USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 963 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 18 HIS : no HE2:sc= -0.194 K(o=1.1,f=-8.9!) USER MOD Set 1.2: A 81 SER OG : rot -55:sc= 1.26 USER MOD Set 2.1: A 77 MET CE :methyl 163:sc= -0.926 (180deg=-0.664) USER MOD Set 2.2: A 111 MET CE :methyl -174:sc= -2.6 (180deg=-2.09) USER MOD Set 3.1: A 46 THR OG1 : rot 129:sc= 0.783 USER MOD Set 3.2: A 72 HIS : no HE2:sc= -0.0755 K(o=0.71,f=-8.1!) USER MOD Set 4.1: A 35 MET CE :methyl -124:sc= -0.883 (180deg=-2.52!) USER MOD Set 4.2: A 86 ASN : amide:sc= -0.38 X(o=-1.3,f=-1.7) USER MOD Set 5.1: A 33 ASN : amide:sc= 0.766 K(o=1,f=-3.5) USER MOD Set 5.2: A 39 THR OG1 : rot 34:sc= 0.238 USER MOD Single : A 19 ASN : amide:sc= -0.479 K(o=-0.48,f=-1.9) USER MOD Single : A 23 TYR OH : rot -140:sc= 0.604 USER MOD Single : A 25 SER OG : rot 135:sc= 0.875 USER MOD Single : A 27 GLN : amide:sc= -0.213 K(o=-0.21,f=-3.6!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -2.05! C(o=-2.1!,f=-1.5!) USER MOD Single : A 60 TYR OH : rot 57:sc= 1.26 USER MOD Single : A 62 CYS SG : rot 180:sc= -0.103 USER MOD Single : A 66 SER OG : rot 170:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0216) USER MOD Single : A 80 THR OG1 : rot 85:sc= 1.22 USER MOD Single : A 93 ASN : amide:sc= -1.17 K(o=-1.2,f=-0.013) USER MOD Single : A 95 TYR OH : rot 100:sc= -0.39 USER MOD Single : A 99 THR OG1 : rot 42:sc= 0.152 USER MOD Single : A 107 ASN : amide:sc= 0.92 K(o=0.92,f=-1.3) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0486) USER MOD Single : A 114 LYS NZ :NH3+ -174:sc= -0.0181 (180deg=-0.0548) USER MOD Single : A 115 THR OG1 : rot 71:sc= 1.22 USER MOD Single : A 116 TYR OH : rot -30:sc= -0.441 USER MOD Single : A 117 MET CE :methyl -125:sc= -1.06 (180deg=-4.77!) USER MOD Single : A 120 ASN : amide:sc= 1.04 K(o=1,f=-0.47) USER MOD Single : A 121 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0442) USER MOD Single : A 126 MET CE :methyl -130:sc= -0.153 (180deg=-1.37) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 157:sc= -0.108 (180deg=-0.57) USER MOD Single : A 142 LYS NZ :NH3+ 168:sc= -0.0446 (180deg=-0.278) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -179:sc= 1.08 (180deg=0.978) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 162:sc= -0.144 (180deg=-0.527) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -172:sc= -0.0123 (180deg=-0.0956) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -24.653 -11.848 -10.816 1.00 44.23 N ATOM 94 CA LEU A 17 -23.982 -11.047 -9.868 1.00 43.34 C ATOM 95 C LEU A 17 -23.029 -10.156 -10.594 1.00 50.54 C ATOM 96 O LEU A 17 -22.564 -10.477 -11.689 1.00 73.21 O ATOM 97 CB LEU A 17 -23.219 -11.851 -8.836 1.00 51.35 C ATOM 98 CG LEU A 17 -24.003 -12.841 -7.996 1.00 70.33 C ATOM 99 CD1 LEU A 17 -25.235 -12.211 -7.371 1.00 61.53 C ATOM 100 CD2 LEU A 17 -24.309 -14.097 -8.761 1.00 73.12 C ATOM 0 HA LEU A 17 -24.738 -10.478 -9.327 1.00 43.34 H new ATOM 0 HB2 LEU A 17 -22.431 -12.399 -9.353 1.00 51.35 H new ATOM 0 HB3 LEU A 17 -22.729 -11.151 -8.160 1.00 51.35 H new ATOM 0 HG LEU A 17 -23.366 -13.137 -7.163 1.00 70.33 H new ATOM 0 HD11 LEU A 17 -25.765 -12.957 -6.779 1.00 61.53 H new ATOM 0 HD12 LEU A 17 -24.934 -11.384 -6.728 1.00 61.53 H new ATOM 0 HD13 LEU A 17 -25.892 -11.839 -8.157 1.00 61.53 H new ATOM 0 HD21 LEU A 17 -24.871 -14.782 -8.126 1.00 73.12 H new ATOM 0 HD22 LEU A 17 -24.901 -13.851 -9.643 1.00 73.12 H new ATOM 0 HD23 LEU A 17 -23.377 -14.571 -9.070 1.00 73.12 H new ATOM 112 N HIS A 18 -22.740 -9.068 -10.005 1.00 2.53 N ATOM 113 CA HIS A 18 -21.897 -8.080 -10.606 1.00 32.33 C ATOM 114 C HIS A 18 -20.643 -7.954 -9.797 1.00 34.10 C ATOM 115 O HIS A 18 -20.610 -8.377 -8.619 1.00 20.41 O ATOM 116 CB HIS A 18 -22.618 -6.729 -10.635 1.00 4.13 C ATOM 117 CG HIS A 18 -23.933 -6.747 -11.360 1.00 21.21 C ATOM 118 ND1 HIS A 18 -24.131 -6.180 -12.593 1.00 11.24 N ATOM 119 CD2 HIS A 18 -25.133 -7.244 -10.988 1.00 21.52 C ATOM 120 CE1 HIS A 18 -25.389 -6.321 -12.942 1.00 53.13 C ATOM 121 NE2 HIS A 18 -26.018 -6.967 -11.984 1.00 10.35 N ATOM 0 H HIS A 18 -23.080 -8.819 -9.076 1.00 2.53 H new ATOM 0 HA HIS A 18 -21.656 -8.379 -11.626 1.00 32.33 H new ATOM 0 HB2 HIS A 18 -22.786 -6.398 -9.610 1.00 4.13 H new ATOM 0 HB3 HIS A 18 -21.967 -5.993 -11.106 1.00 4.13 H new ATOM 0 HD1 HIS A 18 -23.413 -5.720 -13.152 1.00 11.24 H new ATOM 0 HD2 HIS A 18 -25.350 -7.766 -10.068 1.00 21.52 H new ATOM 0 HE1 HIS A 18 -25.833 -5.966 -13.861 1.00 53.13 H new ATOM 130 N ASN A 19 -19.615 -7.427 -10.401 1.00 11.45 N ATOM 131 CA ASN A 19 -18.387 -7.188 -9.697 1.00 23.10 C ATOM 132 C ASN A 19 -18.136 -5.685 -9.694 1.00 2.21 C ATOM 133 O ASN A 19 -18.113 -5.049 -10.757 1.00 5.41 O ATOM 134 CB ASN A 19 -17.194 -7.899 -10.353 1.00 34.01 C ATOM 135 CG ASN A 19 -17.372 -9.388 -10.609 1.00 11.20 C ATOM 136 OD1 ASN A 19 -18.138 -10.079 -9.941 1.00 20.22 O ATOM 137 ND2 ASN A 19 -16.624 -9.899 -11.560 1.00 63.10 N ATOM 0 H ASN A 19 -19.604 -7.154 -11.384 1.00 11.45 H new ATOM 0 HA ASN A 19 -18.482 -7.582 -8.685 1.00 23.10 H new ATOM 0 HB2 ASN A 19 -16.980 -7.409 -11.303 1.00 34.01 H new ATOM 0 HB3 ASN A 19 -16.319 -7.760 -9.719 1.00 34.01 H new ATOM 0 HD21 ASN A 19 -16.668 -10.898 -11.763 1.00 63.10 H new ATOM 0 HD22 ASN A 19 -15.999 -9.297 -12.096 1.00 63.10 H new ATOM 144 N VAL A 20 -17.952 -5.123 -8.530 1.00 34.22 N ATOM 145 CA VAL A 20 -17.765 -3.684 -8.383 1.00 25.45 C ATOM 146 C VAL A 20 -16.472 -3.407 -7.622 1.00 70.11 C ATOM 147 O VAL A 20 -16.133 -4.132 -6.705 1.00 4.40 O ATOM 148 CB VAL A 20 -18.976 -3.044 -7.611 1.00 30.40 C ATOM 149 CG1 VAL A 20 -18.802 -1.540 -7.413 1.00 2.50 C ATOM 150 CG2 VAL A 20 -20.284 -3.322 -8.335 1.00 30.31 C ATOM 0 H VAL A 20 -17.926 -5.639 -7.651 1.00 34.22 H new ATOM 0 HA VAL A 20 -17.708 -3.239 -9.376 1.00 25.45 H new ATOM 0 HB VAL A 20 -19.004 -3.509 -6.626 1.00 30.40 H new ATOM 0 HG11 VAL A 20 -19.663 -1.142 -6.875 1.00 2.50 H new ATOM 0 HG12 VAL A 20 -17.896 -1.351 -6.838 1.00 2.50 H new ATOM 0 HG13 VAL A 20 -18.723 -1.052 -8.384 1.00 2.50 H new ATOM 0 HG21 VAL A 20 -21.108 -2.870 -7.783 1.00 30.31 H new ATOM 0 HG22 VAL A 20 -20.242 -2.897 -9.338 1.00 30.31 H new ATOM 0 HG23 VAL A 20 -20.440 -4.399 -8.403 1.00 30.31 H new ATOM 160 N PHE A 21 -15.762 -2.380 -8.009 1.00 34.23 N ATOM 161 CA PHE A 21 -14.549 -1.997 -7.321 1.00 53.34 C ATOM 162 C PHE A 21 -14.902 -0.942 -6.305 1.00 64.24 C ATOM 163 O PHE A 21 -15.466 0.106 -6.649 1.00 24.11 O ATOM 164 CB PHE A 21 -13.513 -1.467 -8.327 1.00 24.54 C ATOM 165 CG PHE A 21 -12.209 -0.985 -7.735 1.00 23.42 C ATOM 166 CD1 PHE A 21 -11.254 -1.885 -7.286 1.00 42.12 C ATOM 167 CD2 PHE A 21 -11.928 0.371 -7.656 1.00 15.42 C ATOM 168 CE1 PHE A 21 -10.060 -1.444 -6.771 1.00 1.01 C ATOM 169 CE2 PHE A 21 -10.730 0.815 -7.140 1.00 1.50 C ATOM 170 CZ PHE A 21 -9.797 -0.094 -6.697 1.00 3.11 C ATOM 0 H PHE A 21 -16.002 -1.787 -8.803 1.00 34.23 H new ATOM 0 HA PHE A 21 -14.108 -2.858 -6.818 1.00 53.34 H new ATOM 0 HB2 PHE A 21 -13.294 -2.257 -9.045 1.00 24.54 H new ATOM 0 HB3 PHE A 21 -13.963 -0.645 -8.884 1.00 24.54 H new ATOM 0 HD1 PHE A 21 -11.452 -2.945 -7.342 1.00 42.12 H new ATOM 0 HD2 PHE A 21 -12.657 1.088 -8.003 1.00 15.42 H new ATOM 0 HE1 PHE A 21 -9.326 -2.156 -6.424 1.00 1.01 H new ATOM 0 HE2 PHE A 21 -10.524 1.874 -7.083 1.00 1.50 H new ATOM 0 HZ PHE A 21 -8.858 0.251 -6.291 1.00 3.11 H new ATOM 180 N VAL A 22 -14.584 -1.206 -5.078 1.00 3.44 N ATOM 181 CA VAL A 22 -14.919 -0.325 -4.018 1.00 52.13 C ATOM 182 C VAL A 22 -13.677 0.384 -3.498 1.00 51.01 C ATOM 183 O VAL A 22 -12.563 -0.160 -3.524 1.00 15.11 O ATOM 184 CB VAL A 22 -15.676 -1.049 -2.871 1.00 51.01 C ATOM 185 CG1 VAL A 22 -14.830 -2.113 -2.191 1.00 3.01 C ATOM 186 CG2 VAL A 22 -16.205 -0.057 -1.872 1.00 24.34 C ATOM 0 H VAL A 22 -14.082 -2.045 -4.787 1.00 3.44 H new ATOM 0 HA VAL A 22 -15.601 0.425 -4.420 1.00 52.13 H new ATOM 0 HB VAL A 22 -16.520 -1.568 -3.326 1.00 51.01 H new ATOM 0 HG11 VAL A 22 -15.409 -2.586 -1.398 1.00 3.01 H new ATOM 0 HG12 VAL A 22 -14.534 -2.865 -2.922 1.00 3.01 H new ATOM 0 HG13 VAL A 22 -13.939 -1.652 -1.764 1.00 3.01 H new ATOM 0 HG21 VAL A 22 -16.732 -0.586 -1.078 1.00 24.34 H new ATOM 0 HG22 VAL A 22 -15.376 0.507 -1.445 1.00 24.34 H new ATOM 0 HG23 VAL A 22 -16.892 0.628 -2.369 1.00 24.34 H new ATOM 196 N TYR A 23 -13.876 1.588 -3.043 1.00 70.23 N ATOM 197 CA TYR A 23 -12.807 2.417 -2.592 1.00 21.13 C ATOM 198 C TYR A 23 -12.922 2.792 -1.104 1.00 3.24 C ATOM 199 O TYR A 23 -12.054 2.456 -0.330 1.00 20.52 O ATOM 200 CB TYR A 23 -12.691 3.657 -3.501 1.00 74.43 C ATOM 201 CG TYR A 23 -13.955 4.504 -3.601 1.00 23.03 C ATOM 202 CD1 TYR A 23 -15.093 4.033 -4.254 1.00 2.10 C ATOM 203 CD2 TYR A 23 -14.006 5.767 -3.049 1.00 63.53 C ATOM 204 CE1 TYR A 23 -16.230 4.796 -4.338 1.00 35.41 C ATOM 205 CE2 TYR A 23 -15.144 6.533 -3.135 1.00 11.33 C ATOM 206 CZ TYR A 23 -16.247 6.047 -3.773 1.00 64.42 C ATOM 207 OH TYR A 23 -17.364 6.808 -3.843 1.00 13.22 O ATOM 0 H TYR A 23 -14.797 2.022 -2.976 1.00 70.23 H new ATOM 0 HA TYR A 23 -11.884 1.842 -2.667 1.00 21.13 H new ATOM 0 HB2 TYR A 23 -11.880 4.284 -3.132 1.00 74.43 H new ATOM 0 HB3 TYR A 23 -12.411 3.330 -4.502 1.00 74.43 H new ATOM 0 HD1 TYR A 23 -15.079 3.050 -4.702 1.00 2.10 H new ATOM 0 HD2 TYR A 23 -13.138 6.160 -2.541 1.00 63.53 H new ATOM 0 HE1 TYR A 23 -17.105 4.416 -4.845 1.00 35.41 H new ATOM 0 HE2 TYR A 23 -15.165 7.520 -2.697 1.00 11.33 H new ATOM 0 HH TYR A 23 -17.115 7.740 -4.013 1.00 13.22 H new ATOM 217 N GLY A 24 -14.006 3.460 -0.699 1.00 64.14 N ATOM 218 CA GLY A 24 -14.067 3.923 0.684 1.00 45.42 C ATOM 219 C GLY A 24 -15.370 3.641 1.408 1.00 40.42 C ATOM 220 O GLY A 24 -15.375 2.913 2.396 1.00 25.44 O ATOM 0 H GLY A 24 -14.815 3.683 -1.279 1.00 64.14 H new ATOM 0 HA2 GLY A 24 -13.254 3.458 1.241 1.00 45.42 H new ATOM 0 HA3 GLY A 24 -13.889 4.998 0.697 1.00 45.42 H new ATOM 224 N SER A 25 -16.475 4.173 0.892 1.00 25.31 N ATOM 225 CA SER A 25 -17.788 4.125 1.568 1.00 55.01 C ATOM 226 C SER A 25 -18.267 2.689 1.876 1.00 51.34 C ATOM 227 O SER A 25 -19.067 2.474 2.786 1.00 1.13 O ATOM 228 CB SER A 25 -18.816 4.803 0.672 1.00 0.22 C ATOM 229 OG SER A 25 -18.350 6.073 0.225 1.00 43.12 O ATOM 0 H SER A 25 -16.495 4.653 -0.008 1.00 25.31 H new ATOM 0 HA SER A 25 -17.679 4.636 2.525 1.00 55.01 H new ATOM 0 HB2 SER A 25 -19.029 4.167 -0.188 1.00 0.22 H new ATOM 0 HB3 SER A 25 -19.752 4.927 1.217 1.00 0.22 H new ATOM 0 HG SER A 25 -18.531 6.169 -0.733 1.00 43.12 H new ATOM 235 N PHE A 26 -17.778 1.725 1.121 1.00 30.43 N ATOM 236 CA PHE A 26 -18.208 0.340 1.276 1.00 30.44 C ATOM 237 C PHE A 26 -16.963 -0.560 1.331 1.00 2.30 C ATOM 238 O PHE A 26 -17.029 -1.738 1.028 1.00 10.13 O ATOM 239 CB PHE A 26 -19.070 -0.062 0.053 1.00 34.11 C ATOM 240 CG PHE A 26 -20.194 0.879 -0.284 1.00 10.54 C ATOM 241 CD1 PHE A 26 -21.383 0.866 0.420 1.00 61.22 C ATOM 242 CD2 PHE A 26 -20.044 1.787 -1.322 1.00 13.42 C ATOM 243 CE1 PHE A 26 -22.403 1.745 0.089 1.00 44.13 C ATOM 244 CE2 PHE A 26 -21.054 2.658 -1.651 1.00 60.24 C ATOM 245 CZ PHE A 26 -22.235 2.640 -0.947 1.00 31.41 C ATOM 0 H PHE A 26 -17.081 1.871 0.391 1.00 30.43 H new ATOM 0 HA PHE A 26 -18.791 0.229 2.190 1.00 30.44 H new ATOM 0 HB2 PHE A 26 -18.418 -0.148 -0.816 1.00 34.11 H new ATOM 0 HB3 PHE A 26 -19.490 -1.051 0.236 1.00 34.11 H new ATOM 0 HD1 PHE A 26 -21.519 0.167 1.232 1.00 61.22 H new ATOM 0 HD2 PHE A 26 -19.119 1.809 -1.880 1.00 13.42 H new ATOM 0 HE1 PHE A 26 -23.330 1.729 0.643 1.00 44.13 H new ATOM 0 HE2 PHE A 26 -20.920 3.357 -2.463 1.00 60.24 H new ATOM 0 HZ PHE A 26 -23.029 3.325 -1.205 1.00 31.41 H new ATOM 255 N GLN A 27 -15.838 0.020 1.749 1.00 42.05 N ATOM 256 CA GLN A 27 -14.537 -0.666 1.726 1.00 11.35 C ATOM 257 C GLN A 27 -14.455 -1.801 2.752 1.00 23.13 C ATOM 258 O GLN A 27 -13.742 -2.799 2.555 1.00 63.32 O ATOM 259 CB GLN A 27 -13.427 0.349 2.003 1.00 1.41 C ATOM 260 CG GLN A 27 -12.028 -0.228 1.942 1.00 52.33 C ATOM 261 CD GLN A 27 -10.943 0.774 2.292 1.00 61.24 C ATOM 262 OE1 GLN A 27 -9.830 0.696 1.781 1.00 24.11 O ATOM 263 NE2 GLN A 27 -11.234 1.701 3.177 1.00 55.00 N ATOM 0 H GLN A 27 -15.798 0.972 2.112 1.00 42.05 H new ATOM 0 HA GLN A 27 -14.417 -1.110 0.738 1.00 11.35 H new ATOM 0 HB2 GLN A 27 -13.505 1.161 1.280 1.00 1.41 H new ATOM 0 HB3 GLN A 27 -13.586 0.784 2.990 1.00 1.41 H new ATOM 0 HG2 GLN A 27 -11.963 -1.075 2.625 1.00 52.33 H new ATOM 0 HG3 GLN A 27 -11.846 -0.613 0.939 1.00 52.33 H new ATOM 0 HE21 GLN A 27 -12.168 1.741 3.585 1.00 55.00 H new ATOM 0 HE22 GLN A 27 -10.526 2.380 3.456 1.00 55.00 H new ATOM 272 N ASP A 28 -15.163 -1.644 3.829 1.00 64.00 N ATOM 273 CA ASP A 28 -15.120 -2.601 4.911 1.00 41.20 C ATOM 274 C ASP A 28 -16.274 -3.597 4.818 1.00 61.12 C ATOM 275 O ASP A 28 -17.418 -3.206 4.651 1.00 1.20 O ATOM 276 CB ASP A 28 -15.134 -1.867 6.250 1.00 35.41 C ATOM 277 CG ASP A 28 -15.167 -2.800 7.424 1.00 23.51 C ATOM 278 OD1 ASP A 28 -14.176 -3.495 7.667 1.00 45.23 O ATOM 279 OD2 ASP A 28 -16.180 -2.825 8.137 1.00 72.40 O ATOM 0 H ASP A 28 -15.788 -0.854 3.990 1.00 64.00 H new ATOM 0 HA ASP A 28 -14.195 -3.172 4.833 1.00 41.20 H new ATOM 0 HB2 ASP A 28 -14.250 -1.233 6.321 1.00 35.41 H new ATOM 0 HB3 ASP A 28 -16.002 -1.210 6.290 1.00 35.41 H new ATOM 284 N PRO A 29 -15.993 -4.903 4.921 1.00 10.22 N ATOM 285 CA PRO A 29 -17.024 -5.942 4.820 1.00 12.53 C ATOM 286 C PRO A 29 -18.119 -5.830 5.889 1.00 52.24 C ATOM 287 O PRO A 29 -19.266 -6.219 5.659 1.00 33.43 O ATOM 288 CB PRO A 29 -16.256 -7.246 4.987 1.00 41.42 C ATOM 289 CG PRO A 29 -14.955 -6.867 5.600 1.00 11.41 C ATOM 