USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=24 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 :FLIP amide:sc= -4.34! C(o=-9.6!,f=-6.5!) USER MOD Set 1.2: A 144 HIS : no HE2:sc= -2.2 K(o=-6.5,f=-12!) USER MOD Set 2.1: A 116 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 120 SER OG : rot 151:sc= 0.189 USER MOD Set 3.1: A 108 LYS NZ :NH3+ -169:sc= -0.0315 (180deg=-0.237) USER MOD Set 3.2: A 109 SER OG : rot 180:sc= -0.079 USER MOD Set 4.1: A 95 LYS NZ :NH3+ -171:sc= 1.17 (180deg=0.719) USER MOD Set 4.2: A 175 SER OG : rot 49:sc= -0.0122 USER MOD Single : A 92 SER OG : rot 180:sc= -0.123 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 155:sc= -0.157 (180deg=-0.721) USER MOD Single : A 105 ASN : amide:sc= 1.01 K(o=1,f=-1.4!) USER MOD Single : A 112 ASN : amide:sc= -0.139 K(o=-0.14,f=-2.6!) USER MOD Single : A 113 LYS NZ :NH3+ -176:sc= -3.21! (180deg=-3.71!) USER MOD Single : A 118 THR OG1 : rot 76:sc= 0.87 USER MOD Single : A 124 ASN : amide:sc= 0.657 K(o=0.66,f=-1.5) USER MOD Single : A 127 SER OG : rot 180:sc= -0.0105 USER MOD Single : A 128 CYS SG : rot 128:sc= -3.6! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 CYS SG : rot 180:sc= 0.0793 USER MOD Single : A 135 ASN : amide:sc= 0.365 X(o=0.36,f=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0.0182 USER MOD Single : A 138 LYS NZ :NH3+ 152:sc= 0.474 (180deg=0.165) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 148 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.51) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 MET CE :methyl 178:sc= -2.05 (180deg=-2.07) USER MOD Single : A 159 ASN : amide:sc= -1.88! C(o=-1.9!,f=-4.7!) USER MOD Single : A 161 MET CE :methyl -143:sc= -0.103 (180deg=-0.712) USER MOD Single : A 164 ASN : amide:sc= 0.666 K(o=0.67,f=-1.8!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ -171:sc=-0.00761 (180deg=-0.0984) USER MOD Single : A 177 LYS NZ :NH3+ -159:sc= -0.08 (180deg=-0.591) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 88 29.223 -8.054 3.339 1.00 14.85 N ATOM 2 CA GLY A 88 28.097 -7.758 4.257 1.00 14.52 C ATOM 3 C GLY A 88 27.166 -8.939 4.418 1.00 14.06 C ATOM 4 O GLY A 88 27.268 -9.919 3.683 1.00 14.34 O ATOM 0 HA2 GLY A 88 28.491 -7.472 5.232 1.00 14.52 H new ATOM 0 HA3 GLY A 88 27.536 -6.904 3.877 1.00 14.52 H new ATOM 10 N ALA A 89 26.260 -8.854 5.381 1.00 13.50 N ATOM 11 CA ALA A 89 25.289 -9.912 5.612 1.00 13.18 C ATOM 12 C ALA A 89 24.032 -9.665 4.794 1.00 12.18 C ATOM 13 O ALA A 89 23.357 -10.604 4.368 1.00 12.38 O ATOM 14 CB ALA A 89 24.950 -10.013 7.090 1.00 13.38 C ATOM 0 H ALA A 89 26.177 -8.060 6.017 1.00 13.50 H new ATOM 0 HA ALA A 89 25.728 -10.858 5.295 1.00 13.18 H new ATOM 0 HB1 ALA A 89 24.222 -10.810 7.243 1.00 13.38 H new ATOM 0 HB2 ALA A 89 25.855 -10.234 7.656 1.00 13.38 H new ATOM 0 HB3 ALA A 89 24.530 -9.067 7.432 1.00 13.38 H new ATOM 20 N ASP A 90 23.730 -8.394 4.567 1.00 11.25 N ATOM 21 CA ASP A 90 22.553 -8.012 3.791 1.00 10.32 C ATOM 22 C ASP A 90 22.881 -8.075 2.307 1.00 10.04 C ATOM 23 O ASP A 90 23.823 -7.428 1.854 1.00 9.96 O ATOM 24 CB ASP A 90 22.073 -6.596 4.147 1.00 9.53 C ATOM 25 CG ASP A 90 21.846 -6.398 5.633 1.00 9.74 C ATOM 26 OD1 ASP A 90 20.826 -6.899 6.156 1.00 9.92 O ATOM 27 OD2 ASP A 90 22.679 -5.737 6.284 1.00 9.91 O ATOM 0 H ASP A 90 24.283 -7.608 4.908 1.00 11.25 H new ATOM 0 HA ASP A 90 21.752 -8.711 4.031 1.00 10.32 H new ATOM 0 HB2 ASP A 90 22.809 -5.872 3.799 1.00 9.53 H new ATOM 0 HB3 ASP A 90 21.145 -6.389 3.614 1.00 9.53 H new ATOM 32 N PRO A 91 22.123 -8.864 1.533 1.00 10.16 N ATOM 33 CA PRO A 91 22.347 -9.006 0.090 1.00 10.16 C ATOM 34 C PRO A 91 22.187 -7.682 -0.653 1.00 9.18 C ATOM 35 O PRO A 91 23.169 -7.082 -1.098 1.00 9.15 O ATOM 36 CB PRO A 91 21.271 -10.009 -0.350 1.00 10.77 C ATOM 37 CG PRO A 91 20.856 -10.704 0.901 1.00 11.14 C ATOM 38 CD PRO A 91 20.998 -9.690 1.998 1.00 10.63 C ATOM 0 HA PRO A 91 23.362 -9.335 -0.133 1.00 10.16 H new ATOM 0 HB2 PRO A 91 20.427 -9.502 -0.818 1.00 10.77 H new ATOM 0 HB3 PRO A 91 21.665 -10.715 -1.081 1.00 10.77 H new ATOM 0 HG2 PRO A 91 19.828 -11.060 0.828 1.00 11.14 H new ATOM 0 HG3 PRO A 91 21.483 -11.576 1.091 1.00 11.14 H new ATOM 0 HD2 PRO A 91 20.089 -9.102 2.125 1.00 10.63 H new ATOM 0 HD3 PRO A 91 21.211 -10.160 2.958 1.00 10.63 H new ATOM 46 N SER A 92 20.949 -7.220 -0.775 1.00 8.61 N ATOM 47 CA SER A 92 20.657 -5.962 -1.448 1.00 7.83 C ATOM 48 C SER A 92 19.321 -5.392 -0.972 1.00 6.91 C ATOM 49 O SER A 92 18.263 -5.772 -1.471 1.00 6.95 O ATOM 50 CB SER A 92 20.625 -6.159 -2.969 1.00 8.48 C ATOM 51 OG SER A 92 21.885 -6.598 -3.454 1.00 9.30 O ATOM 0 H SER A 92 20.126 -7.702 -0.414 1.00 8.61 H new ATOM 0 HA SER A 92 21.449 -5.256 -1.199 1.00 7.83 H new ATOM 0 HB2 SER A 92 19.858 -6.889 -3.228 1.00 8.48 H new ATOM 0 HB3 SER A 92 20.351 -5.222 -3.454 1.00 8.48 H new ATOM 0 HG SER A 92 21.838 -6.718 -4.426 1.00 9.30 H new ATOM 57 N LEU A 93 19.368 -4.508 0.017 1.00 6.42 N ATOM 58 CA LEU A 93 18.159 -3.871 0.515 1.00 5.85 C ATOM 59 C LEU A 93 18.010 -2.476 -0.094 1.00 4.94 C ATOM 60 O LEU A 93 18.893 -1.630 0.068 1.00 5.05 O ATOM 61 CB LEU A 93 18.191 -3.776 2.043 1.00 6.31 C ATOM 62 CG LEU A 93 18.230 -5.119 2.775 1.00 7.36 C ATOM 63 CD1 LEU A 93 18.328 -4.895 4.285 1.00 7.82 C ATOM 64 CD2 LEU A 93 16.993 -5.944 2.442 1.00 7.89 C ATOM 0 H LEU A 93 20.226 -4.218 0.487 1.00 6.42 H new ATOM 0 HA LEU A 93 17.303 -4.479 0.223 1.00 5.85 H new ATOM 0 HB2 LEU A 93 19.064 -3.194 2.337 1.00 6.31 H new ATOM 0 HB3 LEU A 93 17.312 -3.223 2.376 1.00 6.31 H new ATOM 0 HG LEU A 93 19.111 -5.669 2.444 1.00 7.36 H new ATOM 0 HD11 LEU A 93 18.355 -5.858 4.795 1.00 7.82 H new ATOM 0 HD12 LEU A 93 19.237 -4.339 4.512 1.00 7.82 H new ATOM 0 HD13 LEU A 93 17.461 -4.328 4.626 1.00 7.82 H new ATOM 0 HD21 LEU A 93 17.037 -6.896 2.971 1.00 7.89 H new ATOM 0 HD22 LEU A 93 16.100 -5.400 2.748 1.00 7.89 H new ATOM 0 HD23 LEU A 93 16.956 -6.127 1.368 1.00 7.89 H new ATOM 76 N ARG A 94 16.909 -2.233 -0.798 1.00 4.45 N ATOM 77 CA ARG A 94 16.686 -0.944 -1.435 1.00 3.96 C ATOM 78 C ARG A 94 15.700 -0.126 -0.619 1.00 3.05 C ATOM 79 O ARG A 94 15.879 1.076 -0.413 1.00 3.26 O ATOM 80 CB ARG A 94 16.142 -1.133 -2.852 1.00 4.35 C ATOM 81 CG ARG A 94 17.016 -2.005 -3.741 1.00 5.15 C ATOM 82 CD ARG A 94 16.420 -2.156 -5.131 1.00 5.75 C ATOM 83 NE ARG A 94 17.149 -3.130 -5.941 1.00 6.33 N ATOM 84 CZ ARG A 94 16.573 -3.909 -6.859 1.00 7.04 C ATOM 85 NH1 ARG A 94 15.277 -3.785 -7.108 1.00 7.28 N ATOM 86 NH2 ARG A 94 17.292 -4.792 -7.541 1.00 7.78 N ATOM 0 H ARG A 94 16.160 -2.911 -0.940 1.00 4.45 H new ATOM 0 HA ARG A 94 17.639 -0.417 -1.489 1.00 3.96 H new ATOM 0 HB2 ARG A 94 15.148 -1.575 -2.792 1.00 4.35 H new ATOM 0 HB3 ARG A 94 16.028 -0.155 -3.320 1.00 4.35 H new ATOM 0 HG2 ARG A 94 18.011 -1.567 -3.816 1.00 5.15 H new ATOM 0 HG3 ARG A 94 17.134 -2.988 -3.286 1.00 5.15 H new ATOM 0 HD2 ARG A 94 15.378 -2.464 -5.046 1.00 5.75 H new ATOM 0 HD3 ARG A 94 16.427 -1.189 -5.635 1.00 5.75 H new ATOM 0 HE ARG A 94 18.155 -3.219 -5.797 1.00 6.33 H new ATOM 0 HH11 ARG A 94 14.723 -3.096 -6.599 1.00 7.28 H new ATOM 0 HH12 ARG A 94 14.833 -4.379 -7.809 1.00 7.28 H new ATOM 0 HH21 ARG A 94 18.293 -4.879 -7.365 1.00 7.78 H new ATOM 0 HH22 ARG A 94 16.844 -5.383 -8.241 1.00 7.78 H new ATOM 100 N LYS A 95 14.664 -0.798 -0.146 1.00 2.37 N ATOM 101 CA LYS A 95 13.608 -0.153 0.610 1.00 1.60 C ATOM 102 C LYS A 95 13.871 -0.313 2.114 1.00 1.26 C ATOM 103 O LYS A 95 13.500 -1.335 2.693 1.00 1.52 O ATOM 104 CB LYS A 95 12.262 -0.783 0.243 1.00 1.56 C ATOM 105 CG LYS A 95 12.036 -0.858 -1.258 1.00 1.15 C ATOM 106 CD LYS A 95 10.645 -1.358 -1.602 1.00 1.36 C ATOM 107 CE LYS A 95 10.468 -1.481 -3.108 1.00 1.24 C ATOM 108 NZ LYS A 95 10.767 -0.204 -3.809 1.00 1.91 N ATOM 0 H LYS A 95 14.533 -1.801 -0.275 1.00 2.37 H new ATOM 0 HA LYS A 95 13.586 0.910 0.368 1.00 1.60 H new ATOM 0 HB2 LYS A 95 12.209 -1.787 0.664 1.00 1.56 H new ATOM 0 HB3 LYS A 95 11.459 -0.204 0.698 1.00 1.56 H new ATOM 0 HG2 LYS A 95 12.185 0.129 -1.696 1.00 1.15 H new ATOM 0 HG3 LYS A 95 12.779 -1.520 -1.703 1.00 1.15 H new ATOM 0 HD2 LYS A 95 10.476 -2.327 -1.132 1.00 1.36 H new ATOM 0 HD3 LYS A 95 9.898 -0.674 -1.199 1.00 1.36 H new ATOM 0 HE2 LYS A 95 11.123 -2.265 -3.487 1.00 1.24 H new ATOM 0 HE3 LYS A 95 9.445 -1.785 -3.329 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 10.490 -0.283 -4.808 1.00 1.91 H new ATOM 0 HZ2 LYS A 95 10.235 0.570 -3.363 1.00 1.91 H new ATOM 0 HZ3 LYS A 95 11.786 -0.004 -3.747 1.00 1.91 H new ATOM 122 N SER A 96 14.532 0.670 2.746 1.00 1.02 N ATOM 123 CA SER A 96 14.878 0.578 4.161 1.00 0.93 C ATOM 124 C SER A 96 13.637 0.499 5.056 1.00 0.89 C ATOM 125 O SER A 96 13.741 0.175 6.241 1.00 1.75 O ATOM 126 CB SER A 96 15.736 1.779 4.550 1.00 1.13 C ATOM 127 OG SER A 96 16.830 1.928 3.658 1.00 1.79 O ATOM 0 H SER A 96 14.834 1.533 2.295 1.00 1.02 H new ATOM 0 HA SER A 96 15.438 -0.345 4.312 1.00 0.93 H new ATOM 0 HB2 SER A 96 15.128 2.684 4.541 1.00 1.13 H new ATOM 0 HB3 SER A 96 16.105 1.653 5.568 1.00 1.13 H new ATOM 0 HG SER A 96 17.366 2.704 3.924 1.00 1.79 H new ATOM 133 N GLY A 97 12.474 0.809 4.495 1.00 0.44 N ATOM 134 CA GLY A 97 11.231 0.656 5.226 1.00 0.29 C ATOM 135 C GLY A 97 10.850 -0.807 5.400 1.00 0.27 C ATOM 136 O GLY A 97 10.213 -1.168 6.388 1.00 0.36 O ATOM 0 H GLY A 97 12.370 1.164 3.545 1.00 0.44 H new ATOM 0 HA2 GLY A 97 11.326 1.125 6.205 1.00 0.29 H new ATOM 0 HA3 GLY A 97 10.433 1.178 4.698 1.00 0.29 H new ATOM 140 N VAL A 98 11.268 -1.639 4.436 1.00 0.29 N ATOM 141 CA VAL A 98 10.941 -3.075 4.392 1.00 0.33 C ATOM 142 C VAL A 98 9.444 -3.339 4.294 1.00 0.25 C ATOM 143 O VAL A 98 8.649 -2.839 5.090 1.00 0.27 O ATOM 144 CB VAL A 98 11.498 -3.868 5.589 1.00 0.49 C ATOM 145 CG1 VAL A 98 10.938 -5.286 5.587 1.00 0.47 C ATOM 146 CG2 VAL A 98 13.011 -3.908 5.549 1.00 0.71 C ATOM 0 H VAL A 98 11.849 -1.333 3.656 1.00 0.29 H new ATOM 0 HA VAL A 98 11.430 -3.426 3.483 1.00 0.33 H new ATOM 0 HB VAL A 98 11.190 -3.365 6.506 1.00 0.49 H new ATOM 0 HG11 VAL A 98 11.339 -5.837 6.438 1.00 0.47 H new ATOM 0 HG12 VAL A 98 9.851 -5.248 5.659 1.00 0.47 H new ATOM 0 HG13 VAL A 98 11.223 -5.788 4.663 1.00 0.47 H new ATOM 0 HG21 VAL A 98 13.383 -4.473 6.404 1.00 0.71 H new ATOM 0 HG22 VAL A 98 13.338 -4.388 4.627 1.00 0.71 H new ATOM 0 HG23 VAL A 98 13.403 -2.892 5.588 1.00 0.71 H new ATOM 156 N GLY A 99 9.062 -4.134 3.308 1.00 0.21 N ATOM 157 CA GLY A 99 7.678 -4.522 3.190 1.00 0.20 C ATOM 158 C GLY A 99 6.813 -3.376 2.721 1.00 0.15 C ATOM 159 O GLY A 99 5.615 -3.340 2.984 1.00 0.18 O ATOM 0 H GLY A 99 9.682 -4.514 2.593 1.00 0.21 H new ATOM 0 HA2 GLY A 99 7.592 -5.353 2.490 1.00 0.20 H new ATOM 0 HA3 GLY A 99 7.317 -4.879 4.154 1.00 0.20 H new ATOM 163 N ASN A 100 7.430 -2.429 2.038 1.00 0.13 N ATOM 164 CA ASN A 100 6.748 -1.202 1.653 1.00 0.14 C ATOM 165 C ASN A 100 6.022 -1.416 0.330 1.00 0.14 C ATOM 166 O ASN A 100 6.637 -1.822 -0.662 1.00 0.19 O ATOM 167 CB ASN A 100 7.791 -0.086 1.508 1.00 0.21 C ATOM 168 CG ASN A 100 8.345 0.384 2.832 1.00 0.28 C ATOM 169 OD1 ASN A 100 8.245 -0.453 3.857 1.00 0.63 O flip ATOM 170 ND2 ASN A 100 8.840 1.503 2.944 1.00 0.20 N flip ATOM 0 H ASN A 100 8.403 -2.484 1.737 1.00 0.13 H new ATOM 0 HA ASN A 100 6.017 -0.924 2.412 1.00 0.14 H new ATOM 0 HB2 ASN A 100 8.611 -0.442 0.884 1.00 0.21 H new ATOM 0 HB3 ASN A 100 7.340 0.760 0.989 1.00 0.21 H new ATOM 0 HD21 ASN A 100 8.899 2.118 2.132 1.00 0.20 H new ATOM 0 HD22 ASN A 100 9.192 1.817 3.849 1.00 0.20 H new ATOM 177 N ILE A 101 4.724 -1.143 0.311 1.00 0.12 N ATOM 178 CA ILE A 101 3.941 -1.207 -0.920 1.00 0.13 C ATOM 179 C ILE A 101 3.029 0.006 -1.027 1.00 0.12 C ATOM 180 O ILE A 101 2.748 0.666 -0.023 1.00 0.15 O ATOM 181 CB ILE A 101 3.088 -2.493 -1.020 1.00 0.13 C ATOM 182 CG1 ILE A 101 2.068 -2.561 0.117 1.00 0.11 C ATOM 183 CG2 ILE A 101 3.979 -3.725 -1.020 1.00 0.15 C ATOM 184 CD1 ILE A 101 1.213 -3.810 0.094 1.00 0.13 C ATOM 0 H ILE A 101 4.188 -0.874 1.136 1.00 0.12 H new ATOM 0 HA ILE A 101 4.656 -1.218 -1.743 1.00 0.13 H new ATOM 0 HB ILE A 101 2.540 -2.466 -1.962 1.00 0.13 H new ATOM 0 HG12 ILE A 101 2.595 -2.510 1.070 1.00 0.11 H new ATOM 0 HG13 ILE A 101 1.420 -1.686 0.064 1.00 0.11 H new ATOM 0 HG21 ILE A 101 3.362 -4.621 -1.091 1.00 0.15 H new ATOM 0 HG22 ILE A 101 4.657 -3.683 -1.872 1.00 0.15 H new ATOM 0 HG23 ILE A 101 4.558 -3.755 -0.097 1.00 0.15 H new ATOM 0 HD11 ILE A 101 0.514 -3.788 0.930 1.00 0.13 H new ATOM 0 HD12 ILE A 101 0.657 -3.853 -0.843 1.00 0.13 H new ATOM 0 HD13 ILE A 101 1.851 -4.690 0.178 1.00 0.13 H new ATOM 196 N PHE A 102 2.568 0.297 -2.232 1.00 0.11 N ATOM 197 CA PHE A 102 1.639 1.395 -2.438 1.00 0.11 C ATOM 198 C PHE A 102 0.400 0.895 -3.164 1.00 0.09 C ATOM 199 O PHE A 102 0.484 0.015 -4.023 1.00 0.11 O ATOM 200 CB PHE A 102 2.322 2.554 -3.187 1.00 0.16 C ATOM 201 CG PHE A 102 1.818 2.832 -4.578 1.00 0.13 C ATOM 202 CD1 PHE A 102 0.751 3.691 -4.788 1.00 0.14 C ATOM 203 CD2 PHE A 102 2.397 2.207 -5.672 1.00 0.17 C ATOM 204 CE1 PHE A 102 0.275 3.925 -6.061 1.00 0.17 C ATOM 205 CE2 PHE A 102 1.923 2.436 -6.948 1.00 0.21 C ATOM 206 CZ PHE A 102 0.916 3.390 -7.145 1.00 0.20 C ATOM 0 H PHE A 102 2.821 -0.210 -3.080 1.00 0.11 H new ATOM 0 HA PHE A 102 1.323 1.785 -1.471 1.00 0.11 H new ATOM 0 HB2 PHE A 102 2.208 3.461 -2.593 1.00 0.16 H new ATOM 0 HB3 PHE A 102 3.390 2.343 -3.245 1.00 0.16 H new ATOM 0 HD1 PHE A 102 0.287 4.183 -3.946 1.00 0.14 H new ATOM 0 HD2 PHE A 102 3.228 1.533 -5.524 1.00 0.17 H new ATOM 0 HE1 PHE A 102 -0.607 4.533 -6.203 1.00 0.17 H new ATOM 0 HE2 PHE A 102 2.324 1.885 -7.786 1.00 0.21 H new ATOM 0 HZ PHE A 102 0.648 3.700 -8.144 1.00 0.20 H new ATOM 216 N ILE A 103 -0.744 1.437 -2.783 1.00 0.08 N ATOM 217 CA ILE A 103 -2.024 1.018 -3.329 1.00 0.08 C ATOM 218 C ILE A 103 -2.729 2.198 -3.985 1.00 0.08 C ATOM 219 O ILE A 103 -2.829 3.269 -3.391 1.00 0.15 O ATOM 220 CB ILE A 103 -2.930 0.452 -2.220 1.00 0.08 C ATOM 221 CG1 ILE A 103 -2.204 -0.644 -1.445 1.00 0.08 C ATOM 222 CG2 ILE A 103 -4.223 -0.092 -2.812 1.00 0.10 C ATOM 223 CD1 ILE A 103 -2.542 -0.657 0.024 1.00 0.09 C ATOM 0 H ILE A 103 -0.812 2.179 -2.087 1.00 0.08 H new ATOM 0 HA ILE A 103 -1.834 0.242 -4.071 1.00 0.08 H new ATOM 0 HB ILE A 103 -3.176 1.261 -1.533 1.00 0.08 H new ATOM 0 HG12 ILE A 103 -2.455 -1.613 -1.877 1.00 0.08 H new ATOM 0 HG13 ILE A 103 -1.128 -0.511 -1.562 1.00 0.08 H new ATOM 0 HG21 ILE A 103 -4.851 -0.488 -2.013 1.00 0.10 H new ATOM 0 HG22 ILE A 103 -4.753 0.709 -3.327 1.00 0.10 H new ATOM 0 HG23 ILE A 103 -3.992 -0.888 -3.520 1.00 0.10 H new ATOM 0 HD11 ILE A 103 -1.993 -1.459 0.517 1.00 0.09 H new ATOM 0 HD12 ILE A 103 -2.266 0.299 0.469 1.00 0.09 H new ATOM 0 HD13 ILE A 103 -3.612 -0.820 0.150 1.00 0.09 H new ATOM 235 N LYS A 104 -3.210 2.001 -5.203 1.00 0.13 N ATOM 236 CA LYS A 104 -3.904 3.056 -5.928 1.00 0.13 C ATOM 237 C LYS A 104 -5.357 2.668 -6.177 1.00 0.12 C ATOM 238 O LYS A 104 -5.674 1.482 -6.269 1.00 0.14 O ATOM 239 CB LYS A 104 -3.215 3.312 -7.270 1.00 0.19 C ATOM 240 CG LYS A 104 -3.317 4.757 -7.748 1.00 0.28 C ATOM 241 CD LYS A 104 -2.643 4.972 -9.098 1.00 0.39 C ATOM 242 CE LYS A 104 -3.534 4.542 -10.256 1.00 0.66 C ATOM 243 NZ LYS A 104 -4.813 5.300 -10.283 1.00 1.46 N ATOM 0 H LYS A 104 -3.133 1.120 -5.711 1.00 0.13 H new ATOM 0 HA LYS A 104 -3.875 3.962 -5.323 1.00 0.13 H new ATOM 0 HB2 LYS A 104 -2.163 3.040 -7.185 1.00 0.19 H new ATOM 0 HB3 LYS A 104 -3.653 2.658 -8.024 1.00 0.19 H new ATOM 0 HG2 LYS A 104 -4.367 5.039 -7.820 1.00 0.28 H new ATOM 0 HG3 LYS A 104 -2.860 5.415 -7.008 1.00 0.28 H new ATOM 0 HD2 LYS A 104 -2.385 6.025 -9.211 1.00 0.39 H new ATOM 0 HD3 LYS A 104 -1.710 4.410 -9.131 1.00 0.39 H new ATOM 0 HE2 LYS A 104 -3.004 4.691 -11.197 1.00 0.66 H new ATOM 0 HE3 LYS A 104 -3.746 3.476 -10.175 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 -5.189 5.312 -11.253 1.00 1.46 H new ATOM 0 HZ2 LYS A 104 -5.501 4.843 -9.650 1.00 1.46 H new ATOM 0 HZ3 LYS A 104 -4.645 6.276 -9.965 1.00 1.46 H new ATOM 257 N ASN A 105 -6.222 3.678 -6.268 1.00 0.12 N ATOM 258 CA ASN A 105 -7.625 3.511 -6.664 1.00 0.13 C ATOM 259 C ASN A 105 -8.463 2.892 -5.543 1.00 0.15 C ATOM 260 O ASN A 105 -9.362 2.091 -5.793 1.00 0.25 O ATOM 261 CB ASN A 105 -7.743 2.665 -7.938 1.00 0.16 C ATOM 262 CG ASN A 105 -9.023 2.963 -8.704 1.00 0.23 C ATOM 263 OD1 ASN A 105 -9.496 4.103 -8.725 1.00 0.49 O ATOM 264 ND2 ASN A 105 -9.600 1.946 -9.323 1.00 0.34 N ATOM 0 H ASN A 105 -5.968 4.645 -6.067 1.00 0.12 H new ATOM 0 HA ASN A 105 -8.017 4.507 -6.867 1.00 0.13 H new ATOM 0 HB2 ASN A 105 -6.883 2.856 -8.581 1.00 0.16 H new ATOM 0 HB3 ASN A 105 -7.716 1.608 -7.675 1.00 0.16 H new ATOM 0 HD21 ASN A 105 -10.467 2.090 -9.841 1.00 0.34 H new ATOM 0 HD22 ASN A 105 -9.178 1.018 -9.282 1.00 0.34 H new ATOM 271 N LEU A 106 -8.180 3.286 -4.310 1.00 0.14 N ATOM 272 CA LEU A 106 -8.957 2.832 -3.161 1.00 0.17 C ATOM 273 C LEU A 106 -10.287 3.564 -3.077 1.00 0.22 C ATOM 274 O LEU A 106 -10.453 4.648 -3.640 1.00 0.26 O ATOM 275 CB LEU A 106 -8.169 3.034 -1.867 1.00 0.16 C ATOM 276 CG LEU A 106 -7.065 2.008 -1.628 1.00 0.14 C ATOM 277 CD1 LEU A 106 -6.015 2.557 -0.687 1.00 0.15 C ATOM 278 CD2 LEU A 106 -7.655 0.733 -1.052 1.00 0.16 C ATOM 0 H LEU A 106 -7.416 3.921 -4.077 1.00 0.14 H new ATOM 0 HA LEU A 106 -9.156 1.768 -3.293 1.00 0.17 H new ATOM 0 HB2 LEU A 106 -7.725 4.029 -1.879 1.00 0.16 H new ATOM 0 HB3 LEU A 106 -8.862 3.004 -1.027 1.00 0.16 H new ATOM 0 HG LEU A 106 -6.592 1.787 -2.585 1.00 0.14 H new ATOM 0 HD11 LEU A 106 -5.238 1.808 -0.532 1.00 0.15 H new ATOM 0 HD12 LEU A 106 -5.572 3.454 -1.119 1.00 0.15 H new ATOM 0 HD13 LEU A 106 -6.477 2.805 0.269 1.00 0.15 H new ATOM 0 HD21 LEU A 106 -6.859 0.007 -0.885 1.00 0.16 H new ATOM 0 HD22 LEU A 106 -8.148 0.955 -0.106 1.00 0.16 H new ATOM 0 HD23 LEU A 106 -8.382 0.320 -1.751 1.00 0.16 H new ATOM 290 N ASP A 107 -11.232 2.953 -2.380 1.00 0.27 N ATOM 291 CA ASP A 107 -12.558 3.524 -2.205 1.00 0.32 C ATOM 292 C ASP A 107 -12.589 4.514 -1.044 1.00 0.30 C ATOM 293 O ASP A 107 -11.819 4.398 -0.090 1.00 0.26 O ATOM 294 CB ASP A 107 -13.575 2.404 -1.987 1.00 0.37 C ATOM 295 CG ASP A 107 -14.943 2.926 -1.608 1.00 0.50 C ATOM 296 OD1 ASP A 107 -15.622 3.500 -2.482 1.00 0.62 O ATOM 297 OD2 ASP A 107 -15.352 2.749 -0.443 1.00 0.71 O ATOM 0 H ASP A 107 -11.102 2.051 -1.921 1.00 0.27 H new ATOM 0 HA ASP A 107 -12.819 4.074 -3.109 1.00 0.32 H new ATOM 0 HB2 ASP A 107 -13.656 1.810 -2.897 1.00 0.37 H new ATOM 0 HB3 ASP A 107 -13.214 1.738 -1.203 1.00 0.37 H new ATOM 302 N LYS A 108 -13.494 5.481 -1.151 1.00 0.38 N ATOM 303 CA LYS A 108 -13.647 6.556 -0.172 1.00 0.43 C ATOM 304 C LYS A 108 -13.815 6.026 1.253 1.00 0.36 C ATOM 305 O LYS A 108 -13.328 6.627 2.213 1.00 0.46 O ATOM 306 CB LYS A 108 -14.869 7.409 -0.535 1.00 0.55 C ATOM 307 CG LYS A 108 -16.194 6.680 -0.348 1.00 0.57 C ATOM 308 CD LYS A 108 -17.377 7.520 -0.775 1.00 0.90 C ATOM 309 CE LYS A 108 -18.695 6.854 -0.391 1.00 1.21 C ATOM 310 NZ LYS A 108 -18.770 5.444 -0.865 1.00 2.20 N ATOM 0 H LYS A 108 -14.151 5.543 -1.929 1.00 0.38 H new ATOM 0 HA LYS A 108 -12.736 7.153 -0.201 1.00 0.43 H new ATOM 0 HB2 LYS A 108 -14.869 8.310 0.079 1.00 0.55 H new ATOM 0 HB3 LYS A 108 -14.783 7.730 -1.573 1.00 0.55 H new ATOM 0 HG2 LYS A 108 -16.181 5.755 -0.924 1.00 0.57 H new ATOM 0 HG3 LYS A 108 -16.308 6.402 0.700 1.00 0.57 H new ATOM 0 HD2 LYS A 108 -17.315 8.504 -0.310 1.00 0.90 H new ATOM 0 HD3 LYS A 108 -17.346 7.675 -1.853 1.00 0.90 H new ATOM 0 HE2 LYS A 108 -18.811 6.878 0.693 1.00 1.21 H new ATOM 0 HE3 LYS A 108 -19.524 7.422 -0.813 1.00 1.21 H new ATOM 0 HZ1 LYS A 108 -19.741 5.090 -0.750 1.00 2.20 H new ATOM 0 HZ2 LYS A 108 -18.502 5.401 -1.869 1.00 2.20 H new ATOM 0 HZ3 LYS A 108 -18.119 4.855 -0.307 1.00 2.20 H new ATOM 324 N SER A 109 -14.509 4.907 1.383 1.00 0.31 N ATOM 325 CA SER A 109 -14.881 4.384 2.683 1.00 0.40 C ATOM 326 C SER A 109 -13.803 3.468 3.267 1.00 0.34 C ATOM 327 O SER A 109 -13.952 2.966 4.381 1.00 0.43 O ATOM 328 CB SER A 109 -16.219 3.651 2.572 1.00 0.56 C ATOM 329 OG SER A 109 -17.208 4.489 1.992 1.00 1.41 O ATOM 0 H SER A 109 -14.827 4.341 0.596 1.00 0.31 H new ATOM 0 HA SER A 109 -14.982 5.223 3.371 1.00 0.40 H new ATOM 0 HB2 SER A 109 -16.097 2.753 1.967 1.00 0.56 H new ATOM 0 HB3 SER A 109 -16.545 3.328 3.561 1.00 0.56 H new ATOM 0 HG SER A 109 -18.055 4.000 1.929 1.00 1.41 H new ATOM 335 N ILE A 110 -12.731 3.234 2.516 1.00 0.23 N ATOM 336 CA ILE A 110 -11.647 2.385 2.993 1.00 0.20 C ATOM 337 C ILE A 110 -10.822 3.105 4.060 1.00 0.20 C ATOM 338 O ILE A 110 -10.321 4.209 3.842 1.00 0.26 O ATOM 339 CB ILE A 110 -10.736 1.918 1.833 1.00 0.20 C ATOM 340 CG1 ILE A 110 -11.521 0.995 0.892 1.00 0.21 C ATOM 341 CG2 ILE A 110 -9.492 1.210 2.360 1.00 0.22 C ATOM 342 CD1 ILE A 110 -12.011 -0.276 1.556 1.00 0.23 C ATOM 0 H ILE A 110 -12.591 3.618 1.581 1.00 0.23 H new ATOM 0 HA ILE A 110 -12.100 1.500 3.440 1.00 0.20 H new ATOM 0 HB ILE A 110 -10.408 2.797 1.278 1.00 0.20 H new ATOM 0 HG12 ILE A 110 -12.377 1.540 0.493 1.00 0.21 H new ATOM 0 HG13 ILE A 110 -10.888 0.731 0.045 1.00 0.21 H new ATOM 0 HG21 ILE A 110 -8.871 0.893 1.522 1.00 0.22 H new ATOM 0 HG22 ILE A 110 -8.926 1.893 2.994 1.00 0.22 H new ATOM 0 HG23 ILE A 110 -9.789 0.337 2.942 1.00 0.22 H new ATOM 0 HD11 ILE A 110 -12.557 -0.878 0.830 1.00 0.23 H new ATOM 0 HD12 ILE A 110 -11.159 -0.843 1.930 1.00 0.23 H new ATOM 0 HD13 ILE A 110 -12.670 -0.022 2.386 1.00 0.23 H new ATOM 354 N ASP A 111 -10.710 2.470 5.217 1.00 0.17 N ATOM 355 CA ASP A 111 -9.994 3.029 6.357 1.00 0.18 C ATOM 356 C ASP A 111 -8.641 2.360 6.527 1.00 0.14 C ATOM 357 O ASP A 111 -8.313 1.423 5.799 1.00 0.13 O ATOM 358 CB ASP A 111 -10.810 2.877 7.651 1.00 0.23 C ATOM 359 CG ASP A 111 -11.736 1.675 7.664 1.00 1.01 C ATOM 360 OD1 ASP A 111 -12.756 1.703 6.947 1.00 1.23 O ATOM 361 OD2 ASP A 111 -11.443 0.690 8.372 1.00 1.59 O ATOM 0 H ASP A 111 -11.114 1.550 5.394 1.00 0.17 H new ATOM 0 HA ASP A 111 -9.843 4.090 6.160 1.00 0.18 H new ATOM 0 HB2 ASP A 111 -10.123 2.802 8.494 1.00 0.23 H new ATOM 0 HB3 ASP A 111 -11.402 3.780 7.802 1.00 0.23 H new ATOM 366 N ASN A 112 -7.871 2.815 7.515 1.00 0.15 N ATOM 367 CA ASN A 112 -6.545 2.259 7.765 1.00 0.13 C ATOM 368 C ASN A 112 -6.731 0.882 8.333 1.00 0.11 C ATOM 369 O ASN A 112 -5.954 -0.033 8.084 1.00 0.12 O ATOM 370 CB ASN A 112 -5.746 3.098 8.770 1.00 0.16 C ATOM 371 CG ASN A 112 -5.473 4.518 8.310 1.00 0.19 C ATOM 372 OD1 ASN A 112 -6.227 5.095 7.529 1.00 0.60 O ATOM 373 ND2 ASN A 112 -4.400 5.104 8.816 1.00 0.55 N ATOM 0 H ASN A 112 -8.143 3.564 8.152 1.00 0.15 H new ATOM 0 HA ASN A 112 -5.989 2.247 6.828 1.00 0.13 H new ATOM 0 HB2 ASN A 112 -6.290 3.131 9.714 1.00 0.16 H new ATOM 0 HB3 ASN A 112 -4.796 2.602 8.967 1.00 0.16 H new ATOM 0 HD21 ASN A 112 -4.176 6.066 8.561 1.00 0.55 H new ATOM 0 HD22 ASN A 112 -3.797 4.594 9.462 1.00 0.55 H new ATOM 380 N LYS A 113 -7.802 0.759 9.092 1.00 0.12 N ATOM 381 CA LYS A 113 -8.222 -0.472 9.668 1.00 0.12 C ATOM 382 C LYS A 113 -8.594 -1.423 8.568 1.00 0.11 C ATOM 383 O LYS A 113 -8.187 -2.566 8.554 1.00 0.11 O ATOM 384 CB LYS A 113 -9.456 -0.177 10.466 1.00 0.15 C ATOM 385 CG LYS A 113 -9.690 -1.099 11.644 1.00 0.28 C ATOM 386 CD LYS A 113 -9.963 -2.530 11.192 1.00 0.54 C ATOM 387 CE LYS A 113 -11.391 -2.730 10.657 1.00 1.63 C ATOM 388 NZ LYS A 113 -12.064 -1.464 10.243 1.00 2.58 N ATOM 0 H LYS A 113 -8.411 1.544 9.323 1.00 0.12 H new ATOM 0 HA LYS A 113 -7.434 -0.907 10.283 1.00 0.12 H new ATOM 0 HB2 LYS A 113 -9.398 0.848 10.832 1.00 0.15 H new ATOM 0 HB3 LYS A 113 -10.320 -0.231 9.804 1.00 0.15 H new ATOM 0 HG2 LYS A 113 -8.818 -1.084 12.298 1.00 0.28 H new ATOM 0 HG3 LYS A 113 -10.534 -0.735 12.230 1.00 0.28 H new ATOM 0 HD2 LYS A 113 -9.249 -2.802 10.415 1.00 0.54 H new ATOM 0 HD3 LYS A 113 -9.797 -3.208 12.029 1.00 0.54 H new ATOM 0 HE2 LYS A 113 -11.357 -3.408 9.804 1.00 1.63 H new ATOM 0 HE3 LYS A 113 -11.992 -3.215 11.426 1.00 1.63 H new ATOM 0 HZ1 LYS A 113 -13.043 -1.668 9.958 1.00 2.58 H new ATOM 0 HZ2 LYS A 113 -12.068 -0.796 11.040 1.00 2.58 H new ATOM 0 HZ3 LYS A 113 -11.551 -1.044 9.442 1.00 2.58 H new ATOM 402 N ALA A 114 -9.401 -0.914 7.659 1.00 0.11 N ATOM 403 CA ALA A 114 -9.898 -1.703 6.537 1.00 0.12 C ATOM 404 C ALA A 114 -8.755 -2.200 5.671 1.00 0.11 C ATOM 405 O ALA A 114 -8.716 -3.368 5.271 1.00 0.13 O ATOM 406 CB ALA A 114 -10.836 -0.862 5.695 1.00 0.15 C ATOM 0 H ALA A 114 -9.732 0.051 7.672 1.00 0.11 H new ATOM 0 HA ALA A 114 -10.431 -2.565 6.938 1.00 0.12 H new ATOM 0 HB1 ALA A 114 -11.205 -1.455 4.858 1.00 0.15 H new ATOM 0 HB2 ALA A 114 -11.677 -0.534 6.305 1.00 0.15 H new ATOM 0 HB3 ALA A 114 -10.302 0.009 5.315 1.00 0.15 H new ATOM 412 N LEU A 115 -7.827 -1.303 5.392 1.00 0.09 N ATOM 413 CA LEU A 115 -6.648 -1.637 4.619 1.00 0.09 C ATOM 414 C LEU A 115 -5.816 -2.658 5.394 1.00 0.08 C ATOM 415 O LEU A 115 -5.411 -3.688 4.853 1.00 0.09 O ATOM 416 CB LEU A 115 -5.855 -0.349 4.348 1.00 0.10 C ATOM 417 CG LEU A 115 -4.870 -0.388 3.175 1.00 0.11 C ATOM 418 CD1 LEU A 115 -4.260 0.985 2.957 1.00 0.16 C ATOM 419 CD2 LEU A 115 -3.779 -1.408 3.412 1.00 0.11 C ATOM 0 H LEU A 115 -7.870 -0.329 5.693 1.00 0.09 H new ATOM 0 HA LEU A 115 -6.921 -2.081 3.662 1.00 0.09 H new ATOM 0 HB2 LEU A 115 -6.565 0.458 4.170 1.00 0.10 H new ATOM 0 HB3 LEU A 115 -5.301 -0.093 5.251 1.00 0.10 H new ATOM 0 HG LEU A 115 -5.421 -0.681 2.281 1.00 0.11 H new ATOM 0 HD11 LEU A 115 -3.562 0.944 2.121 1.00 0.16 H new ATOM 0 HD12 LEU A 115 -5.050 1.703 2.736 1.00 0.16 H new ATOM 0 HD13 LEU A 115 -3.730 1.295 3.858 1.00 0.16 H new ATOM 0 HD21 LEU A 115 -3.095 -1.413 2.563 1.00 0.11 H new ATOM 0 HD22 LEU A 115 -3.231 -1.150 4.318 1.00 0.11 H new ATOM 0 HD23 LEU A 115 -4.224 -2.397 3.526 1.00 0.11 H new ATOM 431 N TYR A 116 -5.609 -2.385 6.675 1.00 0.08 N ATOM 432 CA TYR A 116 -4.898 -3.301 7.550 1.00 0.09 C ATOM 433 C TYR A 116 -5.600 -4.649 7.620 1.00 0.10 C ATOM 434 O TYR A 116 -4.971 -5.682 7.429 1.00 0.11 O ATOM 435 CB TYR A 116 -4.770 -2.705 8.956 1.00 0.10 C ATOM 436 CG TYR A 116 -4.249 -3.686 9.983 1.00 0.13 C ATOM 437 CD1 TYR A 116 -2.889 -3.962 10.089 1.00 0.19 C ATOM 438 CD2 TYR A 116 -5.117 -4.322 10.857 1.00 0.18 C ATOM 439 CE1 TYR A 116 -2.417 -4.849 11.035 1.00 0.24 C ATOM 440 CE2 TYR A 116 -4.650 -5.209 11.807 1.00 0.23 C ATOM 441 CZ TYR A 116 -3.284 -5.506 11.846 1.00 0.23 C ATOM 442 OH TYR A 116 -2.836 -6.361 12.829 1.00 0.30 O ATOM 0 H TYR A 116 -5.927 -1.530 7.132 1.00 0.08 H new ATOM 0 HA TYR A 116 -3.902 -3.454 7.135 1.00 0.09 H new ATOM 0 HB2 TYR A 116 -4.103 -1.844 8.917 1.00 0.10 H new ATOM 0 HB3 TYR A 116 -5.745 -2.339 9.277 1.00 0.10 H new ATOM 0 HD1 TYR A 116 -2.193 -3.475 9.422 1.00 0.19 H new ATOM 0 HD2 TYR A 116 -6.176 -4.120 10.794 1.00 0.18 H new ATOM 0 HE1 TYR A 116 -1.355 -5.021 11.130 1.00 0.24 H new ATOM 0 HE2 TYR A 116 -5.330 -5.667 12.510 1.00 0.23 H new ATOM 0 HH TYR A 116 -3.603 -6.738 13.309 1.00 0.30 H new ATOM 452 N ASP A 117 -6.904 -4.631 7.860 1.00 0.10 N ATOM 453 CA ASP A 117 -7.666 -5.862 8.052 1.00 0.12 C ATOM 454 C ASP A 117 -7.550 -6.776 6.838 1.00 0.12 C ATOM 455 O ASP A 117 -7.531 -8.001 6.967 1.00 0.15 O ATOM 456 CB ASP A 117 -9.139 -5.538 8.304 1.00 0.16 C ATOM 457 CG ASP A 117 -9.904 -6.724 8.851 1.00 0.27 C ATOM 458 OD1 ASP A 117 -9.873 -6.940 10.081 1.00 0.36 O ATOM 459 OD2 ASP A 117 -10.560 -7.436 8.064 1.00 0.40 O ATOM 0 H ASP A 117 -7.459 -3.778 7.927 1.00 0.10 H new ATOM 0 HA ASP A 117 -7.251 -6.378 8.918 1.00 0.12 H new ATOM 0 HB2 ASP A 117 -9.211 -4.707 9.006 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -9.601 -5.209 7.373 1.00 0.16 H new ATOM 464 N THR A 118 -7.482 -6.180 5.660 1.00 0.11 N ATOM 465 CA THR A 118 -7.355 -6.949 4.436 1.00 0.11 C ATOM 466 C THR A 118 -5.915 -7.432 4.206 1.00 0.10 C ATOM 467 O THR A 118 -5.671 -8.628 4.037 1.00 0.12 O ATOM 468 CB THR A 118 -7.816 -6.118 3.224 1.00 0.13 C ATOM 469 OG1 THR A 118 -9.115 -5.565 3.479 1.00 0.22 O ATOM 470 CG2 THR A 118 -7.866 -6.976 1.970 1.00 0.17 C ATOM 0 H THR A 118 -7.513 -5.169 5.526 1.00 0.11 H new ATOM 0 HA THR A 118 -7.994 -7.825 4.544 1.00 0.11 H new ATOM 0 HB THR A 118 -7.099 -5.312 3.067 1.00 0.13 H new ATOM 0 HG1 THR A 118 -9.032 -4.806 4.093 1.00 0.22 H new ATOM 0 HG21 THR A 118 -8.194 -6.369 1.126 1.00 0.17 H new ATOM 0 HG22 THR A 118 -6.874 -7.377 1.764 1.00 0.17 H new ATOM 0 HG23 THR A 118 -8.566 -7.798 2.119 1.00 0.17 H new ATOM 478 N PHE A 119 -4.966 -6.495 4.215 1.00 0.08 N ATOM 479 CA PHE A 119 -3.573 -6.796 3.874 1.00 0.08 C ATOM 480 C PHE A 119 -2.854 -7.594 4.972 1.00 0.08 C ATOM 481 O PHE A 119 -1.949 -8.371 4.678 1.00 0.09 O ATOM 482 CB PHE A 119 -2.801 -5.516 3.519 1.00 0.08 C ATOM 483 CG PHE A 119 -3.244 -4.872 2.220 1.00 0.08 C ATOM 484 CD1 PHE A 119 -4.533 -4.381 2.084 1.00 0.10 C ATOM 485 CD2 PHE A 119 -2.372 -4.744 1.141 1.00 0.08 C ATOM 486 CE1 PHE A 119 -4.947 -3.781 0.912 1.00 0.11 C ATOM 487 CE2 PHE A 119 -2.783 -4.143 -0.031 1.00 0.10 C ATOM 488 CZ PHE A 119 -4.072 -3.662 -0.146 1.00 0.09 C ATOM 0 H PHE A 119 -5.136 -5.518 4.455 1.00 0.08 H new ATOM 0 HA PHE A 119 -3.598 -7.435 2.992 1.00 0.08 H new ATOM 0 HB2 PHE A 119 -2.919 -4.796 4.329 1.00 0.08 H new ATOM 0 HB3 PHE A 119 -1.739 -5.751 3.453 1.00 0.08 H new ATOM 0 HD1 PHE A 119 -5.225 -4.469 2.909 1.00 0.10 H new ATOM 0 HD2 PHE A 119 -1.363 -5.120 1.223 1.00 0.08 H new ATOM 0 HE1 PHE A 119 -5.956 -3.405 0.824 1.00 0.11 H new ATOM 0 HE2 PHE A 119 -2.096 -4.049 -0.859 1.00 0.10 H new ATOM 0 HZ PHE A 119 -4.394 -3.193 -1.064 1.00 0.09 H new ATOM 498 N SER A 120 -3.254 -7.406 6.229 1.00 0.09 N ATOM 499 CA SER A 120 -2.594 -8.068 7.358 1.00 0.09 C ATOM 500 C SER A 120 -2.641 -9.591 7.219 1.00 0.08 C ATOM 501 O SER A 120 -1.780 -10.296 7.744 1.00 0.09 O ATOM 502 CB SER A 120 -3.188 -7.628 8.702 1.00 0.13 C ATOM 503 OG SER A 120 -2.417 -8.129 9.781 1.00 0.19 O ATOM 0 H SER A 120 -4.032 -6.801 6.493 1.00 0.09 H new ATOM 0 HA SER A 120 -1.549 -7.759 7.340 1.00 0.09 H new ATOM 0 HB2 SER A 120 -3.225 -6.540 8.750 1.00 0.13 H new ATOM 0 HB3 SER A 120 -4.214 -7.985 8.786 1.00 0.13 H new ATOM 0 HG SER A 120 -2.483 -7.516 10.543 1.00 0.19 H new ATOM 509 N ALA A 121 -3.663 -10.095 6.538 1.00 0.09 N ATOM 510 CA ALA A 121 -3.778 -11.527 6.270 1.00 0.11 C ATOM 511 C ALA A 121 -2.542 -12.055 5.539 1.00 0.11 C ATOM 512 O ALA A 121 -2.234 -13.246 5.595 1.00 0.13 O ATOM 513 CB ALA A 121 -5.025 -11.806 5.444 1.00 0.14 C ATOM 0 H ALA A 121 -4.426 -9.534 6.160 1.00 0.09 H new ATOM 0 HA ALA A 121 -3.855 -12.043 7.227 1.00 0.11 H new ATOM 0 HB1 ALA A 121 -5.101 -12.876 5.250 1.00 0.14 H new ATOM 0 HB2 ALA A 121 -5.906 -11.473 5.992 1.00 0.14 H new ATOM 0 HB3 ALA A 121 -4.962 -11.269 4.497 1.00 0.14 H new ATOM 519 N PHE A 122 -1.832 -11.157 4.864 1.00 0.08 N ATOM 520 CA PHE A 122 -0.641 -11.522 4.111 1.00 0.09 C ATOM 521 C PHE A 122 0.606 -11.416 4.984 1.00 0.10 C ATOM 522 O PHE A 122 1.642 -12.007 4.675 1.00 0.18 O ATOM 523 CB PHE A 122 -0.506 -10.622 2.879 1.00 0.09 C ATOM 524 CG PHE A 122 -1.757 -10.583 2.052 1.00 0.09 C ATOM 525 CD1 PHE A 122 -2.285 -11.748 1.525 1.00 0.13 C ATOM 526 CD2 PHE A 122 -2.415 -9.388 1.823 1.00 0.10 C ATOM 527 CE1 PHE A 122 -3.449 -11.720 0.782 1.00 0.16 C ATOM 528 CE2 PHE A 122 -3.576 -9.351 1.078 1.00 0.12 C ATOM 529 CZ PHE A 122 -4.095 -10.520 0.558 1.00 0.13 C ATOM 0 H PHE A 122 -2.064 -10.165 4.824 1.00 0.08 H new ATOM 0 HA PHE A 122 -0.740 -12.558 3.786 1.00 0.09 H new ATOM 0 HB2 PHE A 122 -0.255 -9.611 3.198 1.00 0.09 H new ATOM 0 HB3 PHE A 122 0.321 -10.977 2.264 1.00 0.09 H new ATOM 0 HD1 PHE A 122 -1.782 -12.688 1.696 1.00 0.13 H new ATOM 0 HD2 PHE A 122 -2.015 -8.472 2.233 1.00 0.10 H new ATOM 0 HE1 PHE A 122 -3.854 -12.636 0.377 1.00 0.16 H new ATOM 0 HE2 PHE A 122 -4.077 -8.411 0.902 1.00 0.12 H new ATOM 0 HZ PHE A 122 -5.005 -10.496 -0.023 1.00 0.13 H new ATOM 539 N GLY A 123 0.495 -10.674 6.078 1.00 0.09 N ATOM 540 CA GLY A 123 1.610 -10.505 6.983 1.00 0.10 C ATOM 541 C GLY A 123 1.360 -9.400 7.986 