 0.35 H new ATOM 0 HE1 PHE A 173 8.357 5.266 0.401 1.00 0.71 H new ATOM 0 HE2 PHE A 173 4.168 4.571 0.500 1.00 0.37 H new ATOM 0 HZ PHE A 173 6.117 5.848 1.283 1.00 0.42 H new ATOM 1329 N LYS A 174 7.983 3.235 -3.899 1.00 1.17 N ATOM 1330 CA LYS A 174 9.093 3.971 -4.503 1.00 1.67 C ATOM 1331 C LYS A 174 10.290 4.063 -3.563 1.00 1.86 C ATOM 1332 O LYS A 174 11.411 3.726 -3.949 1.00 2.43 O ATOM 1333 CB LYS A 174 8.648 5.383 -4.888 1.00 2.20 C ATOM 1334 CG LYS A 174 7.484 5.432 -5.866 1.00 2.69 C ATOM 1335 CD LYS A 174 7.035 6.869 -6.132 1.00 3.30 C ATOM 1336 CE LYS A 174 7.948 7.600 -7.123 1.00 4.16 C ATOM 1337 NZ LYS A 174 9.342 7.759 -6.625 1.00 4.66 N ATOM 0 H LYS A 174 7.097 3.741 -3.900 1.00 1.17 H new ATOM 0 HA LYS A 174 9.396 3.421 -5.394 1.00 1.67 H new ATOM 0 HB2 LYS A 174 8.369 5.922 -3.983 1.00 2.20 H new ATOM 0 HB3 LYS A 174 9.496 5.911 -5.325 1.00 2.20 H new ATOM 0 HG2 LYS A 174 7.776 4.961 -6.805 1.00 2.69 H new ATOM 0 HG3 LYS A 174 6.648 4.857 -5.468 1.00 2.69 H new ATOM 0 HD2 LYS A 174 6.017 6.861 -6.520 1.00 3.30 H new ATOM 0 HD3 LYS A 174 7.013 7.419 -5.191 1.00 3.30 H new ATOM 0 HE2 LYS A 174 7.965 7.051 -8.065 1.00 4.16 H new ATOM 0 HE3 LYS A 174 7.530 8.584 -7.335 1.00 4.16 H new ATOM 0 HZ1 LYS A 174 9.773 8.598 -7.062 1.00 4.66 H new ATOM 0 HZ2 LYS A 174 9.330 7.874 -5.591 1.00 4.66 H new ATOM 0 HZ3 LYS A 174 9.898 6.916 -6.873 1.00 4.66 H new ATOM 1351 N SER A 175 10.033 4.525 -2.338 1.00 2.06 N ATOM 1352 CA SER A 175 11.074 4.730 -1.330 1.00 2.52 C ATOM 1353 C SER A 175 11.926 5.940 -1.697 1.00 2.93 C ATOM 1354 O SER A 175 11.837 6.464 -2.812 1.00 3.60 O ATOM 1355 CB SER A 175 11.946 3.475 -1.164 1.00 3.15 C ATOM 1356 OG SER A 175 12.850 3.608 -0.077 1.00 3.52 O ATOM 0 H SER A 175 9.096 4.768 -2.017 1.00 2.06 H new ATOM 0 HA SER A 175 10.590 4.920 -0.372 1.00 2.52 H new ATOM 0 HB2 SER A 175 11.308 2.606 -1.003 1.00 3.15 H new ATOM 0 HB3 SER A 175 12.504 3.295 -2.083 1.00 3.15 H new ATOM 0 HG SER A 175 13.669 3.106 -0.269 1.00 3.52 H new ATOM 1362 N ARG A 176 12.727 6.403 -0.755 1.00 3.11 N ATOM 1363 CA ARG A 176 13.608 7.525 -1.008 1.00 3.87 C ATOM 1364 C ARG A 176 14.867 7.051 -1.715 1.00 4.29 C ATOM 1365 O ARG A 176 15.345 7.716 -2.631 1.00 4.77 O ATOM 1366 CB ARG A 176 13.969 8.243 0.296 1.00 4.45 C