290 CD PRO A 29 -14.652 -5.485 5.117 1.00 41.23 C ATOM 0 HA PRO A 29 -17.558 -5.861 3.873 1.00 12.53 H new ATOM 0 HB2 PRO A 29 -16.801 -7.943 5.623 1.00 41.42 H new ATOM 0 HB3 PRO A 29 -16.108 -7.740 4.027 1.00 41.42 H new ATOM 0 HG2 PRO A 29 -15.015 -6.894 6.688 1.00 11.41 H new ATOM 0 HG3 PRO A 29 -14.169 -7.563 5.306 1.00 11.41 H new ATOM 0 HD2 PRO A 29 -14.069 -4.921 5.846 1.00 41.23 H new ATOM 0 HD3 PRO A 29 -14.078 -5.498 4.191 1.00 41.23 H new ATOM 298 N ASP A 30 -17.779 -5.278 7.043 1.00 42.35 N ATOM 299 CA ASP A 30 -18.761 -5.123 8.108 1.00 33.42 C ATOM 300 C ASP A 30 -19.779 -4.067 7.753 1.00 74.31 C ATOM 301 O ASP A 30 -20.976 -4.260 7.964 1.00 10.10 O ATOM 302 CB ASP A 30 -18.117 -4.827 9.458 1.00 62.44 C ATOM 303 CG ASP A 30 -19.143 -4.568 10.547 1.00 43.13 C ATOM 304 OD1 ASP A 30 -19.689 -5.541 11.114 1.00 5.52 O ATOM 305 OD2 ASP A 30 -19.396 -3.395 10.866 1.00 65.21 O ATOM 0 H ASP A 30 -16.845 -4.934 7.266 1.00 42.35 H new ATOM 0 HA ASP A 30 -19.274 -6.080 8.206 1.00 33.42 H new ATOM 0 HB2 ASP A 30 -17.488 -5.668 9.749 1.00 62.44 H new ATOM 0 HB3 ASP A 30 -17.465 -3.959 9.363 1.00 62.44 H new ATOM 310 N VAL A 31 -19.318 -2.955 7.175 1.00 21.34 N ATOM 311 CA VAL A 31 -20.247 -1.921 6.750 1.00 21.21 C ATOM 312 C VAL A 31 -21.120 -2.460 5.614 1.00 14.12 C ATOM 313 O VAL A 31 -22.259 -2.053 5.459 1.00 12.24 O ATOM 314 CB VAL A 31 -19.582 -0.538 6.380 1.00 64.43 C ATOM 315 CG1 VAL A 31 -18.731 -0.599 5.130 1.00 44.45 C ATOM 316 CG2 VAL A 31 -20.630 0.562 6.268 1.00 41.12 C ATOM 0 H VAL A 31 -18.334 -2.756 6.997 1.00 21.34 H new ATOM 0 HA VAL A 31 -20.867 -1.684 7.615 1.00 21.21 H new ATOM 0 HB VAL A 31 -18.907 -0.298 7.201 1.00 64.43 H new ATOM 0 HG11 VAL A 31 -18.304 0.384 4.932 1.00 44.45 H new ATOM 0 HG12 VAL A 31 -17.928 -1.322 5.272 1.00 44.45 H new ATOM 0 HG13 VAL A 31 -19.348 -0.903 4.284 1.00 44.45 H new ATOM 0 HG21 VAL A 31 -20.144 1.503 6.012 1.00 41.12 H new ATOM 0 HG22 VAL A 31 -21.349 0.302 5.491 1.00 41.12 H new ATOM 0 HG23 VAL A 31 -21.149 0.669 7.221 1.00 41.12 H new ATOM 326 N ILE A 32 -20.574 -3.409 4.838 1.00 75.41 N ATOM 327 CA ILE A 32 -21.329 -4.074 3.799 1.00 41.43 C ATOM 328 C ILE A 32 -22.516 -4.824 4.424 1.00 62.03 C ATOM 329 O ILE A 32 -23.658 -4.707 3.968 1.00 4.51 O ATOM 330 CB ILE A 32 -20.419 -5.052 3.017 1.00 72.34 C ATOM 331 CG1 ILE A 32 -19.333 -4.295 2.251 1.00 24.21 C ATOM 332 CG2 ILE A 32 -21.209 -5.929 2.085 1.00 54.24 C ATOM 333 CD1 ILE A 32 -19.877 -3.344 1.205 1.00 34.01 C ATOM 0 H ILE A 32 -19.608 -3.724 4.922 1.00 75.41 H new ATOM 0 HA ILE A 32 -21.710 -3.330 3.100 1.00 41.43 H new ATOM 0 HB ILE A 32 -19.939 -5.700 3.750 1.00 72.34 H new ATOM 0 HG12 ILE A 32 -18.726 -3.733 2.960 1.00 24.21 H new ATOM 0 HG13 ILE A 32 -18.673 -5.015 1.767 1.00 24.21 H new ATOM 0 HG21 ILE A 32 -20.532 -6.600 1.556 1.00 54.24 H new ATOM 0 HG22 ILE A 32 -21.927 -6.515 2.658 1.00 54.24 H new ATOM 0 HG23 ILE A 32 -21.741 -5.308 1.364 1.00 54.24 H new ATOM 0 HD11 ILE A 32 -19.049 -2.843 0.703 1.00 34.01 H new ATOM 0 HD12 ILE A 32 -20.460 -3.903 0.473 1.00 34.01 H new ATOM 0 HD13 ILE A 32 -20.513 -2.601 1.685 1.00 34.01 H new ATOM 345 N ASN A 33 -22.242 -5.552 5.486 1.00 4.20 N ATOM 346 CA ASN A 33 -23.277 -6.280 6.219 1.00 13.12 C ATOM 347 C ASN A 33 -24.329 -5.351 6.784 1.00 41.02 C ATOM 348 O ASN A 33 -25.495 -5.709 6.884 1.00 20.11 O ATOM 349 CB ASN A 33 -22.668 -7.148 7.323 1.00 0.42 C ATOM 350 CG ASN A 33 -21.974 -8.372 6.776 1.00 45.14 C ATOM 351 OD1 ASN A 33 -22.401 -8.947 5.783 1.00 53.41 O ATOM 352 ND2 ASN A 33 -20.882 -8.757 7.373 1.00 35.12 N ATOM 0 H ASN A 33 -21.303 -5.661 5.870 1.00 4.20 H new ATOM 0 HA ASN A 33 -23.772 -6.937 5.504 1.00 13.12 H new ATOM 0 HB2 ASN A 33 -21.955 -6.555 7.896 1.00 0.42 H new ATOM 0 HB3 ASN A 33 -23.453 -7.457 8.013 1.00 0.42 H new ATOM 0 HD21 ASN A 33 -20.359 -9.556 7.015 1.00 35.12 H new ATOM 0 HD22 ASN A 33 -20.549 -8.259 8.199 1.00 35.12 H new ATOM 359 N VAL A 34 -23.931 -4.162 7.141 1.00 72.33 N ATOM 360 CA VAL A 34 -24.870 -3.200 7.677 1.00 52.14 C ATOM 361 C VAL A 34 -25.648 -2.481 6.556 1.00 32.04 C ATOM 362 O VAL A 34 -26.859 -2.240 6.678 1.00 40.13 O ATOM 363 CB VAL A 34 -24.165 -2.154 8.593 1.00 74.33 C ATOM 364 CG1 VAL A 34 -25.164 -1.163 9.181 1.00 65.20 C ATOM 365 CG2 VAL A 34 -23.383 -2.843 9.700 1.00 54.54 C ATOM 0 H VAL A 34 -22.969 -3.831 7.074 1.00 72.33 H new ATOM 0 HA VAL A 34 -25.580 -3.762 8.283 1.00 52.14 H new ATOM 0 HB VAL A 34 -23.465 -1.594 7.972 1.00 74.33 H new ATOM 0 HG11 VAL A 34 -24.638 -0.449 9.814 1.00 65.20 H new ATOM 0 HG12 VAL A 34 -25.667 -0.631 8.373 1.00 65.20 H new ATOM 0 HG13 VAL A 34 -25.902 -1.700 9.776 1.00 65.20 H new ATOM 0 HG21 VAL A 34 -22.900 -2.092 10.326 1.00 54.54 H new ATOM 0 HG22 VAL A 34 -24.063 -3.440 10.308 1.00 54.54 H new ATOM 0 HG23 VAL A 34 -22.625 -3.491 9.261 1.00 54.54 H new ATOM 375 N MET A 35 -24.962 -2.168 5.469 1.00 61.25 N ATOM 376 CA MET A 35 -25.544 -1.372 4.403 1.00 4.14 C ATOM 377 C MET A 35 -26.536 -2.206 3.580 1.00 72.11 C ATOM 378 O MET A 35 -27.591 -1.709 3.190 1.00 32.15 O ATOM 379 CB MET A 35 -24.409 -0.808 3.521 1.00 62.22 C ATOM 380 CG MET A 35 -24.736 0.474 2.746 1.00 52.54 C ATOM 381 SD MET A 35 -26.023 0.332 1.484 1.00 30.03 S ATOM 382 CE MET A 35 -25.220 -0.745 0.309 1.00 51.44 C ATOM 0 H MET A 35 -23.997 -2.455 5.302 1.00 61.25 H new ATOM 0 HA MET A 35 -26.105 -0.541 4.830 1.00 4.14 H new ATOM 0 HB2 MET A 35 -23.544 -0.615 4.156 1.00 62.22 H new ATOM 0 HB3 MET A 35 -24.115 -1.576 2.806 1.00 62.22 H new ATOM 0 HG2 MET A 35 -25.039 1.239 3.461 1.00 52.54 H new ATOM 0 HG3 MET A 35 -23.823 0.828 2.267 1.00 52.54 H new ATOM 0 HE1 MET A 35 -25.201 -0.266 -0.670 1.00 51.44 H new ATOM 0 HE2 MET A 35 -24.199 -0.943 0.636 1.00 51.44 H new ATOM 0 HE3 MET A 35 -25.769 -1.685 0.243 1.00 51.44 H new ATOM 392 N LEU A 36 -26.241 -3.477 3.367 1.00 41.21 N ATOM 393 CA LEU A 36 -27.171 -4.331 2.658 1.00 52.51 C ATOM 394 C LEU A 36 -27.676 -5.464 3.527 1.00 33.13 C ATOM 395 O LEU A 36 -28.881 -5.534 3.792 1.00 14.10 O ATOM 396 CB LEU A 36 -26.702 -4.783 1.227 1.00 11.05 C ATOM 397 CG LEU A 36 -25.248 -5.289 1.033 1.00 4.14 C ATOM 398 CD1 LEU A 36 -25.111 -5.967 -0.312 1.00 22.33 C ATOM 399 CD2 LEU A 36 -24.294 -4.117 1.038 1.00 13.10 C ATOM 0 H LEU A 36 -25.380 -3.932 3.670 1.00 41.21 H new ATOM 0 HA LEU A 36 -28.032 -3.699 2.441 1.00 52.51 H new ATOM 0 HB2 LEU A 36 -27.373 -5.577 0.897 1.00 11.05 H new ATOM 0 HB3 LEU A 36 -26.849 -3.940 0.552 1.00 11.05 H new ATOM 0 HG LEU A 36 -25.019 -5.983 1.842 1.00 4.14 H new ATOM 0 HD11 LEU A 36 -24.087 -6.319 -0.439 1.00 22.33 H new ATOM 0 HD12 LEU A 36 -25.795 -6.814 -0.364 1.00 22.33 H new ATOM 0 HD13 LEU A 36 -25.352 -5.257 -1.103 1.00 22.33 H new ATOM 0 HD21 LEU A 36 -23.274 -4.477 0.902 1.00 13.10 H new ATOM 0 HD22 LEU