1.00 0.09 C ATOM 542 O GLY A 123 0.412 -8.629 7.842 1.00 0.11 O ATOM 0 H GLY A 123 -0.355 -10.183 6.354 1.00 0.09 H new ATOM 0 HA2 GLY A 123 1.794 -11.440 7.512 1.00 0.10 H new ATOM 0 HA3 GLY A 123 2.510 -10.280 6.412 1.00 0.10 H new ATOM 546 N ASN A 124 2.205 -9.320 8.999 1.00 0.13 N ATOM 547 CA ASN A 124 2.069 -8.295 10.024 1.00 0.14 C ATOM 548 C ASN A 124 2.399 -6.925 9.442 1.00 0.11 C ATOM 549 O ASN A 124 3.321 -6.787 8.642 1.00 0.14 O ATOM 550 CB ASN A 124 2.987 -8.611 11.212 1.00 0.18 C ATOM 551 CG ASN A 124 2.908 -7.565 12.309 1.00 0.21 C ATOM 552 OD1 ASN A 124 1.876 -6.924 12.504 1.00 0.24 O ATOM 553 ND2 ASN A 124 3.997 -7.391 13.041 1.00 0.25 N ATOM 0 H ASN A 124 2.994 -9.952 9.136 1.00 0.13 H new ATOM 0 HA ASN A 124 1.038 -8.282 10.378 1.00 0.14 H new ATOM 0 HB2 ASN A 124 2.719 -9.584 11.624 1.00 0.18 H new ATOM 0 HB3 ASN A 124 4.016 -8.686 10.861 1.00 0.18 H new ATOM 0 HD21 ASN A 124 3.999 -6.706 13.797 1.00 0.25 H new ATOM 0 HD22 ASN A 124 4.834 -7.942 12.849 1.00 0.25 H new ATOM 560 N ILE A 125 1.633 -5.922 9.831 1.00 0.11 N ATOM 561 CA ILE A 125 1.827 -4.572 9.328 1.00 0.10 C ATOM 562 C ILE A 125 2.330 -3.654 10.439 1.00 0.11 C ATOM 563 O ILE A 125 1.799 -3.672 11.551 1.00 0.14 O ATOM 564 CB ILE A 125 0.514 -4.012 8.746 1.00 0.11 C ATOM 565 CG1 ILE A 125 0.037 -4.889 7.583 1.00 0.10 C ATOM 566 CG2 ILE A 125 0.697 -2.572 8.291 1.00 0.14 C ATOM 567 CD1 ILE A 125 -1.282 -4.450 6.986 1.00 0.11 C ATOM 0 H ILE A 125 0.866 -6.017 10.497 1.00 0.11 H new ATOM 0 HA ILE A 125 2.574 -4.613 8.535 1.00 0.10 H new ATOM 0 HB ILE A 125 -0.245 -4.025 9.528 1.00 0.11 H new ATOM 0 HG12 ILE A 125 0.797 -4.885 6.802 1.00 0.10 H new ATOM 0 HG13 ILE A 125 -0.057 -5.918 7.931 1.00 0.10 H new ATOM 0 HG21 ILE A 125 -0.242 -2.197 7.884 1.00 0.14 H new ATOM 0 HG22 ILE A 125 0.995 -1.957 9.140 1.00 0.14 H new ATOM 0 HG23 ILE A 125 1.469 -2.529 7.523 1.00 0.14 H new ATOM 0 HD11 ILE A 125 -1.552 -5.119 6.169 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.057 -4.481 7.752 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.189 -3.433 6.606 1.00 0.11 H new ATOM 579 N LEU A 126 3.353 -2.857 10.140 1.00 0.13 N ATOM 580 CA LEU A 126 3.913 -1.946 11.133 1.00 0.15 C ATOM 581 C LEU A 126 3.222 -0.593 11.026 1.00 0.16 C ATOM 582 O LEU A 126 2.965 0.077 12.025 1.00 0.24 O ATOM 583 CB LEU A 126 5.431 -1.728 10.953 1.00 0.19 C ATOM 584 CG LEU A 126 6.327 -2.962 10.728 1.00 0.21 C ATOM 585 CD1 LEU A 126 5.753 -4.221 11.353 1.00 0.53 C ATOM 586 CD2 LEU A 126 6.604 -3.150 9.247 1.00 0.54 C ATOM 0 H LEU A 126 3.807 -2.824 9.227 1.00 0.13 H new ATOM 0 HA LEU A 126 3.749 -2.402 12.109 1.00 0.15 H new ATOM 0 HB2 LEU A 126 5.572 -1.057 10.106 1.00 0.19 H new ATOM 0 HB3 LEU A 126 5.799 -1.207 11.837 1.00 0.19 H new ATOM 0 HG LEU A 126 7.273 -2.776 11.237 1.00 0.21 H new ATOM 0 HD11 LEU A 126 6.424 -5.059 11.164 1.00 0.53 H new ATOM 0 HD12 LEU A 126 5.645 -4.077 12.428 1.00 0.53 H new ATOM 0 HD13 LEU A 126 4.777 -4.432 10.916 1.00 0.53 H new ATOM 0 HD21 LEU A 126 7.238 -4.025 9.104 1.00 0.54 H new ATOM 0 HD22 LEU A 126 5.663 -3.293 8.716 1.00 0.54 H new ATOM 0 HD23 LEU A 126 7.110 -2.267 8.857 1.00 0.54 H new ATOM 598 N SER A 127 2.936 -0.194 9.792 1.00 0.14 N ATOM 599 CA SER A 127 2.343 1.106 9.518 1.00 0.17 C ATOM 600 C SER A 127 1.586 1.092 8.192 1.00 0.19 C ATOM 601 O SER A 127 2.192 1.117 7.121 1.00 0.37 O ATOM 602 CB SER A 127 3.432 2.185 9.483 1.00 0.19 C ATOM 603 OG SER A 127 4.039 2.350 10.755 1.00 0.76 O ATOM 0 H SER A 127 3.108 -0.759 8.960 1.00 0.14 H new ATOM 0 HA SER A 127 1.636 1.332 10.317 1.00 0.17 H new ATOM 0 HB2 SER A 127 4.191 1.915 8.749 1.00 0.19 H new ATOM 0 HB3 SER A 127 2.998 3.131 9.160 1.00 0.19 H new ATOM 0 HG SER A 127 4.730 3.043 10.700 1.00 0.76 H new ATOM 609 N CYS A 128 0.268 1.017 8.260 1.00 0.18 N ATOM 610 CA CYS A 128 -0.555 1.141 7.069 1.00 0.17 C ATOM 611 C CYS A 128 -1.241 2.496 7.055 1.00 0.16 C ATOM 612 O CYS A 128 -1.649 3.011 8.099 1.00 0.28 O ATOM 613 CB CYS A 128 -1.589 0.016 6.984 1.00 0.21 C ATOM 614 SG CYS A 128 -2.576 -0.199 8.480 1.00 0.72 S ATOM 0 H CYS A 128 -0.254 0.871 9.124 1.00 0.18 H new ATOM 0 HA CYS A 128 0.093 1.058 6.197 1.00 0.17 H new ATOM 0 HB2 CYS A 128 -2.258 0.215 6.147 1.00 0.21 H new ATOM 0 HB3 CYS A 128 -1.074 -0.919 6.765 1.00 0.21 H new ATOM 0 HG CYS A 128 -3.839 -0.195 8.171 1.00 0.72 H new ATOM 620 N LYS A 129 -1.356 3.071 5.873 1.00 0.13 N ATOM 621 CA LYS A 129 -1.869 4.417 5.724 1.00 0.14 C ATOM 622 C LYS A 129 -2.868 4.491 4.577 1.00 0.12 C ATOM 623 O LYS A 129 -2.602 4.001 3.485 1.00 0.12 O ATOM 624 CB LYS A 129 -0.692 5.373 5.467 1.00 0.18 C ATOM 625 CG LYS A 129 -1.086 6.809 5.147 1.00 0.23 C ATOM 626 CD LYS A 129 -1.706 7.509 6.343 1.00 0.36 C ATOM 627 CE LYS A 129 -1.994 8.975 6.050 1.00 0.47 C ATOM 628 NZ LYS A 129 -2.641 9.650 7.204 1.00 1.00 N ATOM 0 H LYS A 129 -1.098 2.621 4.995 1.00 0.13 H new ATOM 0 HA LYS A 129 -2.387 4.707 6.638 1.00 0.14 H new ATOM 0 HB2 LYS A 129 -0.048 5.376 6.346 1.00 0.18 H new ATOM 0 HB3 LYS A 129 -0.100 4.982 4.640 1.00 0.18 H new ATOM 0 HG2 LYS A 129 -0.206 7.362 4.820 1.00 0.23 H new ATOM 0 HG3 LYS A 129 -1.793 6.815 4.317 1.00 0.23 H new ATOM 0 HD2 LYS A 129 -2.632 7.005 6.620 1.00 0.36 H new ATOM 0 HD3 LYS A 129 -1.034 7.434 7.198 1.00 0.36 H new ATOM 0 HE2 LYS A 129 -1.063 9.487 5.804 1.00 0.47 H new ATOM 0 HE3 LYS A 129 -2.640 9.051 5.175 1.00 0.47 H new ATOM 0 HZ1 LYS A 129 -2.822 10.646 6.967 1.00 1.00 H new ATOM 0 HZ2 LYS A 129 -3.541 9.177 7.422 1.00 1.00 H new ATOM 0 HZ3 LYS A 129 -2.014 9.599 8.032 1.00 1.00 H new ATOM 642 N VAL A 130 -4.020 5.085 4.843 1.00 0.15 N ATOM 643 CA VAL A 130 -4.975 5.414 3.804 1.00 0.17 C ATOM 644 C VAL A 130 -5.068 6.914 3.757 1.00 0.20 C ATOM 645 O VAL A 130 -5.568 7.542 4.690 1.00 0.24 O ATOM 646 CB VAL A 130 -6.399 4.849 4.037 1.00 0.21 C ATOM 647 CG1 VAL A 130 -7.319 5.256 2.887 1.00 0.28 C ATOM 648 CG2 VAL A 130 -6.381 3.337 4.188 1.00 0.21 C ATOM 0 H VAL A 130 -4.316 5.351 5.782 1.00 0.15 H new ATOM 0 HA VAL A 130 -4.618 4.964 2.877 1.00 0.17 H new ATOM 0 HB VAL A 130 -6.780 5.270 4.967 1.00 0.21 H new ATOM 0 HG11 VAL A 130 -8.317 4.854 3.060 1.00 0.28 H new ATOM 0 HG12 VAL A 130 -7.370 6.343 2.830 1.00 0.28 H new ATOM 0 HG13 VAL A 130 -6.926 4.861 1.950 1.00 0.28 H new ATOM 0 HG21 VAL A 130 -7.396 2.975 4.350 1.00 0.21 H new ATOM 0 HG22 VAL A 130 -5.975 2.886 3.283 1.00 0.21 H new ATOM 0 HG23 VAL A 130 -5.758 3.064 5.040 1.00 0.21 H new ATOM 658 N VAL A 131 -4.559 7.490 2.702 1.00 0.21 N ATOM 659 CA VAL A 131 -4.516 8.924 2.598 1.00 0.27 C ATOM 660 C VAL A 131 -5.890 9.422 2.191 1.00 0.33 C ATOM 661 O VAL A 131 -6.380 9.109 1.106 1.00 0.33 O ATOM 662 CB VAL A 131 -3.427 9.331 1.597 1.00 0.28 C ATOM 663 CG1 VAL A 131 -3.123 10.815 1.687 1.00 0.34 C ATOM 664 CG2 VAL A 131 -2.182 8.503 1.870 1.00 0.25 C ATOM 0 H VAL A 131 -4.169 6.990 1.903 1.00 0.21 H new ATOM 0 HA VAL A 131 -4.261 9.379 3.555 1.00 0.27 H new ATOM 0 HB VAL A 131 -3.779 9.140 0.583 1.00 0.28 H new ATOM 0 HG11 VAL A 131 -2.348 11.072 0.965 1.00 0.34 H new ATOM 0 HG12 VAL A 131 -4.026 11.385 1.468 1.00 0.34 H new ATOM 0 HG13 VAL A 131 -2.777 11.055 2.692 1.00 0.34 H new ATOM 0 HG21 VAL A 131 -1.398 8.781 1.166 1.00 0.25 H new ATOM 0 HG22 VAL A 131 -1.838 8.688 2.888 1.00 0.25 H new ATOM 0 HG23 VAL A 131 -2.416 7.445 1.753 1.00 0.25 H new ATOM 674 N CYS A 132 -6.519 10.173 3.078 1.00 0.43 N ATOM 675 CA CYS A 132 -7.930 10.483 2.942 1.00 0.55 C ATOM 676 C CYS A 132 -8.175 11.897 2.444 1.00 0.58 C ATOM 677 O CYS A 132 -7.533 12.852 2.881 1.00 0.66 O ATOM 678 CB CYS A 132 -8.641 10.255 4.279 1.00 0.75 C ATOM 679 SG CYS A 132 -7.859 11.065 5.692 1.00 1.58 S ATOM 0 H CYS A 132 -6.074 10.579 3.901 1.00 0.43 H new ATOM 0 HA CYS A 132 -8.340 9.812 2.187 1.00 0.55 H new ATOM 0 HB2 CYS A 132 -9.668 10.611 4.195 1.00 0.75 H new ATOM 0 HB3 CYS A 132 -8.690 9.183 4.472 1.00 0.75 H new ATOM 0 HG CYS A 132 -8.540 10.810 6.770 1.00 1.58 H new ATOM 685 N ASP A 133 -9.102 12.006 1.499 1.00 0.59 N ATOM 686 CA ASP A 133 -9.533 13.281 0.977 1.00 0.72 C ATOM 687 C ASP A 133 -10.647 13.824 1.861 1.00 0.93 C ATOM 688 O ASP A 133 -11.163 13.100 2.715 1.00 0.99 O ATOM 689 CB ASP A 133 -10.034 13.127 -0.466 1.00 0.70 C ATOM 690 CG ASP A 133 -10.244 14.455 -1.162 1.00 1.09 C ATOM 691 OD1 ASP A 133 -9.239 15.084 -1.556 1.00 1.20 O ATOM 692 OD2 ASP A 133 -11.410 14.882 -1.302 1.00 2.08 O ATOM 0 H ASP A 133 -9.572 11.205 1.077 1.00 0.59 H new ATOM 0 HA ASP A 133 -8.692 13.975 0.974 1.00 0.72 H new ATOM 0 HB2 ASP A 133 -9.316 12.535 -1.033 1.00 0.70 H new ATOM 0 HB3 ASP A 133 -10.972 12.572 -0.462 1.00 0.70 H new ATOM 697 N GLU A 134 -11.026 15.077 1.661 1.00 1.12 N ATOM 698 CA GLU A 134 -12.175 15.643 2.365 1.00 1.35 C ATOM 699 C GLU A 134 -13.441 14.848 2.025 1.00 1.36 C ATOM 700 O GLU A 134 -14.359 14.738 2.837 1.00 1.52 O ATOM 701 CB GLU A 134 -12.383 17.122 2.003 1.00 1.57 C ATOM 702 CG GLU A 134 -12.911 17.342 0.591 1.00 1.60 C ATOM 703 CD GLU A 134 -13.301 18.778 0.326 1.00 1.96 C ATOM 704 OE1 GLU A 134 -14.375 19.203 0.793 1.00 2.45 O ATOM 705 OE2 GLU A 134 -12.533 19.496 -0.341 1.00 2.09 O ATOM 0 H GLU A 134 -10.560 15.721 1.022 1.00 1.12 H new ATOM 0 HA GLU A 134 -11.976 15.579 3.435 1.00 1.35 H new ATOM 0 HB2 GLU A 134 -13.079 17.566 2.714 1.00 1.57 H new ATOM 0 HB3 GLU A 134 -11.436 17.650 2.113 1.00 1.57 H new ATOM 0 HG2 GLU A 134 -12.149 17.039 -0.128 1.00 1.60 H new ATOM 0 HG3 GLU A 134 -13.776 16.700 0.428 1.00 1.60 H new ATOM 712 N ASN A 135 -13.466 14.279 0.822 1.00 1.25 N ATOM 713 CA ASN A 135 -14.617 13.512 0.349 1.00 1.31 C ATOM 714 C ASN A 135 -14.549 12.065 0.819 1.00 1.25 C ATOM 715 O ASN A 135 -15.444 11.269 0.538 1.00 1.36 O ATOM 716 CB ASN A 135 -14.715 13.541 -1.182 1.00 1.32 C ATOM 717 CG ASN A 135 -15.173 14.882 -1.725 1.00 1.47 C ATOM 718 OD1 ASN A 135 -16.371 15.154 -1.800 1.00 1.65 O ATOM 719 ND2 ASN A 135 -14.232 15.713 -2.142 1.00 1.46 N ATOM 0 H ASN A 135 -12.698 14.335 0.153 1.00 1.25 H new ATOM 0 HA ASN A 135 -15.505 13.982 0.772 1.00 1.31 H new ATOM 0 HB2 ASN A 135 -13.741 13.297 -1.607 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -15.409 12.767 -1.510 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -14.489 16.615 -2.542 1.00 1.46 H new ATOM 0 HD22 ASN A 135 -13.249 15.452 -2.063 1.00 1.46 H new ATOM 726 N GLY A 136 -13.488 11.723 1.532 1.00 1.12 N ATOM 727 CA GLY A 136 -13.349 10.370 2.040 1.00 1.11 C ATOM 728 C GLY A 136 -11.931 9.839 1.932 1.00 0.89 C ATOM 729 O GLY A 136 -11.256 9.675 2.942 1.00 0.86 O ATOM 0 H GLY A 136 -12.722 12.353 1.769 1.00 1.12 H new ATOM 0 HA2 GLY A 136 -13.662 10.346 3.084 1.00 1.11 H new ATOM 0 HA3 GLY A 136 -14.021 