ATOM 1367 CG ARG A 176 12.789 8.876 1.037 1.00 4.94 C ATOM 1368 CD ARG A 176 12.157 10.026 0.258 1.00 5.64 C ATOM 1369 NE ARG A 176 11.356 10.894 1.119 1.00 6.15 N ATOM 1370 CZ ARG A 176 10.614 11.901 0.667 1.00 6.90 C ATOM 1371 NH1 ARG A 176 10.479 12.101 -0.637 1.00 7.24 N ATOM 1372 NH2 ARG A 176 9.986 12.699 1.522 1.00 7.60 N ATOM 0 H ARG A 176 12.785 6.020 0.189 1.00 3.11 H new ATOM 0 HA ARG A 176 13.085 8.233 -1.651 1.00 3.87 H new ATOM 0 HB2 ARG A 176 14.456 7.531 0.962 1.00 4.45 H new ATOM 0 HB3 ARG A 176 14.698 9.022 0.074 1.00 4.45 H new ATOM 0 HG2 ARG A 176 12.034 8.114 1.229 1.00 4.94 H new ATOM 0 HG3 ARG A 176 13.127 9.241 2.007 1.00 4.94 H new ATOM 0 HD2 ARG A 176 12.940 10.613 -0.221 1.00 5.64 H new ATOM 0 HD3 ARG A 176 11.529 9.624 -0.537 1.00 5.64 H new ATOM 0 HE ARG A 176 11.367 10.717 2.124 1.00 6.15 H new ATOM 0 HH11 ARG A 176 10.945 11.481 -1.299 1.00 7.24 H new ATOM 0 HH12 ARG A 176 9.909 12.875 -0.978 1.00 7.24 H new ATOM 0 HH21 ARG A 176 10.072 12.540 2.526 1.00 7.60 H new ATOM 0 HH22 ARG A 176 9.417 13.471 1.175 1.00 7.60 H new ATOM 1386 N LYS A 177 15.397 5.902 -1.282 1.00 4.61 N ATOM 1387 CA LYS A 177 16.557 5.268 -1.924 1.00 5.47 C ATOM 1388 C LYS A 177 17.865 6.003 -1.611 1.00 6.20 C ATOM 1389 O LYS A 177 18.899 5.370 -1.392 1.00 6.81 O ATOM 1390 CB LYS A 177 16.329 5.156 -3.436 1.00 5.99 C ATOM 1391 CG LYS A 177 17.591 4.941 -4.248 1.00 6.65 C ATOM 1392 CD LYS A 177 17.262 4.731 -5.713 1.00 7.44 C ATOM 1393 CE LYS A 177 18.469 4.996 -6.596 1.00 7.99 C ATOM 1394 NZ LYS A 177 18.808 6.442 -6.642 1.00 8.61 N ATOM 0 H LYS A 177 15.037 5.386 -0.480 1.00 4.61 H new ATOM 0 HA LYS A 177 16.658 4.265 -1.511 1.00 5.47 H new ATOM 0 HB2 LYS A 177 15.644 4.330 -3.627 1.00 5.99 H new ATOM 0 HB3 LYS A 177 15.838 6.064 -3.785 1.00 5.99 H new ATOM 0 HG2 LYS A 177 18.250 5.803 -4.139 1.00 6.65 H new ATOM 0 HG3 LYS A 177 18.132 4.076 -3.865 1.00 6.65 H new ATOM 0 HD2 LYS A 177 16.914 3.709 -5.866 1.00 7.44 H new ATOM 0 HD3 LYS A 177 16.445 5.392 -6.002 1.00 7.44 H new ATOM 0 HE2 LYS A 177 19.324 4.433 -6.222 1.00 7.99 H new ATOM 0 HE3 LYS A 177 18.268 4.637 -7.605 1.00 7.99 H new ATOM 0 HZ1 LYS A 177 19.816 6.555 -6.871 1.00 8.61 H new ATOM 0 HZ2 LYS A 177 18.233 6.910 -7.371 1.00 8.61 H new ATOM 0 HZ3 LYS A 177 