A 36 -24.550 -3.436 0.226 1.00 13.10 H new ATOM 0 HD23 LEU A 36 -24.369 -3.591 1.990 1.00 13.10 H new ATOM 411 N ASP A 37 -26.754 -6.318 3.996 1.00 5.44 N ATOM 412 CA ASP A 37 -27.045 -7.461 4.921 1.00 71.42 C ATOM 413 C ASP A 37 -25.911 -8.449 4.900 1.00 14.20 C ATOM 414 O ASP A 37 -25.391 -8.830 5.941 1.00 24.40 O ATOM 415 CB ASP A 37 -28.345 -8.227 4.601 1.00 42.34 C ATOM 416 CG ASP A 37 -28.578 -9.389 5.565 1.00 52.05 C ATOM 417 OD1 ASP A 37 -28.982 -9.149 6.725 1.00 11.42 O ATOM 418 OD2 ASP A 37 -28.366 -10.546 5.170 1.00 13.35 O ATOM 0 H ASP A 37 -25.767 -6.247 3.749 1.00 5.44 H new ATOM 0 HA ASP A 37 -27.168 -7.003 5.903 1.00 71.42 H new ATOM 0 HB2 ASP A 37 -29.191 -7.541 4.649 1.00 42.34 H new ATOM 0 HB3 ASP A 37 -28.300 -8.607 3.580 1.00 42.34 H new ATOM 423 N ARG A 38 -25.523 -8.856 3.709 1.00 63.03 N ATOM 424 CA ARG A 38 -24.483 -9.876 3.532 1.00 55.55 C ATOM 425 C ARG A 38 -23.301 -9.308 2.765 1.00 63.31 C ATOM 426 O ARG A 38 -23.463 -8.377 1.968 1.00 42.53 O ATOM 427 CB ARG A 38 -25.038 -11.113 2.787 1.00 53.34 C ATOM 428 CG ARG A 38 -26.134 -11.926 3.500 1.00 13.51 C ATOM 429 CD ARG A 38 -25.653 -12.586 4.804 1.00 41.12 C ATOM 430 NE ARG A 38 -25.328 -11.614 5.852 1.00 25.31 N ATOM 431 CZ ARG A 38 -24.587 -11.855 6.935 1.00 14.12 C ATOM 432 NH1 ARG A 38 -24.091 -13.065 7.159 1.00 63.52 N ATOM 433 NH2 ARG A 38 -24.353 -10.880 7.799 1.00 14.31 N ATOM 0 H ARG A 38 -25.910 -8.499 2.836 1.00 63.03 H new ATOM 0 HA ARG A 38 -24.152 -10.184 4.524 1.00 55.55 H new ATOM 0 HB2 ARG A 38 -25.433 -10.781 1.827 1.00 53.34 H new ATOM 0 HB3 ARG A 38 -24.204 -11.782 2.574 1.00 53.34 H new ATOM 0 HG2 ARG A 38 -26.976 -11.270 3.722 1.00 13.51 H new ATOM 0 HG3 ARG A 38 -26.501 -12.698 2.824 1.00 13.51 H new ATOM 0 HD2 ARG A 38 -26.427 -13.261 5.170 1.00 41.12 H new ATOM 0 HD3 ARG A 38 -24.773 -13.194 4.594 1.00 41.12 H new ATOM 0 HE ARG A 38 -25.701 -10.671 5.744 1.00 25.31 H new ATOM 0 HH11 ARG A 38 -24.275 -13.822 6.500 1.00 63.52 H new ATOM 0 HH12 ARG A 38 -23.526 -13.239 7.990 1.00 63.52 H new ATOM 0 HH21 ARG A 38 -24.739 -9.950 7.635 1.00 14.31 H new ATOM 0 HH22 ARG A 38 -23.787 -11.059 8.629 1.00 14.31 H new ATOM 447 N THR A 39 -22.121 -9.863 2.996 1.00 75.23 N ATOM 448 CA THR A 39 -20.923 -9.406 2.328 1.00 73.31 C ATOM 449 C THR A 39 -20.620 -10.269 1.081 1.00 45.45 C ATOM 450 O THR A 39 -20.440 -11.495 1.199 1.00 1.03 O ATOM 451 CB THR A 39 -19.701 -9.518 3.259 1.00 51.41 C ATOM 452 OG1 THR A 39 -20.035 -9.066 4.559 1.00 74.44 O ATOM 453 CG2 THR A 39 -18.576 -8.640 2.760 1.00 4.31 C ATOM 0 H THR A 39 -21.972 -10.635 3.646 1.00 75.23 H new ATOM 0 HA THR A 39 -21.099 -8.369 2.043 1.00 73.31 H new ATOM 0 HB THR A 39 -19.395 -10.564 3.277 1.00 51.41 H new ATOM 0 HG1 THR A 39 -20.970 -9.286 4.752 1.00 74.44 H new ATOM 0 HG21 THR A 39 -17.720 -8.730 3.429 1.00 4.31 H new ATOM 0 HG22 THR A 39 -18.287 -8.953 1.757 1.00 4.31 H new ATOM 0 HG23 THR A 39 -18.908 -7.602 2.734 1.00 4.31 H new ATOM 461 N PRO A 40 -20.574 -9.659 -0.117 1.00 11.54 N ATOM 462 CA PRO A 40 -20.132 -10.337 -1.333 1.00 41.54 C ATOM 463 C PRO A 40 -18.652 -10.651 -1.224 1.00 70.43 C ATOM 464 O PRO A 40 -17.933 -9.971 -0.470 1.00 15.45 O ATOM 465 CB PRO A 40 -20.363 -9.301 -2.441 1.00 71.42 C ATOM 466 CG PRO A 40 -21.296 -8.326 -1.852 1.00 44.12 C ATOM 467 CD PRO A 40 -20.959 -8.276 -0.397 1.00 43.01 C ATOM 0 HA PRO A 40 -20.657 -11.274 -1.516 1.00 41.54 H new ATOM 0 HB2 PRO A 40 -19.429 -8.825 -2.739 1.00 71.42 H new ATOM 0 HB3 PRO A 40 -20.784 -9.763 -3.334 1.00 71.42 H new ATOM 0 HG2 PRO A 40 -21.182 -7.346 -2.315 1.00 44.12 H new ATOM 0 HG3 PRO A 40 -22.331 -8.632 -2.004 1.00 44.12 H new ATOM 0 HD2 PRO A 40 -20.147 -7.579 -0.192 1.00 43.01 H new ATOM 0 HD3 PRO A 40 -21.810 -7.961 0.207 1.00 43.01 H new ATOM 475 N GLU A 41 -18.198 -11.687 -1.902 1.00 63.54 N ATOM 476 CA GLU A 41 -16.778 -12.028 -1.865 1.00 52.43 C ATOM 477 C GLU A 41 -15.948 -10.840 -2.337 1.00 25.03 C ATOM 478 O GLU A 41 -16.213 -10.251 -3.394 1.00 32.01 O ATOM 479 CB GLU A 41 -16.435 -13.271 -2.688 1.00 74.21 C ATOM 480 CG GLU A 41 -14.956 -13.641 -2.585 1.00 35.25 C ATOM 481 CD GLU A 41 -14.568 -14.836 -3.399 1.00 13.20 C ATOM 482 OE1 GLU A 41 -14.759 -15.973 -2.930 1.00 24.42 O ATOM 483 OE2 GLU A 41 -14.030 -14.665 -4.504 1.00 21.32 O ATOM 0 H GLU A 41 -18.775 -12.301 -2.477 1.00 63.54 H new ATOM 0 HA GLU A 41 -16.537 -12.266 -0.829 1.00 52.43 H new ATOM 0 HB2 GLU A 41 -17.042 -14.109 -2.347 1.00 74.21 H new ATOM 0 HB3 GLU A 41 -16.692 -13.095 -3.733 1.00 74.21 H new ATOM 0 HG2 GLU A 41 -14.356 -12.788 -2.902 1.00 35.25 H new ATOM 0 HG3 GLU A 41 -14.712 -13.832 -1.540 1.00 35.25 H new ATOM 490 N ILE A 42 -14.978 -10.491 -1.553 1.00 71.13 N ATOM 491 CA ILE A 42 -14.155 -9.355 -1.816 1.00 73.14 C ATOM 492 C ILE A 42 -12.768 -9.822 -2.194 1.00 33.32 C ATOM 493 O ILE A 42 -12.126 -10.583 -1.448 1.00 72.55 O ATOM 494 CB ILE A 42 -14.039 -8.454 -0.565 1.00 40.34 C ATOM 495 CG1 ILE A 42 -15.420 -8.076 -0.044 1.00 2.02 C ATOM 496 CG2 ILE A 42 -13.253 -7.206 -0.903 1.00 41.44 C ATOM 497 CD1 ILE A 42 -15.403 -7.229 1.215 1.00 4.24 C ATOM 0 H ILE A 42 -14.732 -10.994 -0.701 1.00 71.13 H new ATOM 0 HA ILE A 42 -14.609 -8.785 -2.627 1.00 73.14 H new ATOM 0 HB ILE A 42 -13.517 -9.008 0.215 1.00 40.34 H new ATOM 0 HG12 ILE A 42 -15.954 -7.535 -0.825 1.00 2.02 H new ATOM 0 HG13 ILE A 42 -15.983 -8.988 0.154 1.00 2.02 H new ATOM 0 HG21 ILE A 42 -13.174 -6.575 -0.018 1.00 41.44 H new ATOM 0 HG22 ILE A 42 -12.255 -7.485 -1.240 1.00 41.44 H new ATOM 0 HG23 ILE A 42 -13.763 -6.658 -1.695 1.00 41.44 H new ATOM 0 HD11 ILE A 42 -16.426 -7.005 1.517 1.00 4.24 H new ATOM 0 HD12 ILE A 42 -14.900 -7.774 2.014 1.00 4.24 H new ATOM 0 HD13 ILE A 42 -14.871 -6.298 1.020 1.00 4.24 H new ATOM 509 N VAL A 43 -12.318 -9.389 -3.321 1.00 63.23 N ATOM 510 CA VAL A 43 -10.994 -9.706 -3.773 1.00 71.33 C ATOM 511 C VAL A 43 -10.187 -8.425 -3.876 1.00 21.15 C ATOM 512 O VAL A 43 -10.737 -7.362 -4.160 1.00 31.21 O ATOM 513 CB VAL A 43 -10.989 -10.465 -5.137 1.00 24.51 C ATOM 514 CG1 VAL A 43 -11.570 -9.620 -6.256 1.00 12.44 C ATOM 515 CG2 VAL A 43 -9.587 -10.920 -5.489 1.00 74.40 C ATOM 0 H VAL A 43 -12.854 -8.803 -3.962 1.00 63.23 H new ATOM 0 HA VAL A 43 -10.543 -10.379 -3.044 1.00 71.33 H new ATOM 0 HB VAL A 43 -11.626 -11.342 -5.024 1.00 24.51 H new ATOM 0 HG11 VAL A 43 -11.548 -10.185 -7.188 1.00 12.44 H new ATOM 0 HG12 VAL A 43 -12.600 -9.356 -6.016 1.00 12.44 H new ATOM 0 HG13 VAL A 43 -10.980 -8.711 -6.369 1.00 12.44 H new ATOM 0 HG21 VAL A 43 -9.604 -11.447 -6.443 1.00 74.40 H new ATOM 0 HG22 VAL A 43 -8.931 -10.053 -5.565 1.00 74.40 H new ATOM 0 HG23 VAL A 43 -9.215 -11.588 -4.712 1.00 74.40 H new ATOM 525 N SER A 44 -8.923 -8.507 -3.611 1.00 13.31 N ATOM 526 CA SER A 44 -8.072 -7.366 -3.710 1.00 22.13 