9.711 1.491 1.00 1.11 H new ATOM 733 N SER A 137 -11.467 9.579 0.715 1.00 0.77 N ATOM 734 CA SER A 137 -10.124 9.055 0.510 1.00 0.57 C ATOM 735 C SER A 137 -9.501 9.696 -0.721 1.00 0.47 C ATOM 736 O SER A 137 -10.211 10.077 -1.650 1.00 0.53 O ATOM 737 CB SER A 137 -10.157 7.530 0.352 1.00 0.67 C ATOM 738 OG SER A 137 -8.847 7.000 0.235 1.00 1.61 O ATOM 0 H SER A 137 -12.001 9.723 -0.142 1.00 0.77 H new ATOM 0 HA SER A 137 -9.519 9.297 1.384 1.00 0.57 H new ATOM 0 HB2 SER A 137 -10.658 7.083 1.211 1.00 0.67 H new ATOM 0 HB3 SER A 137 -10.740 7.265 -0.530 1.00 0.67 H new ATOM 0 HG SER A 137 -8.896 6.026 0.137 1.00 1.61 H new ATOM 744 N LYS A 138 -8.180 9.836 -0.719 1.00 0.38 N ATOM 745 CA LYS A 138 -7.489 10.435 -1.850 1.00 0.36 C ATOM 746 C LYS A 138 -7.308 9.403 -2.943 1.00 0.34 C ATOM 747 O LYS A 138 -6.979 9.730 -4.082 1.00 0.47 O ATOM 748 CB LYS A 138 -6.127 11.014 -1.453 1.00 0.36 C ATOM 749 CG LYS A 138 -6.170 11.991 -0.285 1.00 0.44 C ATOM 750 CD LYS A 138 -5.050 13.011 -0.370 1.00 0.67 C ATOM 751 CE LYS A 138 -5.282 13.981 -1.522 1.00 0.89 C ATOM 752 NZ LYS A 138 -6.377 14.948 -1.232 1.00 1.51 N ATOM 0 H LYS A 138 -7.572 9.545 0.047 1.00 0.38 H new ATOM 0 HA LYS A 138 -8.103 11.259 -2.213 1.00 0.36 H new ATOM 0 HB2 LYS A 138 -5.458 10.192 -1.198 1.00 0.36 H new ATOM 0 HB3 LYS A 138 -5.696 11.520 -2.317 1.00 0.36 H new ATOM 0 HG2 LYS A 138 -7.131 12.505 -0.275 1.00 0.44 H new ATOM 0 HG3 LYS A 138 -6.092 11.441 0.653 1.00 0.44 H new ATOM 0 HD2 LYS A 138 -4.984 13.563 0.567 1.00 0.67 H new ATOM 0 HD3 LYS A 138 -4.097 12.500 -0.507 1.00 0.67 H new ATOM 0 HE2 LYS A 138 -4.361 14.528 -1.725 1.00 0.89 H new ATOM 0 HE3 LYS A 138 -5.525 13.419 -2.424 1.00 0.89 H new ATOM 0 HZ1 LYS A 138 -6.209 15.830 -1.757 1.00 1.51 H new ATOM 0 HZ2 LYS A 138 -7.288 14.539 -1.524 1.00 1.51 H new ATOM 0 HZ3 LYS A 138 -6.400 15.151 -0.212 1.00 1.51 H new ATOM 766 N GLY A 139 -7.526 8.153 -2.580 1.00 0.27 N ATOM 767 CA GLY A 139 -7.472 7.087 -3.555 1.00 0.26 C ATOM 768 C GLY A 139 -6.272 6.185 -3.387 1.00 0.21 C ATOM 769 O GLY A 139 -6.235 5.093 -3.943 1.00 0.31 O ATOM 0 H GLY A 139 -7.740 7.856 -1.628 1.00 0.27 H new ATOM 0 HA2 GLY A 139 -8.381 6.489 -3.481 1.00 0.26 H new ATOM 0 HA3 GLY A 139 -7.456 7.519 -4.555 1.00 0.26 H new ATOM 773 N TYR A 140 -5.291 6.613 -2.618 1.00 0.19 N ATOM 774 CA TYR A 140 -4.064 5.845 -2.502 1.00 0.15 C ATOM 775 C TYR A 140 -3.681 5.606 -1.052 1.00 0.13 C ATOM 776 O TYR A 140 -3.964 6.422 -0.170 1.00 0.16 O ATOM 777 CB TYR A 140 -2.918 6.518 -3.273 1.00 0.19 C ATOM 778 CG TYR A 140 -2.722 7.989 -2.976 1.00 0.23 C ATOM 779 CD1 TYR A 140 -3.495 8.954 -3.612 1.00 0.26 C ATOM 780 CD2 TYR A 140 -1.752 8.414 -2.078 1.00 0.31 C ATOM 781 CE1 TYR A 140 -3.307 10.298 -3.359 1.00 0.34 C ATOM 782 CE2 TYR A 140 -1.555 9.757 -1.823 1.00 0.39 C ATOM 783 CZ TYR A 140 -2.335 10.695 -2.464 1.00 0.41 C ATOM 784 OH TYR A 140 -2.139 12.035 -2.217 1.00 0.49 O ATOM 0 H TYR A 140 -5.315 7.474 -2.072 1.00 0.19 H new ATOM 0 HA TYR A 140 -4.249 4.869 -2.952 1.00 0.15 H new ATOM 0 HB2 TYR A 140 -1.991 5.991 -3.048 1.00 0.19 H new ATOM 0 HB3 TYR A 140 -3.101 6.400 -4.341 1.00 0.19 H new ATOM 0 HD1 TYR A 140 -4.255 8.647 -4.315 1.00 0.26 H new ATOM 0 HD2 TYR A 140 -1.141 7.682 -1.570 1.00 0.31 H new ATOM 0 HE1 TYR A 140 -3.918 11.035 -3.859 1.00 0.34 H new ATOM 0 HE2 TYR A 140 -0.793 10.071 -1.125 1.00 0.39 H new ATOM 0 HH TYR A 140 -1.419 12.145 -1.562 1.00 0.49 H new ATOM 794 N GLY A 141 -3.048 4.467 -0.820 1.00 0.11 N ATOM 795 CA GLY A 141 -2.629 4.090 0.509 1.00 0.11 C ATOM 796 C GLY A 141 -1.299 3.372 0.486 1.00 0.10 C ATOM 797 O GLY A 141 -0.796 3.031 -0.584 1.00 0.12 O ATOM 0 H GLY A 141 -2.815 3.787 -1.544 1.00 0.11 H new ATOM 0 HA2 GLY A 141 -2.553 4.980 1.134 1.00 0.11 H new ATOM 0 HA3 GLY A 141 -3.384 3.446 0.961 1.00 0.11 H new ATOM 801 N PHE A 142 -0.726 3.141 1.657 1.00 0.10 N ATOM 802 CA PHE A 142 0.592 2.526 1.758 1.00 0.10 C ATOM 803 C PHE A 142 0.616 1.490 2.878 1.00 0.10 C ATOM 804 O PHE A 142 0.058 1.721 3.951 1.00 0.14 O ATOM 805 CB PHE A 142 1.656 3.595 2.032 1.00 0.12 C ATOM 806 CG PHE A 142 1.619 4.757 1.075 1.00 0.14 C ATOM 807 CD1 PHE A 142 2.037 4.599 -0.235 1.00 0.16 C ATOM 808 CD2 PHE A 142 1.165 6.005 1.482 1.00 0.21 C ATOM 809 CE1 PHE A 142 2.005 5.658 -1.123 1.00 0.19 C ATOM 810 CE2 PHE A 142 1.132 7.066 0.597 1.00 0.25 C ATOM 811 CZ PHE A 142 1.552 6.892 -0.706 1.00 0.22 C ATOM 0 H PHE A 142 -1.153 3.370 2.554 1.00 0.10 H new ATOM 0 HA PHE A 142 0.810 2.032 0.811 1.00 0.10 H new ATOM 0 HB2 PHE A 142 1.526 3.970 3.047 1.00 0.12 H new ATOM 0 HB3 PHE A 142 2.642 3.132 1.987 1.00 0.12 H new ATOM 0 HD1 PHE A 142 2.393 3.635 -0.568 1.00 0.16 H new ATOM 0 HD2 PHE A 142 0.834 6.148 2.500 1.00 0.21 H new ATOM 0 HE1 PHE A 142 2.334 5.519 -2.142 1.00 0.19 H new ATOM 0 HE2 PHE A 142 0.777 8.032 0.925 1.00 0.25 H new ATOM 0 HZ PHE A 142 1.526 7.721 -1.398 1.00 0.22 H new ATOM 821 N VAL A 143 1.241 0.342 2.627 1.00 0.08 N ATOM 822 CA VAL A 143 1.420 -0.665 3.668 1.00 0.08 C ATOM 823 C VAL A 143 2.889 -0.825 4.017 1.00 0.08 C ATOM 824 O VAL A 143 3.739 -0.948 3.134 1.00 0.09 O ATOM 825 CB VAL A 143 0.888 -2.055 3.252 1.00 0.08 C ATOM 826 CG1 VAL A 143 0.965 -3.047 4.413 1.00 0.07 C ATOM 827 CG2 VAL A 143 -0.529 -1.959 2.730 1.00 0.10 C ATOM 0 H VAL A 143 1.629 0.088 1.719 1.00 0.08 H new ATOM 0 HA VAL A 143 0.850 -0.307 4.525 1.00 0.08 H new ATOM 0 HB VAL A 143 1.525 -2.424 2.448 1.00 0.08 H new ATOM 0 HG11 VAL A 143 0.584 -4.016 4.090 1.00 0.07 H new ATOM 0 HG12 VAL A 143 2.002 -3.153 4.733 1.00 0.07 H new ATOM 0 HG13 VAL A 143 0.364 -2.680 5.245 1.00 0.07 H new ATOM 0 HG21 VAL A 143 -0.879 -2.951 2.444 1.00 0.10 H new ATOM 0 HG22 VAL A 143 -1.177 -1.556 3.508 1.00 0.10 H new ATOM 0 HG23 VAL A 143 -0.553 -1.301 1.861 1.00 0.10 H new ATOM 837 N HIS A 144 3.184 -0.793 5.301 1.00 0.09 N ATOM 838 CA HIS A 144 4.480 -1.218 5.788 1.00 0.10 C ATOM 839 C HIS A 144 4.362 -2.622 6.345 1.00 0.10 C ATOM 840 O HIS A 144 3.802 -2.818 7.425 1.00 0.11 O ATOM 841 CB HIS A 144 4.977 -0.277 6.881 1.00 0.12 C ATOM 842 CG HIS A 144 6.044 0.656 6.424 1.00 0.14 C ATOM 843 ND1 HIS A 144 6.994 1.187 7.268 1.00 0.18 N ATOM 844 CD2 HIS A 144 6.319 1.140 5.197 1.00 0.17 C ATOM 845 CE1 HIS A 144 7.812 1.958 6.579 1.00 0.21 C ATOM 846 NE2 HIS A 144 7.421 1.953 5.323 1.00 0.21 N ATOM 0 H HIS A 144 2.542 -0.476 6.027 1.00 0.09 H new ATOM 0 HA HIS A 144 5.193 -1.200 4.964 1.00 0.10 H new ATOM 0 HB2 HIS A 144 4.136 0.304 7.259 1.00 0.12 H new ATOM 0 HB3 HIS A 144 5.356 -0.869 7.714 1.00 0.12 H new ATOM 0 HD1 HIS A 144 7.055 1.011 8.271 1.00 0.18 H new ATOM 0 HD2 HIS A 144 5.777 0.929 4.287 1.00 0.17 H new ATOM 0 HE1 HIS A 144 8.657 2.500 6.977 1.00 0.21 H new ATOM 855 N PHE A 145 4.875 -3.593 5.616 1.00 0.10 N ATOM 856 CA PHE A 145 4.825 -4.969 6.066 1.00 0.10 C ATOM 857 C PHE A 145 6.036 -5.316 6.897 1.00 0.13 C ATOM 858 O PHE A 145 7.161 -4.925 6.582 1.00 0.17 O ATOM 859 CB PHE A 145 4.706 -5.938 4.892 1.00 0.10 C ATOM 860 CG PHE A 145 3.291 -6.222 4.490 1.00 0.09 C ATOM 861 CD1 PHE A 145 2.482 -7.009 5.291 1.00 0.10 C ATOM 862 CD2 PHE A 145 2.773 -5.712 3.316 1.00 0.09 C ATOM 863 CE1 PHE A 145 1.179 -7.282 4.926 1.00 0.11 C ATOM 864 CE2 PHE A 145 1.472 -5.982 2.945 1.00 0.10 C ATOM 865 CZ PHE A 145 0.674 -6.767 3.751 1.00 0.10 C ATOM 0 H PHE A 145 5.329 -3.455 4.713 1.00 0.10 H new ATOM 0 HA PHE A 145 3.934 -5.069 6.687 1.00 0.10 H new ATOM 0 HB2 PHE A 145 5.242 -5.527 4.037 1.00 0.10 H new ATOM 0 HB3 PHE A 145 5.196 -6.876 5.155 1.00 0.10 H new ATOM 0 HD1 PHE A 145 2.875 -7.414 6.212 1.00 0.10 H new ATOM 0 HD2 PHE A 145 3.393 -5.095 2.682 1.00 0.09 H new ATOM 0 HE1 PHE A 145 0.557 -7.897 5.559 1.00 0.11 H new ATOM 0 HE2 PHE A 145 1.078 -5.579 2.024 1.00 0.10 H new ATOM 0 HZ PHE A 145 -0.345 -6.978 3.462 1.00 0.10 H new ATOM 875 N GLU A 146 5.767 -6.029 7.976 1.00 0.13 N ATOM 876 CA GLU A 146 6.799 -6.528 8.886 1.00 0.17 C ATOM 877 C GLU A 146 7.919 -7.193 8.108 1.00 0.19 C ATOM 878 O GLU A 146 9.103 -6.924 8.317 1.00 0.22 O ATOM 879 CB GLU A 146 6.182 -7.544 9.842 1.00 0.22 C ATOM 880 CG GLU A 146 7.164 -8.137 10.832 1.00 0.30 C ATOM 881 CD GLU A 146 6.533 -9.223 11.664 1.00 0.37 C ATOM 882 OE1 GLU A 146 6.244 -10.305 11.116 1.00 0.57 O ATOM 883 OE2 GLU A 146 6.344 -9.008 12.875 1.00 0.38 O ATOM 0 H GLU A 146 4.819 -6.284 8.253 1.00 0.13 H new ATOM 0 HA GLU A 146 7.208 -5.687 9.446 1.00 0.17 H new ATOM 0 HB2 GLU A 146 5.373 -7.064 10.392 1.00 0.22 H new ATOM 0 HB3 GLU A 146 5.737 -8.351 9.260 1.00 0.22 H new ATOM 0 HG2 GLU A 146 8.021 -8.543 10.295 1.00 0.30 H new ATOM 0 HG3 GLU A 146 7.540 -7.350 11.486 1.00 0.30 H new ATOM 890 N THR A 147 7.514 -8.061 7.210 1.00 0.22 N ATOM 891 CA THR A 147 8.436 -8.803 6.377 1.00 0.26 C ATOM 892 C THR A 147 8.355 -8.349 4.925 1.00 0.23 C ATOM 893 O THR A 147 7.281 -8.005 4.424 1.00 0.21 O ATOM 894 CB THR A 147 8.154 -10.312 6.461 1.00 0.33 C ATOM 895 OG1 THR A 147 6.740 -10.549 6.422 1.00 0.40 O ATOM 896 CG2 THR A 147 8.735 -10.907 7.728 1.00 0.35 C ATOM 0 H THR A 147 6.532 -8.274 7.035 1.00 0.22 H new ATOM 0 HA THR A 147 9.442 -8.606 6.749 1.00 0.26 H new ATOM 0 HB THR A 147 8.629 -10.792 5.606 1.00 0.33 H new ATOM 0 HG1 THR A 147 6.568 -11.512 6.474 1.00 0.40 H new ATOM 0 HG21 THR A 147 8.520 -11.975 7.760 1.00 0.35 H new ATOM 0 HG22 THR A 147 9.814 -10.753 7.741 1.00 0.35 H new ATOM 0 HG23 THR A 147 8.289 -10.421 8.596 1.00 0.35 H new ATOM 904 N GLN A 148 9.499 -8.351 4.259 1.00 0.24 N ATOM 905 CA GLN A 148 9.589 -7.942 2.867 1.00 0.23 C ATOM 906 C GLN A 148 8.745 -8.853 1.972 1.00 0.21 C ATOM 907 O GLN A 148 8.112 -8.384 1.022 1.00 0.21 O ATOM 908 CB GLN A 148 11.059 -7.956 2.423 1.00 0.28 C ATOM 909 CG GLN A 148 11.301 -7.394 1.030 1.00 0.31 C ATOM 910 CD GLN A 148 10.813 -5.967 0.883 1.00 0.34 C ATOM 911 OE1 GLN A 148 11.544 -5.009 1.121 1.00 0.47 O ATOM 912 NE2 GLN A 148 9.559 -5.823 0.506 1.00 0.38 N ATOM 0 H GLN A 148 10.389 -8.636 4.667 1.00 0.24 H new ATOM 0 HA GLN A 148 9.196 -6.930 2.771 1.00 0.23 H new ATOM 0 HB2 GLN A 148 11.648 -7.383 3.140 1.00 0.28 H new ATOM 0 HB3 GLN A 148 11.426 -8.982 2.456 1.00 0.28 H new ATOM 0 HG2 GLN A 148 12.367 -7.434 0.807 1.00 0.31 H new ATOM 0 HG3 GLN A 148 10.798 -8.023 0.296 1.00 0.31 H new ATOM 0 HE21 GLN A 148 8.985 -6.645 0.318 1.00 0.38 H new ATOM 0 HE22 GLN A 148 9.162 -4.889 0.402 1.00 0.38 H new ATOM 921 N GLU A 149 8.727 -10.148 2.286 1.00 0.22 N ATOM 922 CA GLU A 149 7.991 -11.118 1.480 1.00 0.22 C ATOM 923 C GLU A 149 6.477 -10.938 1.621 1.00 0.18 C ATOM 924 O GLU A 149 5.734 -11.149 0.663 1.00 0.17 O ATOM 925 CB GLU A 149 8.401 -12.554 1.819 1.00 0.28 C ATOM 926 CG GLU A 149 7.869 -13.055 3.139 1.00 0.35 C ATOM 927 CD GLU A 149 8.069 -14.545 3.312 1.00 0.47 C ATOM 928 OE1 GLU A 149 7.190 -15.322 2.884 1.00 0.74 O ATOM 929 OE2 GLU A 149 9.099 -14.947 3.891 1.00 0.62 O ATOM 0 H GLU A 149 9.212 -10.547 3.090 1.00 0.22 H new ATOM 0 HA GLU A 149 8.252 -10.930 0.439 1.00 0.22 H new ATOM 0 HB2 GLU A 149 8.054 -13.216 1.026 1.00 0.28 H new ATOM 0 HB3 GLU A 149 9.489 -12.616 1.832 1.00 0.28 H new ATOM 0 HG2 GLU A 149 8.367 -12.527 3.952 1.00 0.35 H new ATOM 0 HG3 GLU A 149 6.807 -12.823 3.211 1.00 0.35 H new ATOM 936 N ALA A 150 6.020 -10.547 2.812 1.00 0.17 N ATOM 937 CA ALA A 150 4.591 -10.336 3.051 1.00 0.15 C ATOM 938 C ALA A 150 4.057 -9.238 2.141 1.00 0.13 C ATOM 939 O ALA A 150 2.925 -9.304 1.659 1.00 0.13 O ATOM 940 CB ALA A 150 4.340 -9.985 4.506 1.00 0.18 C ATOM 0 H ALA A 150 6.615 -10.371 3.622 1.00 0.17 H new ATOM 0 HA ALA A 150 4.064 -11.263 2.824 1.00 0.15 H new ATOM 0 HB1 ALA A 150 3.273 -9.832 4.664 1.00 0.18 H new ATOM 0 HB2 ALA A 150 4.688 -10.799 5.142 1.00 0.18 H new ATOM 0 HB3 ALA A 150 4.879 -9.072 4.758 1.00 0.18 H new ATOM 946 N ALA A 151 4.895 -8.240 1.899 1.00 0.13 N ATOM 947 CA ALA A 151 4.557 -7.155 0.992 1.00 0.13 C ATOM 948 C ALA A 151 4.356 -7.683 -0.417 1.00 0.12 C ATOM 949 O ALA A 151 3.395 -7.322 -1.095 1.00 0.13 O ATOM 950 CB ALA A 151 5.650 -6.109 1.013 1.00 0.16 C ATOM 0 H ALA A 151 5.820 -8.160 2.322 1.00 0.13 H new ATOM 0 HA ALA A 151 3.624 -6.698 1.322 1.00 0.13 H new ATOM 0 HB1 ALA A 151 5.391 -5.299 0.332 1.00 0.16 H new ATOM 0 HB2 ALA A 151 5.756 -5.714 2.023 1.00 0.16 H new ATOM 0 HB3 ALA A 151 6.591 -6.560 0.699 1.00 0.16 H new ATOM 956 N GLU A 152 5.263 -8.551 -0.844 1.00 0.13 N ATOM 957 CA GLU A 152 5.169 -9.177 -2.153 1.00 0.14 C ATOM 958 C GLU A 152 3.870 -9.965 -2.277 1.00 0.12 C ATOM 959 O GLU A 152 3.215 -9.933 -3.319 1.00 0.15 O ATOM 960 CB GLU A 152 6.363 -10.098 -2.388 1.00 0.18 C ATOM 961 CG GLU A 152 7.701 -9.383 -2.353 1.00 0.26 C ATOM 962 CD GLU A 152 8.854 -10.309 -2.669 1.00 0.75 C ATOM 963 OE1 GLU A 152 8.826 -10.948 -3.738 1.00 0.95 O ATOM 964 OE2 GLU A 152 9.799 -10.395 -1.857 1.00 1.42 O ATOM 0 H GLU A 152 6.076 -8.838 -0.299 1.00 0.13 H new ATOM 0 HA GLU A 152 5.175 -8.392 -2.909 1.00 0.14 H new ATOM 0 HB2 GLU A 152 6.360 -10.882 -1.631 1.00 0.18 H new ATOM 0 HB3 GLU A 152 6.248 -10.588 -3.355 1.00 0.18 H new ATOM 0 HG2 GLU A 152 7.691 -8.562 -3.069 1.00 0.26 H new ATOM 0 HG3 GLU A 152 7.850 -8.944 -1.367 1.00 0.26 H new ATOM 971 N ARG A 153 3.498 -10.659 -1.205 1.00 0.10 N ATOM 972 CA ARG A 153 2.256 -11.419 -1.177 1.00 0.12 C ATOM 973 C ARG A 153 1.051 -10.496 -1.343 1.00 0.11 C ATOM 974 O ARG A 153 0.084 -10.837 -2.025 1.00 0.16 O ATOM 975 CB ARG A 153 2.114 -12.193 0.130 1.00 0.16 C ATOM 976 CG ARG A 153 3.246 -13.169 0.412 1.00 0.21 C ATOM 977 CD ARG A 153 3.001 -13.919 1.711 1.00 0.26 C ATOM 978 NE ARG A 153 4.118 -14.786 2.088 1.00 0.38 N ATOM 979 CZ ARG A 153 3.999 -16.094 2.320 1.00 0.80 C ATOM 980 NH1 ARG A 153 2.852 -16.715 2.076 1.00 1.48 N ATOM 981 NH2 ARG A 153 5.038 -16.784 2.762 1.00 0.84 N ATOM 0 H ARG A 153 4.042 -10.710 -0.343 1.00 0.10 H new ATOM 0 HA ARG A 153 2.290 -12.124 -2.007 1.00 0.12 H new ATOM 0 HB2 ARG A 153 2.051 -11.482 0.954 1.00 0.16 H new ATOM 0 HB3 ARG A 153 1.173 -12.743 0.111 1.00 0.16 H new ATOM 0 HG2 ARG A 153 3.335 -13.878 -0.411 1.00 0.21 H new ATOM 0 HG3 ARG A 153 4.191 -12.629 0.471 1.00 0.21 H new ATOM 0 HD2 ARG A 153 2.819 -13.201 2.511 1.00 0.26 H new ATOM 0 HD3 ARG A 153 2.098 -14.521 1.612 1.00 0.26 H new ATOM 0 HE ARG A 153 5.043 -14.365 2.179 1.00 0.38 H new ATOM 0 HH11 ARG A 153 2.057 -16.192 1.709 1.00 1.48 H new ATOM 0 HH12 ARG A 153 2.766 -17.715 2.255 1.00 1.48 H new ATOM 0 HH21 ARG A 153 5.929 -16.316 2.925 1.00 0.84 H new ATOM 0 HH22 ARG A 153 4.948 -17.784 2.940 1.00 0.84 H new ATOM 995 N ALA A 154 1.105 -9.334 -0.708 1.00 0.09 N ATOM 996 CA ALA A 154 0.028 -8.361 -0.822 1.00 0.09 C ATOM 997 C ALA A 154 -0.044 -7.812 -2.240 1.00 0.09 C ATOM 998 O ALA A 154 -1.131 -7.601 -2.775 1.00 0.10 O ATOM 999 CB ALA A 154 0.207 -7.233 0.182 1.00 0.10 C ATOM 0 H ALA A 154 1.879 -9.043 -0.111 1.00 0.09 H new ATOM 0 HA ALA A 154 -0.912 -8.865 -0.598 1.00 0.09 H new ATOM 0 HB1 ALA A 154 -0.610 -6.519 0.077 1.00 0.10 H new ATOM 0 HB2 ALA A 154 0.204 -7.642 1.193 1.00 0.10 H new ATOM 0 HB3 ALA A 154 1.155 -6.729 -0.003 1.00 0.10 H new ATOM 1005 N ILE A 155 1.119 -7.597 -2.848 1.00 0.09 N ATOM 1006 CA ILE A 155 1.189 -7.104 -4.220 1.00 0.10 C ATOM 1007 C ILE A 155 0.473 -8.048 -5.182 1.00 0.11 C ATOM 1008 O ILE A 155 -0.425 -7.631 -5.908 1.00 0.14 O ATOM 1009 CB ILE A 155 2.653 -6.916 -4.681 1.00 0.11 C ATOM 1010 CG1 ILE A 155 3.335 -5.838 -3.839 1.00 0.12 C ATOM 1011 CG2 ILE A 155 2.711 -6.556 -6.160 1.00 0.14 C ATOM 1012 CD1 ILE A 155 4.799 -5.648 -4.164 1.00 0.15 C ATOM 0 H ILE A 155 2.027 -7.757 -2.412 1.00 0.09 H new ATOM 0 HA ILE A 155 0.690 -6.135 -4.233 1.00 0.10 H new ATOM 0 HB ILE A 155 3.184 -7.858 -4.541 1.00 0.11 H new ATOM 0 HG12 ILE A 155 2.814 -4.892 -3.985 1.00 0.12 H new ATOM 0 HG13 ILE A 155 3.237 -6.097 -2.785 1.00 0.12 H new ATOM 0 HG21 ILE A 155 3.750 -6.428 -6.463 1.00 0.14 H new ATOM 0 HG22 ILE A 155 2.257 -7.355 -6.747 1.00 0.14 H new ATOM 0 HG23 ILE A 155 2.167 -5.627 -6.330 1.00 0.14 H new ATOM 0 HD11 ILE A 155 5.215 -4.867 -3.527 1.00 0.15 H new ATOM 0 HD12 ILE A 155 5.334 -6.582 -3.991 1.00 0.15 H new ATOM 0 HD13 ILE A 155 4.905 -5.358 -5.209 1.00 0.15 H new ATOM 1024 N GLU A 156 0.845 -9.325 -5.163 1.00 0.11 N ATOM 1025 CA GLU A 156 0.243 -10.296 -6.068 1.00 0.13 C ATOM 1026 C GLU A 156 -1.252 -10.426 -5.850 1.00 0.12 C ATOM 1027 O GLU A 156 -2.034 -10.467 -6.802 1.00 0.15 O ATOM 1028 CB GLU A 156 0.878 -11.684 -5.930 1.00 0.17 C ATOM 1029 CG GLU A 156 1.323 -12.052 -4.526 1.00 0.21 C ATOM 1030 CD GLU A 156 1.533 -13.541 -4.373 1.00 0.62 C ATOM 1031 OE1 GLU A 156 2.597 -14.044 -4.797 1.00 0.63 O ATOM 1032 OE2 GLU A 156 0.649 -14.213 -3.809 1.00 1.08 O ATOM 0 H GLU A 156 1.554 -9.708 -4.537 1.00 0.11 H new ATOM 0 HA GLU A 156 0.429 -9.914 -7.072 1.00 0.13 H new ATOM 0 HB2 GLU A 156 0.162 -12.430 -6.275 1.00 0.17 H new ATOM 0 HB3 GLU A 156 1.741 -11.739 -6.594 1.00 0.17 H new ATOM 0 HG2 GLU A 156 2.250 -11.529 -4.290 1.00 0.21 H new ATOM 0 HG3 GLU A 156 0.575 -11.715 -3.808 1.00 0.21 H new ATOM 1039 N LYS A 157 -1.637 -10.493 -4.594 1.00 0.09 N ATOM 1040 CA LYS A 157 -2.987 -10.850 -4.234 1.00 0.10 C ATOM 1041 C LYS A 157 -3.952 -9.669 -4.311 1.00 0.08 C ATOM 1042 O LYS A 157 -5.093 -9.825 -4.737 1.00 0.10 O ATOM 1043 CB LYS A 157 -2.996 -11.443 -2.828 1.00 0.12 C ATOM 1044 CG LYS A 157 -3.829 -12.710 -2.723 1.00 0.17 C ATOM 1045 CD LYS A 157 -5.243 -12.515 -3.266 1.00 0.21 C ATOM 1046 CE LYS A 157 -6.203 -11.953 -2.222 1.00 0.29 C ATOM 1047 NZ LYS A 157 -7.582 -11.806 -2.763 1.00 1.16 N ATOM 0 H LYS A 157 -1.026 -10.302 -3.800 1.00 0.09 H new ATOM 0 HA LYS A 157 -3.335 -11.587 -4.958 1.00 0.10 H new ATOM 0 HB2 LYS A 157 -1.972 -11.662 -2.525 1.00 0.12 H new ATOM 0 HB3 LYS A 157 -3.383 -10.701 -2.129 1.00 0.12 H new ATOM 0 HG2 LYS A 157 -3.338 -13.513 -3.273 1.00 0.17 H new ATOM 0 HG3 LYS A 157 -3.882 -13.023 -1.680 1.00 0.17 H new ATOM 0 HD2 LYS A 157 -5.209 -11.841 -4.122 1.00 0.21 H new ATOM 0 HD3 LYS A 157 -5.624 -13.470 -3.627 1.00 0.21 H new ATOM 0 HE2 LYS A 157 -6.221 -12.611 -1.353 1.00 0.29 H new ATOM 0 HE3 LYS A 157 -5.841 -10.983 -1.880 1.00 0.29 H new ATOM 0 HZ1 LYS A 157 -8.205 -11.422 -2.025 1.00 1.16 H new ATOM 0 HZ2 LYS A 157 -7.569 -11.158 -3.577 1.00 1.16 H new ATOM 0 HZ3 LYS A 157 -7.937 -12.735 -3.066 1.00 1.16 H new ATOM 1061 N MET A 158 -3.501 -8.498 -3.908 1.00 0.07 N ATOM 1062 CA MET A 158 -4.392 -7.347 -3.810 1.00 0.08 C ATOM 1063 C MET A 158 -4.423 -6.534 -5.090 1.00 0.09 C ATOM 1064 O MET A 158 -5.400 -5.833 -5.355 1.00 0.13 O ATOM 1065 CB MET A 158 -4.010 -6.451 -2.634 1.00 0.09 C ATOM 1066 CG MET A 158 -4.232 -7.108 -1.286 1.00 0.10 C ATOM 1067 SD MET A 158 -5.943 -7.625 -1.047 1.00 0.35 S ATOM 1068 CE MET A 158 -6.793 -6.057 -1.224 1.00 0.18 C ATOM 0 H MET A 158 -2.533 -8.313 -3.644 1.00 0.07 H new ATOM 0 HA MET A 158 -5.393 -7.745 -3.642 1.00 0.08 H new ATOM 0 HB2 MET A 158 -2.961 -6.170 -2.726 1.00 0.09 H new ATOM 0 HB3 MET A 158 -4.592 -5.531 -2.683 1.00 0.09 H new ATOM 0 HG2 MET A 158 -3.577 -7.975 -1.195 1.00 0.10 H new ATOM 0 HG3 MET A 158 -3.952 -6.412 -0.495 1.00 0.10 H new ATOM 0 HE1 MET A 158 -7.868 -6.214 -1.137 1.00 0.18 H new ATOM 0 HE2 MET A 158 -6.462 -5.373 -0.442 1.00 0.18 H new ATOM 0 HE3 MET A 158 -6.566 -5.628 -2.200 1.00 0.18 H new ATOM 1078 N ASN A 159 -3.372 -6.618 -5.885 1.00 0.09 N ATOM 1079 CA ASN A 159 -3.337 -5.873 -7.132 1.00 0.10 C ATOM 1080 C ASN A 159 -4.378 -6.438 -8.092 1.00 0.13 C ATOM 1081 O ASN A 159 -4.364 -7.629 -8.407 1.00 0.16 O ATOM 1082 CB ASN A 159 -1.944 -5.940 -7.765 1.00 0.14 C ATOM 1083 CG ASN A 159 -1.800 -5.021 -8.968 1.00 0.16 C ATOM 1084 OD1 ASN A 159 -2.515 -4.026 -9.087 1.00 0.44 O ATOM 1085 ND2 ASN A 159 -0.858 -5.325 -9.852 1.00 0.38 N ATOM 0 H ASN A 159 -2.545 -7.184 -5.696 1.00 0.09 H new ATOM 0 HA ASN A 159 -3.565 -4.828 -6.924 1.00 0.10 H new ATOM 0 HB2 ASN A 159 -1.197 -5.673 -7.018 1.00 0.14 H new ATOM 0 HB3 ASN A 159 -1.737 -6.966 -8.070 1.00 0.14 H new ATOM 0 HD21 ASN A 159 -0.707 -4.725 -10.663 1.00 0.38 H new ATOM 0 HD22 ASN A 159 -0.285 -6.158 -9.720 1.00 0.38 H new ATOM 1092 N GLY A 160 -5.282 -5.585 -8.546 1.00 0.14 N ATOM 1093 CA GLY A 160 -6.310 -6.018 -9.470 1.00 0.19 C ATOM 1094 C GLY A 160 -7.575 -6.485 -8.767 1.00 0.22 C ATOM 1095 O GLY A 160 -8.477 -7.033 -9.404 1.00 0.29 O ATOM 0 H GLY A 160 -5.323 -4.598 -8.291 1.00 0.14 H new ATOM 0 HA2 GLY A 160 -6.556 -5.197 -10.144 1.00 0.19 H new ATOM 0 HA3 GLY A 160 -5.921 -6.829 -10.085 1.00 0.19 H new ATOM 1099 N MET A 161 -7.645 -6.270 -7.459 1.00 0.22 N ATOM 1100 CA MET A 161 -8.819 -6.644 -6.679 1.00 0.27 C ATOM 1101 C MET A 161 -9.806 -5.499 -6.581 1.00 0.24 C ATOM 1102 O MET A 161 -9.457 -4.350 -6.824 1.00 0.23 O ATOM 1103 CB MET A 161 -8.408 -7.058 -5.276 1.00 0.32 C ATOM 1104 CG MET A 161 -7.818 -8.455 -5.163 1.00 0.68 C ATOM 1105 SD MET A 161 -8.950 -9.758 -5.690 1.00 1.18 S ATOM 1106 CE MET A 161 -8.356 -10.086 -7.349 1.00 1.04 C ATOM 0 H MET A 161 -6.900 -5.837 -6.914 1.00 0.22 H new ATOM 0 HA MET A 161 -9.298 -7.479 -7.191 1.00 0.27 H new ATOM 0 HB2 MET A 161 -7.678 -6.341 -4.901 1.00 0.32 H new ATOM 0 HB3 MET A 161 -9.280 -6.995 -4.625 1.00 0.32 H new ATOM 0 HG2 MET A 161 -6.911 -8.508 -5.765 1.00 0.68 H new ATOM 0 HG3 MET A 161 -7.526 -8.635 -4.129 1.00 0.68 H new ATOM 0 HE1 MET A 161 -9.202 -10.300 -8.003 1.00 1.04 H new ATOM 0 HE2 MET A 161 -7.820 -9.214 -7.723 1.00 1.04 H new ATOM 0 HE3 MET A 161 -7.685 -10.945 -7.332 1.00 1.04 H new ATOM 1116 N LEU A 162 -11.032 -5.819 -6.192 1.00 0.26 N ATOM 1117 CA LEU A 162 -12.070 -4.820 -6.016 1.00 0.26 C ATOM 1118 C LEU A 162 -12.302 -4.588 -4.545 1.00 0.28 C ATOM 1119 O LEU A 162 -12.865 -5.441 -3.858 1.00 0.44 O ATOM 1120 CB LEU A 162 -13.404 -5.245 -6.638 1.00 0.31 C ATOM 1121 CG LEU A 162 -13.554 -5.056 -8.146 1.00 0.34 C ATOM 1122 CD1 LEU A 162 -14.976 -5.377 -8.561 1.00 0.42 C ATOM 1123 CD2 LEU A 162 -13.212 -3.634 -8.545 1.00 0.34 C ATOM 0 H LEU A 162 -11.332 -6.773 -5.991 1.00 0.26 H new ATOM 0 HA LEU A 162 -11.725 -3.915 -6.516 1.00 0.26 H new ATOM 0 HB2 LEU A 162 -13.564 -6.299 -6.411 1.00 0.31 H new ATOM 0 HB3 LEU A 162 -14.201 -4.688 -6.145 1.00 0.31 H new ATOM 0 HG LEU A 162 -12.865 -5.732 -8.652 1.00 0.34 H new ATOM 0 HD11 LEU A 162 -15.080 -5.241 -9.637 1.00 0.42 H new ATOM 0 HD12 LEU A 162 -15.206 -6.410 -8.302 1.00 0.42 H new ATOM 0 HD13 LEU A 162 -15.665 -4.711 -8.043 1.00 0.42 H new ATOM 0 HD21 LEU A 162 -13.325 -3.521 -9.623 1.00 0.34 H new ATOM 0 HD22 LEU A 162 -13.882 -2.942 -8.035 1.00 0.34 H new ATOM 0 HD23 LEU A 162 -12.182 -3.415 -8.264 1.00 0.34 H new ATOM 1135 N LEU A 163 -11.863 -3.460 -4.050 1.00 0.25 N ATOM 1136 CA LEU A 163 -12.183 -3.102 -2.695 1.00 0.33 C ATOM 1137 C LEU A 163 -13.418 -2.220 -2.689 1.00 0.45 C ATOM 1138 O LEU A 163 -13.377 -1.075 -3.143 1.00 1.02 O ATOM 1139 CB LEU A 163 -11.005 -2.420 -1.996 1.00 0.29 C ATOM 1140 CG LEU A 163 -9.965 -3.381 -1.415 1.00 0.31 C ATOM 1141 CD1 LEU A 163 -8.812 -2.613 -0.792 1.00 0.31 C ATOM 1142 CD2 LEU A 163 -10.614 -4.296 -0.386 1.00 0.34 C ATOM 0 H LEU A 163 -11.292 -2.783 -4.556 1.00 0.25 H new ATOM 0 HA LEU A 163 -12.392 -4.011 -2.132 1.00 0.33 H new ATOM 0 HB2 LEU A 163 -10.511 -1.758 -2.707 1.00 0.29 H new ATOM 0 HB3 LEU A 163 -11.390 -1.793 -1.192 1.00 0.29 H new ATOM 0 HG LEU A 163 -9.567 -3.992 -2.225 1.00 0.31 H new ATOM 0 HD11 LEU A 163 -8.085 -3.315 -0.385 1.00 0.31 H new ATOM 0 HD12 LEU A 163 -8.334 -1.995 -1.552 1.00 0.31 H new ATOM 0 HD13 LEU A 163 -9.189 -1.977 0.009 1.00 0.31 H new ATOM 0 HD21 LEU A 163 -9.865 -4.975 0.021 1.00 0.34 H new ATOM 0 HD22 LEU A 163 -11.035 -3.696 0.420 1.00 0.34 H new ATOM 0 HD23 LEU A 163 -11.407 -4.873 -0.861 1.00 0.34 H new ATOM 1154 N ASN A 164 -14.521 -2.795 -2.216 1.00 0.41 N ATOM 1155 CA ASN A 164 -15.827 -2.135 -2.185 1.00 0.42 C ATOM 1156 C ASN A 164 -16.436 -2.005 -3.572 1.00 0.45 C ATOM 1157 O ASN A 164 -17.490 -2.574 -3.860 1.00 0.72 O ATOM 1158 CB ASN A 164 -15.753 -0.772 -1.484 1.00 0.49 C ATOM 1159 CG ASN A 164 -15.634 -0.911 0.019 1.00 1.06 C ATOM 1160 OD1 ASN A 164 -15.988 -1.943 0.591 1.00 1.71 O ATOM 1161 ND2 ASN A 164 -15.182 0.137 0.680 1.00 1.07 N ATOM 0 H ASN A 164 -14.535 -3.743 -1.839 1.00 0.41 H new ATOM 0 HA ASN A 164 -16.488 -2.775 -1.601 1.00 0.42 H new ATOM 0 HB2 ASN A 164 -14.897 -0.215 -1.865 1.00 0.49 H new ATOM 0 HB3 ASN A 164 -16.644 -0.192 -1.725 1.00 0.49 H new ATOM 0 HD21 ASN A 164 -15.117 0.109 1.698 1.00 1.07 H new ATOM 0 HD22 ASN A 164 -14.897 0.975 0.174 1.00 1.07 H new ATOM 1168 N ASP A 165 -15.761 -1.277 -4.424 1.00 0.42 N ATOM 1169 CA ASP A 165 -16.232 -1.025 -5.779 1.00 0.44 C ATOM 1170 C ASP A 165 -15.109 -0.501 -6.672 1.00 0.43 C ATOM 1171 O ASP A 165 -15.351 -0.038 -7.784 1.00 0.65 O ATOM 1172 CB ASP A 165 -17.386 -0.014 -5.754 1.00 0.55 C ATOM 1173 CG ASP A 165 -18.106 0.108 -7.086 1.00 0.71 C ATOM 1174 OD1 ASP A 165 -18.807 -0.852 -7.477 1.00 0.82 O ATOM 1175 OD2 ASP A 165 -17.979 1.163 -7.744 1.00 0.85 O ATOM 0 H ASP A 165 -14.867 -0.837 -4.206 1.00 0.42 H new ATOM 0 HA ASP A 165 -16.582 -1.971 -6.192 1.00 0.44 H new ATOM 0 HB2 ASP A 165 -18.102 -0.309 -4.987 1.00 0.55 H new ATOM 0 HB3 ASP A 165 -16.998 0.963 -5.468 1.00 0.55 H new ATOM 1180 N ARG A 166 -13.877 -0.597 -6.208 1.00 0.32 N ATOM 1181 CA ARG A 166 -12.765 -0.013 -6.933 1.00 0.27 C ATOM 1182 C ARG A 166 -11.610 -0.988 -7.006 1.00 0.24 C ATOM 1183 O ARG A 166 -11.210 -1.571 -5.996 1.00 0.24 O ATOM 1184 CB ARG A 166 -12.314 1.291 -6.277 1.00 0.24 C ATOM 1185 CG ARG A 166 -13.402 2.348 -6.217 1.00 0.27 C ATOM 1186 CD ARG A 166 -12.854 3.679 -5.736 1.00 0.27 C ATOM 1187 NE ARG A 166 -13.910 4.676 -5.563 1.00 0.42 N ATOM 1188 CZ ARG A 166 -13.742 5.850 -4.950 1.00 0.58 C ATOM 1189 NH1 ARG A 166 -12.573 6.161 -4.402 1.00 0.96 N ATOM 1190 NH2 ARG A 166 -14.750 6.706 -4.873 1.00 0.70 N ATOM 0 H ARG A 166 -13.623 -1.069 -5.340 1.00 0.32 H new ATOM 0 HA ARG A 166 -13.100 0.209 -7.946 1.00 0.27 H new ATOM 0 HB2 ARG A 166 -11.969 1.079 -5.265 1.00 0.24 H new ATOM 0 HB3 ARG A 166 -11.462 1.689 -6.828 1.00 0.24 H new ATOM 0 HG2 ARG A 166 -13.847 2.471 -7.205 1.00 0.27 H new ATOM 0 HG3 ARG A 166 -14.197 2.017 -5.549 1.00 0.27 H new ATOM 0 HD2 ARG A 166 -12.332 3.536 -4.790 1.00 0.27 H new ATOM 0 HD3 ARG A 166 -12.120 4.049 -6.452 1.00 0.27 H new ATOM 0 HE ARG A 166 -14.835 4.460 -5.935 1.00 0.42 H new ATOM 0 HH11 ARG A 166 -11.797 5.501 -4.448 1.00 0.96 H new ATOM 0 HH12 ARG A 166 -12.452 7.060 -3.935 1.00 0.96 H new ATOM 0 HH21 ARG A 166 -15.654 6.468 -5.282 1.00 0.70 H new ATOM 0 HH22 ARG A 166 -14.623 7.603 -4.405 1.00 0.70 H new ATOM 1204 N LYS A 167 -11.101 -1.180 -8.209 1.00 0.22 N ATOM 1205 CA LYS A 167 -9.989 -2.080 -8.431 1.00 0.20 C ATOM 1206 C LYS A 167 -8.702 -1.391 -8.022 1.00 0.17 C ATOM 1207 O LYS A 167 -8.338 -0.359 -8.584 1.00 0.22 O ATOM 1208 CB LYS A 167 -9.938 -2.495 -9.901 1.00 0.23 C ATOM 1209 CG LYS A 167 -9.194 -3.802 -10.141 1.00 0.40 C ATOM 1210 CD LYS A 167 -9.350 -4.292 -11.574 1.00 0.47 C ATOM 1211 CE LYS A 167 -10.504 -5.279 -11.717 1.00 0.53 C ATOM 1212 NZ LYS A 167 -10.605 -5.815 -13.099 1.00 1.00 N ATOM 0 H LYS A 167 -11.445 -0.720 -9.052 1.00 0.22 H new ATOM 0 HA LYS A 167 -10.117 -2.979 -7.829 1.00 0.20 H new ATOM 0 HB2 LYS A 167 -10.956 -2.592 -10.278 1.00 0.23 H new ATOM 0 HB3 LYS A 167 -9.459 -1.703 -10.477 1.00 0.23 H new ATOM 0 HG2 LYS A 167 -8.136 -3.663 -9.918 1.00 0.40 H new ATOM 0 HG3 LYS A 167 -9.567 -4.563 -9.455 1.00 0.40 H new ATOM 0 HD2 LYS A 167 -9.518 -3.440 -12.232 1.00 0.47 H new ATOM 0 HD3 LYS A 167 -8.424 -4.767 -11.898 1.00 0.47 H new ATOM 0 HE2 LYS A 167 -10.366 -6.103 -11.017 1.00 0.53 H new ATOM 0 HE3 LYS A 167 -11.439 -4.786 -11.449 1.00 0.53 H new ATOM 0 HZ1 LYS A 167 -11.401 -6.482 -13.155 1.00 1.00 H new ATOM 0 HZ2 LYS A 167 -10.762 -5.031 -13.765 1.00 1.00 H new ATOM 0 HZ3 LYS A 167 -9.723 -6.307 -13.346 1.00 1.00 H new ATOM 1226 N VAL A 168 -8.001 -1.970 -7.068 1.00 0.13 N ATOM 1227 CA VAL A 168 -6.845 -1.311 -6.496 1.00 0.12 C ATOM 1228 C VAL A 168 -5.560 -1.859 -7.075 1.00 0.11 C ATOM 1229 O VAL A 168 -5.462 -3.035 -7.433 1.00 0.13 O ATOM 1230 CB VAL A 168 -6.794 -1.436 -4.955 1.00 0.13 C ATOM 1231 CG1 VAL A 168 -7.876 -0.591 -4.307 1.00 0.17 C ATOM 1232 CG2 VAL A 168 -6.914 -2.890 -4.515 1.00 0.13 C ATOM 0 H VAL A 168 -8.209 -2.888 -6.675 1.00 0.13 H new ATOM 0 HA VAL A 168 -6.944 -0.256 -6.752 1.00 0.12 H new ATOM 0 HB VAL A 168 -5.824 -1.063 -4.625 1.00 0.13 H new ATOM 0 HG11 VAL A 168 -7.819 -0.696 -3.224 1.00 0.17 H new ATOM 0 HG12 VAL A 168 -7.732 0.455 -4.578 1.00 0.17 H new ATOM 0 HG13 VAL A 168 -8.854 -0.925 -4.653 1.00 0.17 H new ATOM 0 HG21 VAL A 168 -6.875 -2.945 -3.427 1.00 0.13 H new ATOM 0 HG22 VAL A 168 -7.862 -3.299 -4.865 1.00 0.13 H new ATOM 0 HG23 VAL A 168 -6.091 -3.467 -4.937 1.00 0.13 H new ATOM 1242 N PHE A 169 -4.589 -0.978 -7.192 1.00 0.11 N ATOM 1243 CA PHE A 169 -3.296 -1.329 -7.725 1.00 0.12 C ATOM 1244 C PHE A 169 -2.282 -1.371 -6.597 1.00 0.10 C ATOM 1245 O PHE A 169 -2.048 -0.365 -5.937 1.00 0.12 O ATOM 1246 CB PHE A 169 -2.882 -0.303 -8.789 1.00 0.18 C ATOM 1247 CG PHE A 169 -1.529 -0.554 -9.387 1.00 0.14 C ATOM 1248 CD1 PHE A 169 -1.384 -1.396 -10.475 1.00 0.25 C ATOM 1249 CD2 PHE A 169 -0.403 0.047 -8.853 1.00 0.18 C ATOM 1250 CE1 PHE A 169 -0.137 -1.634 -11.023 1.00 0.30 C ATOM 1251 CE2 PHE A 169 0.846 -0.188 -9.395 1.00 0.23 C ATOM 1252 CZ PHE A 169 0.979 -1.029 -10.479 1.00 0.26 C ATOM 0 H PHE A 169 -4.677 0.001 -6.919 1.00 0.11 H new ATOM 0 HA PHE A 169 -3.342 -2.313 -8.192 1.00 0.12 H new ATOM 0 HB2 PHE A 169 -3.625 -0.302 -9.586 1.00 0.18 H new ATOM 0 HB3 PHE A 169 -2.892 0.691 -8.343 1.00 0.18 H new ATOM 0 HD1 PHE A 169 -2.254 -1.873 -10.901 1.00 0.25 H new ATOM 0 HD2 PHE A 169 -0.501 0.707 -8.004 1.00 0.18 H new ATOM 0 HE1 PHE A 169 -0.036 -2.291 -11.874 1.00 0.30 H new ATOM 0 HE2 PHE A 169 1.718 0.287 -8.970 1.00 0.23 H new ATOM 0 HZ PHE A 169 1.955 -1.215 -10.903 1.00 0.26 H new ATOM 1262 N VAL A 170 -1.694 -2.532 -6.370 1.00 0.09 N ATOM 1263 CA VAL A 170 -0.675 -2.675 -5.345 1.00 0.10 C ATOM 1264 C VAL A 170 0.647 -3.022 -6.004 1.00 0.11 C ATOM 1265 O VAL A 170 0.736 -3.985 -6.765 1.00 0.13 O ATOM 1266 CB VAL A 170 -1.020 -3.771 -4.305 1.00 0.10 C ATOM 1267 CG1 VAL A 170 0.018 -3.806 -3.192 1.00 0.11 C ATOM 1268 CG2 VAL A 170 -2.408 -3.568 -3.720 1.00 0.09 C ATOM 0 H VAL A 170 -1.904 -3.389 -6.881 1.00 0.09 H new ATOM 0 HA VAL A 170 -0.615 -1.725 -4.813 1.00 0.10 H new ATOM 0 HB VAL A 170 -1.010 -4.728 -4.826 1.00 0.10 H new ATOM 0 HG11 VAL A 170 -0.245 -4.583 -2.474 1.00 0.11 H new ATOM 0 HG12 VAL A 170 0.999 -4.021 -3.616 1.00 0.11 H new ATOM 0 HG13 VAL A 170 0.044 -2.840 -2.688 1.00 0.11 H new ATOM 0 HG21 VAL A 170 -2.616 -4.355 -2.995 1.00 0.09 H new ATOM 0 HG22 VAL A 170 -2.456 -2.597 -3.226 1.00 0.09 H new ATOM 0 HG23 VAL A 170 -3.149 -3.606 -4.519 1.00 0.09 H new ATOM 1278 N GLY A 171 1.663 -2.229 -5.723 1.00 0.12 N ATOM 1279 CA GLY A 171 2.957 -2.459 -6.316 1.00 0.14 C ATOM 1280 C GLY A 171 4.084 -2.098 -5.378 1.00 0.14 C ATOM 1281 O GLY A 171 3.848 -1.759 -4.215 1.00 0.18 O ATOM 0 H GLY A 171 1.614 -1.428 -5.093 1.00 0.12 H new ATOM 0 HA2 GLY A 171 3.044 -3.508 -6.600 1.00 0.14 H new ATOM 0 HA3 GLY A 171 3.045 -1.873 -7.231 1.00 0.14 H new ATOM 1285 N ARG A 172 5.305 -2.171 -5.883 1.00 0.18 N ATOM 1286 CA ARG A 172 6.483 -1.860 -5.090 1.00 0.19 C ATOM 1287 C ARG A 172 6.516 -0.373 -4.755 1.00 0.22 C ATOM 1288 O ARG A 172 6.534 0.477 -5.646 1.00 0.36 O ATOM 1289 CB ARG A 172 7.755 -2.272 -5.840 1.00 0.23 C ATOM 1290 CG ARG A 172 7.865 -3.772 -6.099 1.00 0.32 C ATOM 1291 CD ARG A 172 8.270 -4.545 -4.847 1.00 0.39 C ATOM 1292 NE ARG A 172 8.305 -5.990 -5.076 1.00 1.03 N ATOM 1293 CZ ARG A 172 9.406 -6.738 -4.988 1.00 1.26 C ATOM 1294 NH1 ARG A 172 10.589 -6.176 -4.770 1.00 1.34 N ATOM 1295 NH2 ARG A 172 9.322 -8.053 -5.148 1.00 1.93 N ATOM 0 H ARG A 172 5.506 -2.445 -6.845 1.00 0.18 H new ATOM 0 HA ARG A 172 6.436 -2.423 -4.158 1.00 0.19 H new ATOM 0 HB2 ARG A 172 7.789 -1.746 -6.794 1.00 0.23 H new ATOM 0 HB3 ARG A 172 