18.612 6.874 -5.716 1.00 8.61 H new ATOM 1408 N GLU A 178 17.813 7.330 -1.557 1.00 6.45 N ATOM 1409 CA GLU A 178 18.986 8.141 -1.228 1.00 7.43 C ATOM 1410 C GLU A 178 19.307 8.081 0.267 1.00 7.96 C ATOM 1411 O GLU A 178 19.842 9.028 0.838 1.00 8.13 O ATOM 1412 CB GLU A 178 18.777 9.598 -1.657 1.00 7.79 C ATOM 1413 CG GLU A 178 19.173 9.887 -3.098 1.00 8.26 C ATOM 1414 CD GLU A 178 18.356 9.118 -4.111 1.00 8.30 C ATOM 1415 OE1 GLU A 178 17.208 9.520 -4.388 1.00 8.32 O ATOM 1416 OE2 GLU A 178 18.855 8.096 -4.625 1.00 8.55 O ATOM 0 H GLU A 178 16.968 7.871 -1.737 1.00 6.45 H new ATOM 0 HA GLU A 178 19.832 7.726 -1.777 1.00 7.43 H new ATOM 0 HB2 GLU A 178 17.727 9.858 -1.521 1.00 7.79 H new ATOM 0 HB3 GLU A 178 19.354 10.246 -0.997 1.00 7.79 H new ATOM 0 HG2 GLU A 178 19.064 10.955 -3.290 1.00 8.26 H new ATOM 0 HG3 GLU A 178 20.227 9.645 -3.233 1.00 8.26 H new ATOM 1423 N ARG A 179 18.978 6.963 0.893 1.00 8.49 N ATOM 1424 CA ARG A 179 19.345 6.718 2.278 1.00 9.26 C ATOM 1425 C ARG A 179 20.709 6.038 2.316 1.00 10.11 C ATOM 1426 O ARG A 179 21.350 5.933 3.360 1.00 10.52 O ATOM 1427 CB ARG A 179 18.276 5.848 2.950 1.00 9.63 C ATOM 1428 CG ARG A 179 18.564 5.508 4.404 1.00 10.21 C ATOM 1429 CD ARG A 179 17.360 4.863 5.072 1.00 10.71 C ATOM 1430 NE ARG A 179 17.688 4.312 6.385 1.00 11.04 N ATOM 1431 CZ ARG A 179 16.927 4.453 7.468 1.00 11.73 C ATOM 1432 NH1 ARG A 179 15.795 5.147 7.410 1.00 12.15 N ATOM 1433 NH2 ARG A 179 17.296 3.891 8.609 1.00 12.18 N ATOM 0 H ARG A 179 18.452 6.204 0.459 1.00 8.49 H new ATOM 0 HA ARG A 179 19.406 7.660 2.824 1.00 9.26 H new ATOM 0 HB2 ARG A 179 17.317 6.364 2.893 1.00 9.63 H new ATOM 0 HB3 ARG A 179 18.173 4.921 2.386 1.00 9.63 H new ATOM 0 HG2 ARG A 179 19.418 4.833 4.459 1.00 10.21 H new ATOM 0 HG3 ARG A 179 18.839 6.414 4.944 1.00 10.21 H new ATOM 0 HD2 ARG A 179 16.566 5.602 5.178 1.00 10.71 H new ATOM 0 HD3 ARG A 179 16.974 4.069 4.433 1.00 10.71 H new ATOM 0 HE ARG A 179 18.556 3.785 6.478 1.00 11.04 H new ATOM 0 HH11 ARG A 179 15.504 5.576 6.531 1.00 12.15 H new ATOM 0 HH12 ARG A 179 15.217 5.251 8.244 1.00 12.15 H new ATOM 0 HH21 ARG A 179 18.161 3.352 8.656 1.00 12.18 H new ATOM 0 HH22 ARG A 179 16.715 3.997 9.441 1.00 12.18 H new ATOM 1447 N GLU A 180 21.150 5.611 1.143 1.00 10.55 N ATOM 