C ATOM 527 C SER A 44 -7.668 -7.152 -5.168 1.00 65.12 C ATOM 528 O SER A 44 -7.135 -8.063 -5.826 1.00 63.12 O ATOM 529 CB SER A 44 -6.864 -7.589 -2.852 1.00 21.20 C ATOM 530 OG SER A 44 -7.252 -7.866 -1.508 1.00 55.05 O ATOM 0 H SER A 44 -8.453 -9.364 -3.321 1.00 13.31 H new ATOM 0 HA SER A 44 -8.595 -6.474 -3.366 1.00 22.13 H new ATOM 0 HB2 SER A 44 -6.278 -8.419 -3.246 1.00 21.20 H new ATOM 0 HB3 SER A 44 -6.224 -6.707 -2.878 1.00 21.20 H new ATOM 0 HG SER A 44 -6.453 -8.011 -0.960 1.00 55.05 H new ATOM 536 N ALA A 45 -7.934 -5.979 -5.672 1.00 74.41 N ATOM 537 CA ALA A 45 -7.631 -5.653 -7.039 1.00 61.35 C ATOM 538 C ALA A 45 -7.166 -4.230 -7.167 1.00 52.32 C ATOM 539 O ALA A 45 -7.417 -3.399 -6.299 1.00 73.22 O ATOM 540 CB ALA A 45 -8.833 -5.885 -7.913 1.00 32.03 C ATOM 0 H ALA A 45 -8.368 -5.220 -5.146 1.00 74.41 H new ATOM 0 HA ALA A 45 -6.823 -6.306 -7.367 1.00 61.35 H new ATOM 0 HB1 ALA A 45 -8.587 -5.633 -8.945 1.00 32.03 H new ATOM 0 HB2 ALA A 45 -9.128 -6.933 -7.855 1.00 32.03 H new ATOM 0 HB3 ALA A 45 -9.657 -5.257 -7.573 1.00 32.03 H new ATOM 546 N THR A 46 -6.497 -3.965 -8.229 1.00 72.22 N ATOM 547 CA THR A 46 -5.972 -2.675 -8.508 1.00 34.03 C ATOM 548 C THR A 46 -6.605 -2.095 -9.756 1.00 41.13 C ATOM 549 O THR A 46 -6.719 -2.766 -10.773 1.00 32.21 O ATOM 550 CB THR A 46 -4.450 -2.757 -8.671 1.00 32.22 C ATOM 551 OG1 THR A 46 -3.898 -3.241 -7.455 1.00 4.32 O ATOM 552 CG2 THR A 46 -3.842 -1.398 -8.991 1.00 63.22 C ATOM 0 H THR A 46 -6.293 -4.657 -8.950 1.00 72.22 H new ATOM 0 HA THR A 46 -6.206 -2.016 -7.672 1.00 34.03 H new ATOM 0 HB THR A 46 -4.224 -3.425 -9.502 1.00 32.22 H new ATOM 0 HG1 THR A 46 -3.300 -3.994 -7.644 1.00 4.32 H new ATOM 0 HG21 THR A 46 -2.762 -1.499 -9.099 1.00 63.22 H new ATOM 0 HG22 THR A 46 -4.266 -1.020 -9.921 1.00 63.22 H new ATOM 0 HG23 THR A 46 -4.062 -0.701 -8.182 1.00 63.22 H new ATOM 560 N LEU A 47 -7.036 -0.876 -9.643 1.00 73.41 N ATOM 561 CA LEU A 47 -7.622 -0.132 -10.716 1.00 52.23 C ATOM 562 C LEU A 47 -6.582 0.810 -11.330 1.00 22.40 C ATOM 563 O LEU A 47 -6.284 1.859 -10.766 1.00 61.22 O ATOM 564 CB LEU A 47 -8.826 0.664 -10.178 1.00 12.23 C ATOM 565 CG LEU A 47 -9.484 1.645 -11.131 1.00 51.33 C ATOM 566 CD1 LEU A 47 -9.922 0.958 -12.396 1.00 63.05 C ATOM 567 CD2 LEU A 47 -10.665 2.322 -10.464 1.00 40.05 C ATOM 0 H LEU A 47 -6.988 -0.353 -8.769 1.00 73.41 H new ATOM 0 HA LEU A 47 -7.964 -0.814 -11.494 1.00 52.23 H new ATOM 0 HB2 LEU A 47 -9.583 -0.048 -9.848 1.00 12.23 H new ATOM 0 HB3 LEU A 47 -8.501 1.215 -9.296 1.00 12.23 H new ATOM 0 HG LEU A 47 -8.747 2.404 -11.394 1.00 51.33 H new ATOM 0 HD11 LEU A 47 -10.390 1.684 -13.061 1.00 63.05 H new ATOM 0 HD12 LEU A 47 -9.055 0.519 -12.890 1.00 63.05 H new ATOM 0 HD13 LEU A 47 -10.638 0.173 -12.154 1.00 63.05 H new ATOM 0 HD21 LEU A 47 -11.125 3.022 -11.162 1.00 40.05 H new ATOM 0 HD22 LEU A 47 -11.397 1.570 -10.169 1.00 40.05 H new ATOM 0 HD23 LEU A 47 -10.324 2.862 -9.581 1.00 40.05 H new ATOM 579 N PRO A 48 -5.980 0.434 -12.461 1.00 71.41 N ATOM 580 CA PRO A 48 -4.993 1.263 -13.121 1.00 61.32 C ATOM 581 C PRO A 48 -5.646 2.398 -13.913 1.00 63.13 C ATOM 582 O PRO A 48 -6.731 2.225 -14.498 1.00 13.34 O ATOM 583 CB PRO A 48 -4.271 0.291 -14.054 1.00 73.52 C ATOM 584 CG PRO A 48 -5.279 -0.761 -14.368 1.00 73.35 C ATOM 585 CD PRO A 48 -6.208 -0.838 -13.182 1.00 13.01 C ATOM 0 HA PRO A 48 -4.324 1.754 -12.414 1.00 61.32 H new ATOM 0 HB2 PRO A 48 -3.929 0.793 -14.959 1.00 73.52 H new ATOM 0 HB3 PRO A 48 -3.390 -0.136 -13.574 1.00 73.52 H new ATOM 0 HG2 PRO A 48 -5.829 -0.511 -15.275 1.00 73.35 H new ATOM 0 HG3 PRO A 48 -4.794 -1.722 -14.543 1.00 73.35 H new ATOM 0 HD2 PRO A 48 -7.247 -0.938 -13.496 1.00 13.01 H new ATOM 0 HD3 PRO A 48 -5.981 -1.699 -12.553 1.00 13.01 H new ATOM 593 N GLY A 49 -5.007 3.544 -13.912 1.00 34.41 N ATOM 594 CA GLY A 49 -5.500 4.684 -14.646 1.00 4.31 C ATOM 595 C GLY A 49 -6.287 5.632 -13.772 1.00 63.50 C ATOM 596 O GLY A 49 -6.852 6.612 -14.258 1.00 35.25 O ATOM 0 H GLY A 49 -4.137 3.711 -13.406 1.00 34.41 H new ATOM 0 HA2 GLY A 49 -4.660 5.217 -15.092 1.00 4.31 H new ATOM 0 HA3 GLY A 49 -6.131 4.340 -15.466 1.00 4.31 H new ATOM 600 N PHE A 50 -6.322 5.352 -12.482 1.00 65.35 N ATOM 601 CA PHE A 50 -7.077 6.158 -11.528 1.00 41.25 C ATOM 602 C PHE A 50 -6.258 6.402 -10.277 1.00 62.05 C ATOM 603 O PHE A 50 -5.222 5.799 -10.099 1.00 25.13 O ATOM 604 CB PHE A 50 -8.428 5.487 -11.177 1.00 13.41 C ATOM 605 CG PHE A 50 -9.411 5.443 -12.327 1.00 41.30 C ATOM 606 CD1 PHE A 50 -9.350 4.448 -13.290 1.00 55.44 C ATOM 607 CD2 PHE A 50 -10.381 6.417 -12.445 1.00 63.21 C ATOM 608 CE1 PHE A 50 -10.240 4.426 -14.343 1.00 52.10 C ATOM 609 CE2 PHE A 50 -11.271 6.407 -13.496 1.00 1.13 C ATOM 610 CZ PHE A 50 -11.203 5.411 -14.446 1.00 72.21 C ATOM 0 H PHE A 50 -5.831 4.563 -12.063 1.00 65.35 H new ATOM 0 HA PHE A 50 -7.294 7.120 -11.993 1.00 41.25 H new ATOM 0 HB2 PHE A 50 -8.239 4.469 -10.835 1.00 13.41 H new ATOM 0 HB3 PHE A 50 -8.883 6.023 -10.344 1.00 13.41 H new ATOM 0 HD1 PHE A 50 -8.595 3.679 -13.215 1.00 55.44 H new ATOM 0 HD2 PHE A 50 -10.443 7.199 -11.702 1.00 63.21 H new ATOM 0 HE1 PHE A 50 -10.184 3.642 -15.084 1.00 52.10 H new ATOM 0 HE2 PHE A 50 -12.022 7.179 -13.576 1.00 1.13 H new ATOM 0 HZ PHE A 50 -11.901 5.401 -15.270 1.00 72.21 H new ATOM 620 N GLN A 51 -6.715 7.290 -9.432 1.00 2.21 N ATOM 621 CA GLN A 51 -6.043 7.609 -8.195 1.00 25.21 C ATOM 622 C GLN A 51 -7.065 7.788 -7.113 1.00 41.22 C ATOM 623 O GLN A 51 -8.266 7.944 -7.393 1.00 20.11 O ATOM 624 CB GLN A 51 -5.187 8.844 -8.352 1.00 71.32 C ATOM 625 CG GLN A 51 -5.963 10.029 -8.789 1.00 43.30 C ATOM 626 CD GLN A 51 -5.089 11.227 -9.150 1.00 43.22 C ATOM 627 OE1 GLN A 51 -5.451 12.032 -10.008 1.00 63.24 O ATOM 628 NE2 GLN A 51 -3.950 11.370 -8.501 1.00 63.13 N ATOM 0 H GLN A 51 -7.574 7.819 -9.584 1.00 2.21 H new ATOM 0 HA GLN A 51 -5.378 6.790 -7.921 1.00 25.21 H new ATOM 0 HB2 GLN A 51 -4.699 9.065 -7.403 1.00 71.32 H new ATOM 0 HB3 GLN A 51 -4.398 8.644 -9.077 1.00 71.32 H new ATOM 0 HG2 GLN A 51 -6.570 9.758 -9.653 1.00 43.30 H new ATOM 0 HG3 GLN A 51 -6.651 10.317 -7.994 1.00 43.30 H new ATOM 0 HE21 GLN A 51 -3.676 10.687 -7.795 1.00 63.13 H new ATOM 0 HE22 GLN A 51 -3.343 12.164 -8.705 1.00 63.13 H new ATOM 637 N ARG A 52 -6.606 7.771 -5.911 1.00 23.35 N ATOM 638 CA ARG A 52 -7.470 7.774 -4.755 1.00 65.02 C ATOM 639 C ARG A 52 -7.034 8.820 -3.770 1.00 43.42 C ATOM 640 O ARG A 52 -5.878 8.858 -3.360 1.00 11.51 O ATOM 641 CB ARG A 52 -7.443 6.380 -4.106 1.00 51.44 C ATOM 642 CG ARG A 52 -8.244 6.221 -2.813 1.00 71.44 C ATOM 643 CD ARG A 52 -8.138 4.786 -2.305 1.00 64.23 C ATOM 644 NE ARG A 52 -8.790 4.569 -1.005 1.00 31.03 N ATOM 645 CZ ARG A 52 -8.929 3.363 -0.410 1.00 34.32 C ATOM 646 NH1 ARG A 52 -8.531 2.249 -1.030 1.00 54.54 