8.624 -1.948 -5.267 1.00 0.23 H new ATOM 0 HG2 ARG A 172 6.908 -4.147 -6.462 1.00 0.32 H new ATOM 0 HG3 ARG A 172 8.597 -3.950 -6.887 1.00 0.32 H new ATOM 0 HD2 ARG A 172 9.252 -4.208 -4.516 1.00 0.39 H new ATOM 0 HD3 ARG A 172 7.569 -4.323 -4.043 1.00 0.39 H new ATOM 0 HE ARG A 172 7.430 -6.456 -5.319 1.00 1.03 H new ATOM 0 HH11 ARG A 172 10.662 -5.164 -4.668 1.00 1.34 H new ATOM 0 HH12 ARG A 172 11.425 -6.757 -4.704 1.00 1.34 H new ATOM 0 HH21 ARG A 172 8.419 -8.487 -5.337 1.00 1.93 H new ATOM 0 HH22 ARG A 172 10.161 -8.629 -5.082 1.00 1.93 H new ATOM 1309 N PHE A 173 6.505 -0.080 -3.462 1.00 0.23 N ATOM 1310 CA PHE A 173 6.495 1.291 -2.968 1.00 0.29 C ATOM 1311 C PHE A 173 7.700 2.062 -3.477 1.00 0.80 C ATOM 1312 O PHE A 173 8.839 1.608 -3.344 1.00 1.44 O ATOM 1313 CB PHE A 173 6.479 1.272 -1.437 1.00 0.48 C ATOM 1314 CG PHE A 173 6.471 2.617 -0.764 1.00 0.42 C ATOM 1315 CD1 PHE A 173 5.278 3.266 -0.488 1.00 0.35 C ATOM 1316 CD2 PHE A 173 7.658 3.245 -0.437 1.00 0.72 C ATOM 1317 CE1 PHE A 173 5.271 4.514 0.105 1.00 0.37 C ATOM 1318 CE2 PHE A 173 7.658 4.490 0.158 1.00 0.71 C ATOM 1319 CZ PHE A 173 6.447 5.077 0.529 1.00 0.42 C ATOM 0 H PHE A 173 6.503 -0.786 -2.725 1.00 0.23 H new ATOM 0 HA PHE A 173 5.601 1.795 -3.336 1.00 0.29 H new ATOM 0 HB2 PHE A 173 5.600 0.718 -1.109 1.00 0.48 H new ATOM 0 HB3 PHE A 173 7.352 0.719 -1.091 1.00 0.48 H new ATOM 0 HD1 PHE A 173 4.342 2.790 -0.740 1.00 0.35 H new ATOM 0 HD2 PHE A 173 8.597 2.755 -0.650 1.00 0.72 H new ATOM 0 HE1 PHE A 173 4.340 5.046 0.234 1.00 0.37 H new ATOM 0 HE2 PHE A 173 8.589 5.007 0.336 1.00 0.71 H new ATOM 0 HZ PHE A 173 6.437 5.965 1.143 1.00 0.42 H new ATOM 1329 N LYS A 174 7.439 3.219 -4.069 1.00 1.17 N ATOM 1330 CA LYS A 174 8.499 4.097 -4.534 1.00 1.67 C ATOM 1331 C LYS A 174 9.265 4.626 -3.335 1.00 1.86 C ATOM 1332 O LYS A 174 8.856 5.593 -2.691 1.00 2.43 O ATOM 1333 CB LYS A 174 7.919 5.253 -5.353 1.00 2.20 C ATOM 1334 CG LYS A 174 7.086 4.799 -6.541 1.00 2.69 C ATOM 1335 CD LYS A 174 6.404 5.974 -7.222 1.00 3.30 C ATOM 1336 CE LYS A 174 5.524 5.519 -8.380 1.00 4.16 C ATOM 1337 NZ LYS A 174 6.315 4.879 -9.464 1.00 4.66 N ATOM 0 H LYS A 174 6.497 3.571 -4.238 1.00 1.17 H new ATOM 0 HA LYS A 174 9.176 3.537 -5.179 1.00 1.67 H new ATOM 0 HB2 LYS A 174 7.302 5.874 -4.703 1.00 2.20 H new ATOM 0 HB3 LYS A 174 8.736 5.880 -5.711 1.00 2.20 H new ATOM 0 HG2 LYS A 174 7.724 4.281 -7.258 1.00 2.69 H new ATOM 0 HG3 LYS A 174 6.334 4.083 -6.208 1.00 2.69 H new ATOM 0 HD2 LYS A 174 5.798 6.515 -6.495 1.00 3.30 H new ATOM 0 HD3 LYS A 174 7.158 6.670 -7.589 1.00 3.30 H new ATOM 0 HE2 LYS A 174 4.777 4.815 -8.013 1.00 4.16 H new ATOM 0 HE3 LYS A 174 4.984 6.376 -8.783 1.00 4.16 H new ATOM 0 HZ1 LYS A 174 5.706 4.723 -10.292 1.00 4.66 H new ATOM 0 HZ2 LYS A 174 7.107 5.499 -9.728 1.00 4.66 H new ATOM 0 HZ3 LYS A 174 6.686 3.966 -9.131 1.00 4.66 H new ATOM 1351 N SER A 175 10.360 3.960 -3.020 1.00 2.06 N ATOM 1352 CA SER A 175 11.118 4.260 -1.824 1.00 2.52 C ATOM 1353 C SER A 175 12.248 5.219 -2.142 1.00 2.93 C ATOM 1354 O SER A 175 12.733 5.929 -1.258 1.00 3.60 O ATOM 1355 CB SER A 175 11.662 2.964 -1.230 1.00 3.15 C ATOM 1356 OG SER A 175 10.628 2.000 -1.120 1.00 3.52 O ATOM 0 H SER A 175 10.745 3.201 -3.583 1.00 2.06 H new ATOM 0 HA SER A 175 10.465 4.739 -1.094 1.00 2.52 H new ATOM 0 HB2 SER A 175 12.464 2.577 -1.858 1.00 3.15 H new ATOM 0 HB3 SER A 175 12.093 3.159 -0.248 1.00 3.15 H new ATOM 0 HG SER A 175 10.146 1.938 -1.971 1.00 3.52 H new ATOM 1362 N ARG A 176 12.645 5.240 -3.419 1.00 3.11 N ATOM 1363 CA ARG A 176 13.706 6.116 -3.892 1.00 3.87 C ATOM 1364 C ARG A 176 15.033 5.720 -3.239 1.00 4.29 C ATOM 1365 O ARG A 176 15.731 4.837 -3.737 1.00 4.77 O ATOM 1366 CB ARG A 176 13.321 7.577 -3.604 1.00 4.45 C ATOM 1367 CG ARG A 176 14.328 8.628 -4.043 1.00 4.94 C ATOM 1368 CD ARG A 176 13.791 10.020 -3.744 1.00 5.64 C ATOM 1369 NE ARG A 176 14.810 11.060 -3.846 1.00 6.15 N ATOM 1370 CZ ARG A 176 14.865 12.112 -3.030 1.00 6.90 C ATOM 1371 NH1 ARG A 176 13.990 12.225 -2.034 1.00 7.24 N ATOM 1372 NH2 ARG A 176 15.792 13.046 -3.201 1.00 7.60 N ATOM 0 H ARG A 176 12.238 4.651 -4.145 1.00 3.11 H new ATOM 0 HA ARG A 176 13.835 6.014 -4.969 1.00 3.87 H new ATOM 0 HB2 ARG A 176 12.370 7.785 -4.095 1.00 4.45 H new ATOM 0 HB3 ARG A 176 13.157 7.685 -2.532 1.00 4.45 H new ATOM 0 HG2 ARG A 176 15.275 8.475 -3.525 1.00 4.94 H new ATOM 0 HG3 ARG A 176 14.529 8.528 -5.110 1.00 4.94 H new ATOM 0 HD2 ARG A 176 12.979 10.246 -4.435 1.00 5.64 H new ATOM 0 HD3 ARG A 176 13.367 10.032 -2.740 1.00 5.64 H new ATOM 0 HE ARG A 176 15.515 10.977 -4.578 1.00 6.15 H new ATOM 0 HH11 ARG A 176 13.279 11.507 -1.896 1.00 7.24 H new ATOM 0 HH12 ARG A 176 14.031 13.030 -1.408 1.00 7.24 H new ATOM 0 HH21 ARG A 176 16.468 12.961 -3.960 1.00 7.60 H new ATOM 0 HH22 ARG A 176 15.829 13.849 -2.573 1.00 7.60 H new ATOM 1386 N LYS A 177 15.338 6.343 -2.109 1.00 4.61 N ATOM 1387 CA LYS A 177 16.503 6.019 -1.304 1.00 5.47 C ATOM 1388 C LYS A 177 16.602 7.022 -0.169 1.00 6.20 C ATOM 1389 O LYS A 177 16.932 6.678 0.966 1.00 6.81 O ATOM 1390 CB LYS A 177 17.781 6.037 -2.144 1.00 5.99 C ATOM 1391 CG LYS A 177 19.046 5.810 -1.344 1.00 6.65 C ATOM 1392 CD LYS A 177 20.243 5.688 -2.263 1.00 7.44 C ATOM 1393 CE LYS A 177 20.232 4.364 -3.018 1.00 7.99 C ATOM 1394 NZ LYS A 177 20.252 3.197 -2.094 1.00 8.61 N ATOM 0 H LYS A 177 14.773 7.099 -1.722 1.00 4.61 H new ATOM 0 HA LYS A 177 16.392 5.011 -0.904 1.00 5.47 H new ATOM 0 HB2 LYS A 177 17.708 5.270 -2.915 1.00 5.99 H new ATOM 0 HB3 LYS A 177 17.854 6.997 -2.656 1.00 5.99 H new ATOM 0 HG2 LYS A 177 19.197 6.636 -0.649 1.00 6.65 H new ATOM 0 HG3 LYS A 177 18.947 4.905 -0.745 1.00 6.65 H new ATOM 0 HD2 LYS A 177 20.243 6.514 -2.974 1.00 7.44 H new ATOM 0 HD3 LYS A 177 21.161 5.769 -1.680 1.00 7.44 H new ATOM 0 HE2 LYS A 177 19.344 4.313 -3.648 1.00 7.99 H new ATOM 0 HE3 LYS A 177 21.096 4.317 -3.681 1.00 7.99 H new ATOM 0 HZ1 LYS A 177 20.596 2.357 -2.602 1.00 8.61 H new ATOM 0 HZ2 LYS A 177 20.883 3.399 -1.293 1.00 8.61 H new ATOM 0 HZ3 LYS A 177 19.291 3.018 -1.740 1.00 8.61 H new ATOM 1408 N GLU A 178 16.280 8.265 -0.489 1.00 6.45 N ATOM 1409 CA GLU A 178 16.287 9.337 0.488 1.00 7.43 C ATOM 1410 C GLU A 178 14.984 9.319 1.282 1.00 7.96 C ATOM 1411 O GLU A 178 13.901 9.151 0.717 1.00 8.13 O ATOM 1412 CB GLU A 178 16.481 10.691 -0.212 1.00 7.79 C ATOM 1413 CG GLU A 178 16.507 11.877 0.732 1.00 8.26 C ATOM 1414 CD GLU A 178 17.578 11.743 1.786 1.00 8.30 C ATOM 1415 OE1 GLU A 178 18.762 11.981 1.474 1.00 8.32 O ATOM 1416 OE2 GLU A 178 17.240 11.400 2.936 1.00 8.55 O ATOM 0 H GLU A 178 16.008 8.556 -1.428 1.00 6.45 H new ATOM 0 HA GLU A 178 17.117 9.189 1.178 1.00 7.43 H new ATOM 0 HB2 GLU A 178 17.415 10.667 -0.774 1.00 7.79 H new ATOM 0 HB3 GLU A 178 15.677 10.833 -0.935 1.00 7.79 H new ATOM 0 HG2 GLU A 178 16.674 12.790 0.161 1.00 8.26 H new ATOM 0 HG3 GLU A 178 15.535 11.976 1.215 1.00 8.26 H new ATOM 1423 N ARG A 179 15.095 9.471 2.592 1.00 8.49 N ATOM 1424 CA ARG A 179 13.935 9.473 3.471 1.00 9.26 C ATOM 1425 C ARG A 179 13.560 10.917 3.811 1.00 10.11 C ATOM 1426 O ARG A 179 12.718 11.175 4.675 1.00 10.52 O ATOM 1427 CB ARG A 179 14.246 8.650 4.730 1.00 9.63 C ATOM 1428 CG ARG A 179 13.077 8.481 5.690 1.00 10.21 C ATOM 1429 CD ARG A 179 13.389 7.458 6.772 1.00 10.71 C ATOM 1430 NE ARG A 179 14.689 7.692 7.403 1.00 11.04 N ATOM 1431 CZ ARG A 179 15.244 6.869 8.295 1.00 11.73 C ATOM 1432 NH1 ARG A 179 14.619 5.758 8.664 1.00 12.15 N ATOM 1433 NH2 ARG A 179 16.433 7.158 8.809 1.00 12.18 N ATOM 0 H ARG A 179 15.985 9.596 3.074 1.00 8.49 H new ATOM 0 HA ARG A 179 13.081 9.013 2.975 1.00 9.26 H new ATOM 0 HB2 ARG A 179 14.592 7.663 4.425 1.00 9.63 H new ATOM 0 HB3 ARG A 179 15.069 9.126 5.263 1.00 9.63 H new ATOM 0 HG2 ARG A 179 12.842 9.440 6.151 1.00 10.21 H new ATOM 0 HG3 ARG A 179 12.192 8.168 5.136 1.00 10.21 H new ATOM 0 HD2 ARG A 179 12.609 7.488 7.532 1.00 10.71 H new ATOM 0 HD3 ARG A 179 13.373 6.458 6.338 1.00 10.71 H new ATOM 0 HE ARG A 179 15.202 8.535 7.145 1.00 11.04 H new ATOM 0 HH11 ARG A 179 13.709 5.529 8.265 1.00 12.15 H new ATOM 0 HH12 ARG A 179 15.049 5.133 9.346 1.00 12.15 H new ATOM 0 HH21 ARG A 179 16.920 8.007 8.522 1.00 12.18 H new ATOM 0 HH22 ARG A 179 16.860 6.531 9.491 1.00 12.18 H new ATOM 1447 N GLU A 180 14.220 11.851 3.117 1.00 10.55 N ATOM 1448 CA GLU A 180 13.945 13.291 3.213 1.00 11.52 C ATOM 1449 C GLU A 180 14.485 13.890 4.507 1.00 12.20 C ATOM 1450 O GLU A 180 15.045 14.985 4.508 1.00 12.70 O ATOM 1451 CB GLU A 180 12.446 13.578 3.062 1.00 11.80 C ATOM 1452 CG GLU A 180 11.873 13.136 1.724 1.00 12.14 C ATOM 1453 CD GLU A 180 12.388 13.960 0.559 1.00 12.44 C ATOM 1454 OE1 GLU A 180 13.551 13.768 0.148 1.00 12.64 O ATOM 1455 OE2 GLU A 180 11.620 14.797 0.038 1.00 12.62 O ATOM 0 H GLU A 180 14.970 11.626 2.464 1.00 10.55 H new ATOM 0 HA GLU A 180 14.470 13.773 2.388 1.00 11.52 H new ATOM 0 HB2 GLU A 180 11.906 13.074 3.863 1.00 11.80 H new ATOM 0 HB3 GLU A 180 12.275 14.647 3.186 1.00 11.80 H new ATOM 0 HG2 GLU A 180 12.120 12.087 1.558 1.00 12.14 H new ATOM 0 HG3 GLU A 180 10.786 13.206 1.759 1.00 12.14 H new ATOM 1462 N ALA A 181 14.320 13.172 5.599 1.00 12.41 N ATOM 1463 CA ALA A 181 14.821 13.613 6.889 1.00 13.20 C ATOM 1464 C ALA A 181 16.014 12.767 7.314 1.00 13.42 C ATOM 1465 O ALA A 181 15.851 11.678 7.869 1.00 13.65 O ATOM 1466 CB ALA A 181 13.718 13.548 7.935 1.00 13.56 C ATOM 0 H ALA A 181 13.839 12.273 5.620 1.00 12.41 H new ATOM 0 HA ALA A 181 15.150 14.648 6.799 1.00 13.20 H new ATOM 0 HB1 ALA A 181 14.108 13.881 8.897 1.00 13.56 H new ATOM 0 HB2 ALA A 181 12.893 14.194 7.635 1.00 13.56 H new ATOM 0 HB3 ALA A 181 13.361 12.522 8.024 1.00 13.56 H new ATOM 1472 N GLU A 182 17.209 13.257 7.026 1.00 13.52 N ATOM 1473 CA GLU A 182 18.434 12.550 7.365 1.00 13.92 C ATOM 1474 C GLU A 182 19.468 13.534 7.896 1.00 14.43 C ATOM 1475 O GLU A 182 19.765 13.489 9.109 1.00 15.05 O ATOM 1476 CB GLU A 182 18.975 11.801 6.139 1.00 13.77 C ATOM 1477 CG GLU A 182 20.219 10.964 6.408 1.00 14.19 C ATOM 1478 CD GLU A 182 20.601 10.098 5.225 1.00 14.38 C ATOM 1479 OE1 GLU A 182 21.086 10.644 4.213 1.00 14.58 O ATOM 1480 OE2 GLU A 182 20.422 8.864 5.300 1.00 14.46 O ATOM 1481 OXT GLU A 182 19.946 14.380 7.111 1.00 14.36 O ATOM 0 H GLU A 182 17.357 14.149 6.554 1.00 13.52 H new ATOM 0 HA GLU A 182 18.219 11.817 8.142 1.00 13.92 H new ATOM 0 HB2 GLU A 182 18.191 11.150 5.752 1.00 13.77 H new ATOM 0 HB3 GLU A 182 19.202 12.526 5.357 1.00 13.77 H new ATOM 0 HG2 GLU A 182 21.051 11.624 6.655 1.00 14.19 H new ATOM 0 HG3 GLU A 182 20.046 10.330 7.278 1.00 14.19 H new TER 1488 GLU A 182