1448 CA GLU A 180 22.417 4.916 0.987 1.00 11.52 C ATOM 1449 C GLU A 180 22.814 4.906 -0.488 1.00 12.20 C ATOM 1450 O GLU A 180 22.217 4.204 -1.304 1.00 12.70 O ATOM 1451 CB GLU A 180 22.338 3.491 1.564 1.00 11.80 C ATOM 1452 CG GLU A 180 21.107 2.702 1.139 1.00 12.14 C ATOM 1453 CD GLU A 180 20.973 1.394 1.883 1.00 12.44 C ATOM 1454 OE1 GLU A 180 20.361 1.384 2.971 1.00 12.62 O ATOM 1455 OE2 GLU A 180 21.466 0.365 1.384 1.00 12.64 O ATOM 0 H GLU A 180 20.637 5.737 0.270 1.00 10.55 H new ATOM 0 HA GLU A 180 23.188 5.444 1.549 1.00 11.52 H new ATOM 0 HB2 GLU A 180 23.229 2.941 1.261 1.00 11.80 H new ATOM 0 HB3 GLU A 180 22.356 3.552 2.652 1.00 11.80 H new ATOM 0 HG2 GLU A 180 20.216 3.306 1.309 1.00 12.14 H new ATOM 0 HG3 GLU A 180 21.158 2.504 0.068 1.00 12.14 H new ATOM 1462 N ALA A 181 23.809 5.717 -0.828 1.00 12.41 N ATOM 1463 CA ALA A 181 24.188 5.924 -2.219 1.00 13.20 C ATOM 1464 C ALA A 181 25.091 4.811 -2.732 1.00 13.42 C ATOM 1465 O ALA A 181 26.184 4.583 -2.206 1.00 13.65 O ATOM 1466 CB ALA A 181 24.872 7.273 -2.385 1.00 13.56 C ATOM 0 H ALA A 181 24.369 6.243 -0.157 1.00 12.41 H new ATOM 0 HA ALA A 181 23.274 5.908 -2.813 1.00 13.20 H new ATOM 0 HB1 ALA A 181 25.150 7.414 -3.430 1.00 13.56 H new ATOM 0 HB2 ALA A 181 24.190 8.067 -2.080 1.00 13.56 H new ATOM 0 HB3 ALA A 181 25.767 7.306 -1.764 1.00 13.56 H new ATOM 1472 N GLU A 182 24.625 4.128 -3.763 1.00 13.52 N ATOM 1473 CA GLU A 182 25.397 3.084 -4.413 1.00 13.92 C ATOM 1474 C GLU A 182 24.877 2.876 -5.831 1.00 14.43 C ATOM 1475 O GLU A 182 25.330 3.599 -6.738 1.00 15.05 O ATOM 1476 CB GLU A 182 25.321 1.778 -3.616 1.00 13.77 C ATOM 1477 CG GLU A 182 26.143 0.643 -4.210 1.00 14.19 C ATOM 1478 CD GLU A 182 27.627 0.935 -4.224 1.00 14.38 C ATOM 1479 OE1 GLU A 182 28.295 0.663 -3.208 1.00 14.58 O ATOM 1480 OE2 GLU A 182 28.134 1.418 -5.256 1.00 14.46 O ATOM 1481 OXT GLU A 182 24.000 2.009 -6.032 1.00 14.36 O ATOM 0 H GLU A 182 23.703 4.281 -4.172 1.00 13.52 H new ATOM 0 HA GLU A 182 26.442 3.390 -4.456 1.00 13.92 H new ATOM 0 HB2 GLU A 182 25.661 1.965 -2.598 1.00 13.77 H new ATOM 0 HB3 GLU A 182 24.279 1.464 -3.551 1.00 13.77 H new ATOM 0 HG2 GLU A 182 25.962 -0.267 -3.638 1.00 14.19 H new ATOM 0 HG3 GLU A 182 25.806 0.452 -5.229 1.00 14.19 H new TER 1488 GLU A 182