N ATOM 647 NH2 ARG A 52 -9.462 3.280 0.790 1.00 35.41 N ATOM 0 H ARG A 52 -5.611 7.754 -5.687 1.00 23.35 H new ATOM 0 HA ARG A 52 -8.487 8.012 -5.066 1.00 65.02 H new ATOM 0 HB2 ARG A 52 -7.817 5.657 -4.831 1.00 51.44 H new ATOM 0 HB3 ARG A 52 -6.405 6.118 -3.900 1.00 51.44 H new ATOM 0 HG2 ARG A 52 -7.870 6.911 -2.057 1.00 71.44 H new ATOM 0 HG3 ARG A 52 -9.289 6.477 -2.989 1.00 71.44 H new ATOM 0 HD2 ARG A 52 -8.583 4.116 -3.041 1.00 64.23 H new ATOM 0 HD3 ARG A 52 -7.085 4.516 -2.223 1.00 64.23 H new ATOM 0 HE ARG A 52 -9.163 5.384 -0.519 1.00 31.03 H new ATOM 0 HH11 ARG A 52 -8.118 2.303 -1.961 1.00 54.54 H new ATOM 0 HH12 ARG A 52 -8.640 1.344 -0.573 1.00 54.54 H new ATOM 0 HH21 ARG A 52 -9.770 4.125 1.271 1.00 35.41 H new ATOM 0 HH22 ARG A 52 -9.567 2.370 1.240 1.00 35.41 H new ATOM 661 N PHE A 53 -7.946 9.655 -3.401 1.00 74.51 N ATOM 662 CA PHE A 53 -7.692 10.674 -2.430 1.00 43.30 C ATOM 663 C PHE A 53 -8.511 10.424 -1.213 1.00 13.55 C ATOM 664 O PHE A 53 -9.445 9.631 -1.248 1.00 12.22 O ATOM 665 CB PHE A 53 -7.947 12.071 -3.002 1.00 30.40 C ATOM 666 CG PHE A 53 -6.910 12.485 -4.000 1.00 61.21 C ATOM 667 CD1 PHE A 53 -6.872 11.924 -5.265 1.00 31.25 C ATOM 668 CD2 PHE A 53 -5.958 13.428 -3.661 1.00 10.41 C ATOM 669 CE1 PHE A 53 -5.911 12.297 -6.158 1.00 60.54 C ATOM 670 CE2 PHE A 53 -4.992 13.806 -4.562 1.00 44.12 C ATOM 671 CZ PHE A 53 -4.966 13.240 -5.814 1.00 3.15 C ATOM 0 H PHE A 53 -8.898 9.652 -3.766 1.00 74.51 H new ATOM 0 HA PHE A 53 -6.638 10.636 -2.154 1.00 43.30 H new ATOM 0 HB2 PHE A 53 -8.929 12.092 -3.475 1.00 30.40 H new ATOM 0 HB3 PHE A 53 -7.970 12.794 -2.187 1.00 30.40 H new ATOM 0 HD1 PHE A 53 -7.608 11.186 -5.547 1.00 31.25 H new ATOM 0 HD2 PHE A 53 -5.974 13.873 -2.677 1.00 10.41 H new ATOM 0 HE1 PHE A 53 -5.890 11.851 -7.141 1.00 60.54 H new ATOM 0 HE2 PHE A 53 -4.255 14.546 -4.287 1.00 44.12 H new ATOM 0 HZ PHE A 53 -4.208 13.533 -6.526 1.00 3.15 H new ATOM 681 N ARG A 54 -8.156 11.062 -0.145 1.00 31.44 N ATOM 682 CA ARG A 54 -8.844 10.904 1.099 1.00 13.30 C ATOM 683 C ARG A 54 -8.982 12.227 1.821 1.00 33.40 C ATOM 684 O ARG A 54 -7.996 12.903 2.094 1.00 14.32 O ATOM 685 CB ARG A 54 -8.128 9.859 1.971 1.00 13.14 C ATOM 686 CG ARG A 54 -6.614 9.986 1.984 1.00 34.43 C ATOM 687 CD ARG A 54 -6.047 9.950 3.381 1.00 3.15 C ATOM 688 NE ARG A 54 -6.387 11.179 4.123 1.00 43.31 N ATOM 689 CZ ARG A 54 -5.642 11.726 5.091 1.00 20.31 C ATOM 690 NH1 ARG A 54 -4.531 11.127 5.496 1.00 0.33 N ATOM 691 NH2 ARG A 54 -6.009 12.875 5.648 1.00 53.13 N ATOM 0 H ARG A 54 -7.373 11.714 -0.109 1.00 31.44 H new ATOM 0 HA ARG A 54 -9.852 10.544 0.894 1.00 13.30 H new ATOM 0 HB2 ARG A 54 -8.497 9.942 2.993 1.00 13.14 H new ATOM 0 HB3 ARG A 54 -8.394 8.863 1.616 1.00 13.14 H new ATOM 0 HG2 ARG A 54 -6.179 9.177 1.397 1.00 34.43 H new ATOM 0 HG3 ARG A 54 -6.326 10.920 1.502 1.00 34.43 H new ATOM 0 HD2 ARG A 54 -6.436 9.081 3.912 1.00 3.15 H new ATOM 0 HD3 ARG A 54 -4.964 9.837 3.335 1.00 3.15 H new ATOM 0 HE ARG A 54 -7.259 11.649 3.879 1.00 43.31 H new ATOM 0 HH11 ARG A 54 -4.242 10.247 5.070 1.00 0.33 H new ATOM 0 HH12 ARG A 54 -3.965 11.546 6.234 1.00 0.33 H new ATOM 0 HH21 ARG A 54 -6.861 13.343 5.338 1.00 53.13 H new ATOM 0 HH22 ARG A 54 -5.439 13.289 6.386 1.00 53.13 H new ATOM 796 N TYR A 60 -14.995 13.284 0.414 1.00 32.00 N ATOM 797 CA TYR A 60 -14.750 12.002 1.002 1.00 72.34 C ATOM 798 C TYR A 60 -13.563 11.413 0.289 1.00 45.21 C ATOM 799 O TYR A 60 -13.037 12.052 -0.621 1.00 2.32 O ATOM 800 CB TYR A 60 -15.971 11.113 0.672 1.00 63.43 C ATOM 801 CG TYR A 60 -17.307 11.782 0.867 1.00 43.31 C ATOM 802 CD1 TYR A 60 -17.899 12.491 -0.180 1.00 2.55 C ATOM 803 CD2 TYR A 60 -17.975 11.716 2.070 1.00 71.44 C ATOM 804 CE1 TYR A 60 -19.114 13.105 -0.016 1.00 60.35 C ATOM 805 CE2 TYR A 60 -19.195 12.329 2.239 1.00 12.04 C ATOM 806 CZ TYR A 60 -19.759 13.018 1.193 1.00 74.24 C ATOM 807 OH TYR A 60 -20.972 13.625 1.358 1.00 23.23 O ATOM 0 HA TYR A 60 -14.582 12.071 2.077 1.00 72.34 H new ATOM 0 HB2 TYR A 60 -15.893 10.782 -0.364 1.00 63.43 H new ATOM 0 HB3 TYR A 60 -15.932 10.220 1.296 1.00 63.43 H new ATOM 0 HD1 TYR A 60 -17.393 12.557 -1.132 1.00 2.55 H new ATOM 0 HD2 TYR A 60 -17.534 11.174 2.894 1.00 71.44 H new ATOM 0 HE1 TYR A 60 -19.561 13.653 -0.832 1.00 60.35 H new ATOM 0 HE2 TYR A 60 -19.706 12.269 3.188 1.00 12.04 H new ATOM 0 HH TYR A 60 -21.602 13.283 0.690 1.00 23.23 H new ATOM 817 N PRO A 61 -13.076 10.223 0.693 1.00 53.40 N ATOM 818 CA PRO A 61 -12.134 9.488 -0.123 1.00 64.13 C ATOM 819 C PRO A 61 -12.802 9.203 -1.460 1.00 31.32 C ATOM 820 O PRO A 61 -13.865 8.594 -1.500 1.00 50.15 O ATOM 821 CB PRO A 61 -11.895 8.179 0.659 1.00 23.34 C ATOM 822 CG PRO A 61 -13.002 8.116 1.658 1.00 71.22 C ATOM 823 CD PRO A 61 -13.348 9.535 1.969 1.00 61.11 C ATOM 0 HA PRO A 61 -11.199 10.015 -0.315 1.00 64.13 H new ATOM 0 HB2 PRO A 61 -11.913 7.314 -0.005 1.00 23.34 H new ATOM 0 HB3 PRO A 61 -10.921 8.185 1.149 1.00 23.34 H new ATOM 0 HG2 PRO A 61 -13.863 7.583 1.255 1.00 71.22 H new ATOM 0 HG3 PRO A 61 -12.689 7.584 2.556 1.00 71.22 H new ATOM 0 HD2 PRO A 61 -14.390 9.641 2.272 1.00 61.11 H new ATOM 0 HD3 PRO A 61 -12.738 9.932 2.781 1.00 61.11 H new ATOM 831 N CYS A 62 -12.215 9.669 -2.522 1.00 44.20 N ATOM 832 CA CYS A 62 -12.826 9.566 -3.817 1.00 60.13 C ATOM 833 C CYS A 62 -11.832 9.052 -4.855 1.00 73.13 C ATOM 834 O CYS A 62 -10.603 9.092 -4.642 1.00 50.42 O ATOM 835 CB CYS A 62 -13.395 10.941 -4.209 1.00 23.33 C ATOM 836 SG CYS A 62 -12.164 12.267 -4.233 1.00 40.54 S ATOM 0 H CYS A 62 -11.305 10.129 -2.518 1.00 44.20 H new ATOM 0 HA CYS A 62 -13.640 8.842 -3.779 1.00 60.13 H new ATOM 0 HB2 CYS A 62 -13.852 10.866 -5.196 1.00 23.33 H new ATOM 0 HB3 CYS A 62 -14.188 11.208 -3.510 1.00 23.33 H new ATOM 0 HG CYS A 62 -12.735 13.383 -4.575 1.00 40.54 H new ATOM 842 N ILE A 63 -12.363 8.542 -5.952 1.00 14.12 N ATOM 843 CA ILE A 63 -11.565 8.032 -7.048 1.00 4.34 C ATOM 844 C ILE A 63 -11.718 8.964 -8.222 1.00 34.23 C ATOM 845 O ILE A 63 -12.811 9.447 -8.479 1.00 24.11 O ATOM 846 CB ILE A 63 -12.050 6.607 -7.490 1.00 72.24 C ATOM 847 CG1 ILE A 63 -11.978 5.617 -6.332 1.00 11.41 C ATOM 848 CG2 ILE A 63 -11.261 6.081 -8.691 1.00 1.03 C ATOM 849 CD1 ILE A 63 -10.592 5.434 -5.760 1.00 52.43 C ATOM 0 H ILE A 63 -13.369 8.470 -6.107 1.00 14.12 H new ATOM 0 HA ILE A 63 -10.528 7.965 -6.720 1.00 4.34 H new ATOM 0 HB ILE A 63 -13.091 6.708 -7.796 1.00 72.24 H new ATOM 0 HG12 ILE A 63 -12.645 5.954 -5.538 1.00 11.41 H new ATOM 0 HG13 ILE A 63 -12.350 4.650 -6.671 1.00 11.41 H new ATOM 0 HG21 ILE A 63 -11.629 5.092 -8.964 1.00 1.03 H new ATOM 0 HG22 ILE A 63 -11.386 6.760 -9.534 1.00 1.03 H new ATOM 0 HG23 ILE A 63 -10.204 6.016 -8.432 1.00 1.03 H new ATOM 0 HD11 ILE A 63 -10.628 4.715 -4.942 1.00 52.43 H new ATOM 0 HD12 ILE A 63 -9.923 5.066 -6.538 1.00 52.43 H new ATOM 0 HD13 ILE A 63 -10.223 6.390 -5.387 1.00 52.43 H new ATOM 861 N VAL A 64 -10.639 9.242 -8.898 1.00 14.23 N ATOM 862 CA VAL A 64 -10.660 10.043 -10.113 1.00 45.31 C ATOM 863 C VAL A 64 -9.581 9.513 -11.050 1.00 51.22 C ATOM 864 O VAL A 64 -8.606 8.919 -10.584 1.00 70.25 O ATOM 865 CB VAL A 64 -10.401 11.580 -9.852 1.00 24.31 C ATOM 866 CG1 VAL A 64 -11.510 12.214 -9.047 1.00 40.32 C ATOM 867 CG2 VAL A 64 -9.061 11.809 -9.165 1.00 54.21 C ATOM 0 H VAL A 64 -9.709 8.922 -8.629 1.00 14.23 H new ATOM 0 HA VAL A 64 -11.657 9.959 -10.546 1.00 45.31 H new ATOM 0 HB VAL A 64 -10.379 12.060 -10.830 1.00 24.31 H new ATOM 0 HG11 VAL A 64 -11.289 13.270 -8.892 1.00 40.32 H new ATOM 0 HG12 VAL A 64 -12.453 12.115 -9.585 1.00 40.32 H new ATOM 0 HG13 VAL A 64 -11.590 11.715 -8.081 1.00 40.32 H new ATOM 0 HG21 VAL A 64 -8.914 12.876 -9.000 1.00 54.21 H new ATOM 0 HG22 VAL A 64 -9.050 11.289 -8.207 1.00 54.21 H new ATOM 0 HG23 VAL A 64 -8.259 11.426 -9.795 1.00 54.21 H new ATOM 877 N PRO A 65 -9.759 9.666 -12.364 1.00 14.43 N ATOM 878 CA PRO A 65 -8.760 9.243 -13.353 1.00 10.32 C ATOM 879 C PRO A 65 -7.394 9.929 -13.148 1.00 42.03 C ATOM 880 O PRO A 65 -7.313 11.150 -12.943 1.00 64.33 O ATOM 881 CB PRO A 65 -9.377 9.644 -14.701 1.00 72.20 C ATOM 882 CG PRO A 65 -10.512 10.554 -14.376 1.00 51.23 C ATOM 883 CD PRO A 65 -10.962 10.215 -12.993 1.00 22.20 C ATOM 0 HA PRO A 65 -8.549 8.176 -13.277 1.00 10.32 H new ATOM 0 HB2 PRO A 65 -8.643 10.145 -15.333 1.00 72.20 H new ATOM 0 HB3 PRO A 65 -9.724 8.767 -15.248 1.00 72.20 H new ATOM 0 HG2 PRO A 65 -10.199 11.597 -14.435 1.00 51.23 H new ATOM 0 HG3 PRO A 65 -11.326 10.425 -15.089 1.00 51.23 H new ATOM 0 HD2 PRO A 65 -11.326 11.095 -12.463 1.00 22.20 H new ATOM 0 HD3 PRO A 65 -11.776 9.490 -13.003 1.00 22.20 H new ATOM 891 N SER A 66 -6.340 9.146 -13.216 1.00 31.33 N ATOM 892 CA SER A 66 -4.998 9.629 -12.999 1.00 14.10 C ATOM 893 C SER A 66 -4.180 9.369 -14.246 1.00 52.10 C ATOM 894 O SER A 66 -4.415 8.379 -14.953 1.00 22.15 O ATOM 895 CB SER A 66 -4.369 8.916 -11.789 1.00 53.41 C ATOM 896 OG SER A 66 -3.077 9.439 -11.448 1.00 14.01 O ATOM 0 H SER A 66 -6.393 8.149 -13.425 1.00 31.33 H new ATOM 0 HA SER A 66 -5.019 10.699 -12.792 1.00 14.10 H new ATOM 0 HB2 SER A 66 -5.033 9.012 -10.930 1.00 53.41 H new ATOM 0 HB3 SER A 66 -4.280 7.851 -12.006 1.00 53.41 H new ATOM 0 HG SER A 66 -2.792 9.070 -10.586 1.00 14.01 H new ATOM 902 N GLU A 67 -3.241 10.245 -14.520 1.00 72.40 N ATOM 903 CA GLU A 67 -2.418 10.126 -15.705 1.00 32.02 C ATOM 904 C GLU A 67 -1.435 8.980 -15.550 1.00 64.54 C ATOM 905 O GLU A 67 -1.175 8.250 -16.494 1.00 34.12 O ATOM 906 CB GLU A 67 -1.698 11.434 -15.954 1.00 15.21 C ATOM 907 CG GLU A 67 -2.632 12.624 -16.032 1.00 11.31 C ATOM 908 CD GLU A 67 -1.904 13.926 -16.187 1.00 40.23 C ATOM 909 OE1 GLU A 67 -1.392 14.457 -15.178 1.00 73.32 O ATOM 910 OE2 GLU A 67 -1.837 14.455 -17.304 1.00 72.15 O ATOM 0 H GLU A 67 -3.026 11.053 -13.936 1.00 72.40 H new ATOM 0 HA GLU A 67 -3.050 9.908 -16.566 1.00 32.02 H new ATOM 0 HB2 GLU A 67 -0.974 11.600 -15.156 1.00 15.21 H new ATOM 0 HB3 GLU A 67 -1.136 11.360 -16.885 1.00 15.21 H new ATOM 0 HG2 GLU A 67 -3.312 12.491 -16.873 1.00 11.31 H new ATOM 0 HG3 GLU A 67 -3.243 12.660 -15.130 1.00 11.31 H new ATOM 917 N LYS A 68 -0.920 8.818 -14.358 1.00 0.44 N ATOM 918 CA LYS A 68 -0.081 7.693 -14.036 1.00 62.14 C ATOM 919 C LYS A 68 -0.382 7.254 -12.646 1.00 41.21 C ATOM 920 O LYS A 68 0.330 7.595 -11.701 1.00 3.53 O ATOM 921 CB LYS A 68 1.422 7.956 -14.179 1.00 3.42 C ATOM 922 CG LYS A 68 1.887 8.321 -15.575 1.00 72.12 C ATOM 923 CD LYS A 68 3.397 8.308 -15.664 1.00 30.43 C ATOM 924 CE LYS A 68 4.047 9.262 -14.674 1.00 65.23 C ATOM 925 NZ LYS A 68 5.522 9.210 -14.750 1.00 45.33 N ATOM 0 H LYS A 68 -1.071 9.463 -13.583 1.00 0.44 H new ATOM 0 HA LYS A 68 -0.312 6.916 -14.765 1.00 62.14 H new ATOM 0 HB2 LYS A 68 1.699 8.762 -13.499 1.00 3.42 H new ATOM 0 HB3 LYS A 68 1.962 7.066 -13.855 1.00 3.42 H new ATOM 0 HG2 LYS A 68 1.471 7.618 -16.296 1.00 72.12 H new ATOM 0 HG3 LYS A 68 1.512 9.309 -15.840 1.00 72.12 H new ATOM 0 HD2 LYS A 68 3.760 7.297 -15.481 1.00 30.43 H new ATOM 0 HD3 LYS A 68 3.700 8.577 -16.676 1.00 30.43 H new ATOM 0 HE2 LYS A 68 3.708 10.279 -14.873 1.00 65.23 H new ATOM 0 HE3 LYS A 68 3.726 9.011 -13.663 1.00 65.23 H new ATOM 0 HZ1 LYS A 68 5.929 9.874 -14.060 1.00 45.33 H new ATOM 0 HZ2 LYS A 68 5.847 8.246 -14.535 1.00 45.33 H new ATOM 0 HZ3 LYS A 68 5.830 9.474 -15.708 1.00 45.33 H new ATOM 939 N GLY A 69 -1.478 6.596 -12.497 1.00 53.24 N ATOM 940 CA GLY A 69 -1.846 6.123 -11.197 1.00 51.21 C ATOM 941 C GLY A 69 -2.599 4.838 -11.245 1.00 25.22 C ATOM 942 O GLY A 69 -3.034 4.401 -12.315 1.00 43.43 O ATOM 0 H GLY A 69 -2.133 6.372 -13.246 1.00 53.24 H new ATOM 0 HA2 GLY A 69 -0.947 5.990 -10.595 1.00 51.21 H new ATOM 0 HA3 GLY A 69 -2.455 6.878 -10.699 1.00 51.21 H new ATOM 946 N GLU A 70 -2.760 4.241 -10.100 1.00 61.13 N ATOM 947 CA GLU A 70 -3.480 3.017 -9.946 1.00 55.53 C ATOM 948 C GLU A 70 -4.009 2.940 -8.522 1.00 5.11 C ATOM 949 O GLU A 70 -3.336 3.336 -7.584 1.00 42.12 O ATOM 950 CB GLU A 70 -2.582 1.819 -10.283 1.00 64.32 C ATOM 951 CG GLU A 70 -1.293 1.769 -9.478 1.00 13.33 C ATOM 952 CD GLU A 70 -0.428 0.607 -9.834 1.00 10.20 C ATOM 953 OE1 GLU A 70 0.246 0.650 -10.865 1.00 32.40 O ATOM 954 OE2 GLU A 70 -0.393 -0.367 -9.062 1.00 61.33 O ATOM 0 H GLU A 70 -2.382 4.605 -9.225 1.00 61.13 H new ATOM 0 HA GLU A 70 -4.322 2.988 -10.637 1.00 55.53 H new ATOM 0 HB2 GLU A 70 -3.141 0.899 -10.112 1.00 64.32 H new ATOM 0 HB3 GLU A 70 -2.335 1.850 -11.344 1.00 64.32 H new ATOM 0 HG2 GLU A 70 -0.736 2.692 -9.637 1.00 13.33 H new ATOM 0 HG3 GLU A 70 -1.536 1.722 -8.416 1.00 13.33 H new ATOM 961 N VAL A 71 -5.189 2.441 -8.354 1.00 1.13 N ATOM 962 CA VAL A 71 -5.779 2.387 -7.048 1.00 64.33 C ATOM 963 C VAL A 71 -5.889 0.964 -6.615 1.00 24.43 C ATOM 964 O VAL A 71 -6.546 0.170 -7.254 1.00 4.11 O ATOM 965 CB VAL A 71 -7.205 3.005 -7.028 1.00 55.53 C ATOM 966 CG1 VAL A 71 -7.783 2.982 -5.618 1.00 51.22 C ATOM 967 CG2 VAL A 71 -7.193 4.415 -7.574 1.00 23.43 C ATOM 0 H VAL A 71 -5.768 2.063 -9.103 1.00 1.13 H new ATOM 0 HA VAL A 71 -5.139 2.960 -6.377 1.00 64.33 H new ATOM 0 HB VAL A 71 -7.842 2.398 -7.671 1.00 55.53 H new ATOM 0 HG11 VAL A 71 -8.781 3.419 -5.627 1.00 51.22 H new ATOM 0 HG12 VAL A 71 -7.841 1.952 -5.265 1.00 51.22 H new ATOM 0 HG13 VAL A 71 -7.141 3.558 -4.952 1.00 51.22 H new ATOM 0 HG21 VAL A 71 -8.203 4.824 -7.549 1.00 23.43 H new ATOM 0 HG22 VAL A 71 -6.535 5.035 -6.965 1.00 23.43 H new ATOM 0 HG23 VAL A 71 -6.832 4.404 -8.602 1.00 23.43 H new ATOM 977 N HIS A 72 -5.241 0.643 -5.542 1.00 21.05 N ATOM 978 CA HIS A 72 -5.325 -0.685 -5.004 1.00 65.45 C ATOM 979 C HIS A 72 -6.482 -0.697 -4.042 1.00 3.41 C ATOM 980 O HIS A 72 -6.471 0.030 -3.042 1.00 3.25 O ATOM 981 CB HIS A 72 -4.010 -1.086 -4.298 1.00 14.14 C ATOM 982 CG HIS A 72 -2.807 -1.135 -5.203 1.00 4.22 C ATOM 983 ND1 HIS A 72 -2.090 -2.279 -5.460 1.00 3.10 N ATOM 984 CD2 HIS A 72 -2.195 -0.159 -5.915 1.00 13.55 C ATOM 985 CE1 HIS A 72 -1.108 -2.005 -6.277 1.00 64.25 C ATOM 986 NE2 HIS A 72 -1.150 -0.732 -6.569 1.00 51.14 N ATOM 0 H HIS A 72 -4.644 1.282 -5.016 1.00 21.05 H new ATOM 0 HA HIS A 72 -5.480 -1.412 -5.801 1.00 65.45 H new ATOM 0 HB2 HIS A 72 -3.814 -0.379 -3.492 1.00 14.14 H new ATOM 0 HB3 HIS A 72 -4.143 -2.065 -3.838 1.00 14.14 H new ATOM 0 HD1 HIS A 72 -2.293 -3.200 -5.072 1.00 3.10 H new ATOM 0 HD2 HIS A 72 -2.483 0.881 -5.956 1.00 13.55 H new ATOM 0 HE1 HIS A 72 -0.382 -2.713 -6.649 1.00 64.25 H new ATOM 995 N GLY A 73 -7.480 -1.468 -4.348 1.00 11.43 N ATOM 996 CA GLY A 73 -8.651 -1.500 -3.536 1.00 21.14 C ATOM 997 C GLY A 73 -9.256 -2.861 -3.501 1.00 64.21 C ATOM 998 O GLY A 73 -8.543 -3.875 -3.608 1.00 61.41 O ATOM 0 H GLY A 73 -7.504 -2.086 -5.159 1.00 11.43 H new ATOM 0 HA2 GLY A 73 -8.401 -1.186 -2.523 1.00 21.14 H new ATOM 0 HA3 GLY A 73 -9.380 -0.787 -3.920 1.00 21.14 H new ATOM 1002 N LYS A 74 -10.544 -2.915 -3.383 1.00 32.43 N ATOM 1003 CA LYS A 74 -11.222 -4.167 -3.256 1.00 32.00 C ATOM 1004 C LYS A 74 -12.330 -4.291 -4.288 1.00 60.35 C ATOM 1005 O LYS A 74 -12.935 -3.304 -4.674 1.00 63.11 O ATOM 1006 CB LYS A 74 -11.831 -4.303 -1.854 1.00 4.12 C ATOM 1007 CG LYS A 74 -10.852 -4.281 -0.672 1.00 52.23 C ATOM 1008 CD LYS A 74 -9.803 -5.384 -0.764 1.00 32.33 C ATOM 1009 CE LYS A 74 -8.979 -5.501 0.524 1.00 4.53 C ATOM 1010 NZ LYS A 74 -8.321 -4.231 0.921 1.00 60.13 N ATOM 0 H LYS A 74 -11.154 -2.098 -3.372 1.00 32.43 H new ATOM 0 HA LYS A 74 -10.491 -4.959 -3.419 1.00 32.00 H new ATOM 0 HB2 LYS A 74 -12.550 -3.495 -1.715 1.00 4.12 H new ATOM 0 HB3 LYS A 74 -12.390 -5.238 -1.815 1.00 4.12 H new ATOM 0 HG2 LYS A 74 -10.354 -3.312 -0.635 1.00 52.23 H new ATOM 0 HG3 LYS A 74 -11.408 -4.390 0.259 1.00 52.23 H new ATOM 0 HD2 LYS A 74 -10.294 -6.335 -0.968 1.00 32.33 H new ATOM 0 HD3 LYS A 74 -9.137 -5.182 -1.603 1.00 32.33 H new ATOM 0 HE2 LYS A 74 -9.629 -5.833 1.333 1.00 4.53 H new ATOM 0 HE3 LYS A 74 -8.218 -6.270 0.391 1.00 4.53 H new ATOM 0 HZ1 LYS A 74 -7.727 -4.395 1.759 1.00 60.13 H new ATOM 0 HZ2 LYS A 74 -7.728 -3.888 0.138 1.00 60.13 H new ATOM 0 HZ3 LYS A 74 -9.046 -3.519 1.144 1.00 60.13 H new ATOM 1024 N VAL A 75 -12.563 -5.488 -4.736 1.00 34.14 N ATOM 1025 CA VAL A 75 -13.652 -5.789 -5.618 1.00 71.25 C ATOM 1026 C VAL A 75 -14.698 -6.610 -4.910 1.00 72.15 C ATOM 1027 O VAL A 75 -14.397 -7.646 -4.316 1.00 3.52 O ATOM 1028 CB VAL A 75 -13.173 -6.541 -6.883 1.00 1.23 C ATOM 1029 CG1 VAL A 75 -14.351 -7.153 -7.643 1.00 72.44 C ATOM 1030 CG2 VAL A 75 -12.412 -5.594 -7.781 1.00 30.32 C ATOM 0 H VAL A 75 -11.992 -6.298 -4.495 1.00 34.14 H new ATOM 0 HA VAL A 75 -14.086 -4.839 -5.928 1.00 71.25 H new ATOM 0 HB VAL A 75 -12.517 -7.353 -6.571 1.00 1.23 H new ATOM 0 HG11 VAL A 75 -13.983 -7.674 -8.526 1.00 72.44 H new ATOM 0 HG12 VAL A 75 -14.874 -7.858 -6.997 1.00 72.44 H new ATOM 0 HG13 VAL A 75 -15.037 -6.363 -7.948 1.00 72.44 H new ATOM 0 HG21 VAL A 75 -12.076 -6.127 -8.671 1.00 30.32 H new ATOM 0 HG22 VAL A 75 -13.062 -4.770 -8.075 1.00 30.32 H new ATOM 0 HG23 VAL A 75 -11.548 -5.201 -7.246 1.00 30.32 H new ATOM 1040 N LEU A 76 -15.908 -6.134 -4.984 1.00 72.43 N ATOM 1041 CA LEU A 76 -17.046 -6.783 -4.431 1.00 44.12 C ATOM 1042 C LEU A 76 -17.685 -7.591 -5.536 1.00 73.02 C ATOM 1043 O LEU A 76 -18.305 -7.029 -6.445 1.00 25.21 O ATOM 1044 CB LEU A 76 -18.069 -5.743 -3.936 1.00 60.04 C ATOM 1045 CG LEU A 76 -17.576 -4.707 -2.925 1.00 14.21 C ATOM 1046 CD1 LEU A 76 -18.694 -3.749 -2.552 1.00 2.43 C ATOM 1047 CD2 LEU A 76 -17.023 -5.381 -1.694 1.00 0.11 C ATOM 0 H LEU A 76 -16.129 -5.253 -5.448 1.00 72.43 H new ATOM 0 HA LEU A 76 -16.745 -7.410 -3.592 1.00 44.12 H new ATOM 0 HB2 LEU A 76 -18.457 -5.210 -4.804 1.00 60.04 H new ATOM 0 HB3 LEU A 76 -18.907 -6.279 -3.490 1.00 60.04 H new ATOM 0 HG LEU A 76 -16.773 -4.134 -3.390 1.00 14.21 H new ATOM 0 HD11 LEU A 76 -18.323 -3.020 -1.832 1.00 2.43 H new ATOM 0 HD12 LEU A 76 -19.043 -3.231 -3.446 1.00 2.43 H new ATOM 0 HD13 LEU A 76 -19.519 -4.307 -2.111 1.00 2.43 H new ATOM 0 HD21 LEU A 76 -16.678 -4.625 -0.989 1.00 0.11 H new ATOM 0 HD22 LEU A 76 -17.803 -5.983 -1.228 1.00 0.11 H new ATOM 0 HD23 LEU A 76 -16.188 -6.023 -1.975 1.00 0.11 H new ATOM 1059 N MET A 77 -17.492 -8.864 -5.507 1.00 34.34 N ATOM 1060 CA MET A 77 -18.089 -9.722 -6.498 1.00 71.32 C ATOM 1061 C MET A 77 -19.169 -10.538 -5.877 1.00 25.24 C ATOM 1062 O MET A 77 -19.018 -11.046 -4.763 1.00 2.13 O ATOM 1063 CB MET A 77 -17.071 -10.606 -7.225 1.00 70.40 C ATOM 1064 CG MET A 77 -16.233 -11.485 -6.345 1.00 22.53 C ATOM 1065 SD MET A 77 -15.193 -12.623 -7.296 1.00 63.11 S ATOM 1066 CE MET A 77 -14.256 -11.483 -8.302 1.00 71.04 C ATOM 0 H MET A 77 -16.925 -9.345 -4.809 1.00 34.34 H new ATOM 0 HA MET A 77 -18.519 -9.078 -7.265 1.00 71.32 H new ATOM 0 HB2 MET A 77 -17.606 -11.237 -7.935 1.00 70.40 H new ATOM 0 HB3 MET A 77 -16.408 -9.964 -7.805 1.00 70.40 H new ATOM 0 HG2 MET A 77 -15.601 -10.863 -5.711 1.00 22.53 H new ATOM 0 HG3 MET A 77 -16.883 -12.058 -5.683 1.00 22.53 H new ATOM 0 HE1 MET A 77 -13.382 -11.991 -8.709 1.00 71.04 H new ATOM 0 HE2 MET A 77 -14.880 -11.122 -9.120 1.00 71.04 H new ATOM 0 HE3 MET A 77 -13.934 -10.639 -7.692 1.00 71.04 H new ATOM 1076 N GLY A 78 -20.248 -10.681 -6.576 1.00 32.15 N ATOM 1077 CA GLY A 78 -21.367 -11.358 -6.008 1.00 31.32 C ATOM 1078 C GLY A 78 -22.452 -10.390 -5.583 1.00 52.01 C ATOM 1079 O GLY A 78 -23.369 -10.757 -4.842 1.00 73.55 O ATOM 0 H GLY A 78 -20.378 -10.343 -7.529 1.00 32.15 H new ATOM 0 HA2 GLY A 78 -21.772 -12.063 -6.734 1.00 31.32 H new ATOM 0 HA3 GLY A 78 -21.041 -11.940 -5.146 1.00 31.32 H new ATOM 1083 N VAL A 79 -22.356 -9.148 -6.038 1.00 63.42 N ATOM 1084 CA VAL A 79 -23.366 -8.162 -5.713 1.00 32.25 C ATOM 1085 C VAL A 79 -24.541 -8.324 -6.690 1.00 43.22 C ATOM 1086 O VAL A 79 -24.340 -8.414 -7.908 1.00 44.02 O ATOM 1087 CB VAL A 79 -22.795 -6.690 -5.716 1.00 23.24 C ATOM 1088 CG1 VAL A 79 -22.377 -6.220 -7.086 1.00 21.32 C ATOM 1089 CG2 VAL A 79 -23.754 -5.716 -5.076 1.00 71.41 C ATOM 0 H VAL A 79 -21.596 -8.806 -6.627 1.00 63.42 H new ATOM 0 HA VAL A 79 -23.714 -8.335 -4.694 1.00 32.25 H new ATOM 0 HB VAL A 79 -21.890 -6.721 -5.109 1.00 23.24 H new ATOM 0 HG11 VAL A 79 -21.994 -5.202 -7.020 1.00 21.32 H new ATOM 0 HG12 VAL A 79 -21.598 -6.876 -7.474 1.00 21.32 H new ATOM 0 HG13 VAL A 79 -23.237 -6.241 -7.756 1.00 21.32 H new ATOM 0 HG21 VAL A 79 -23.324 -4.715 -5.098 1.00 71.41 H new ATOM 0 HG22 VAL A 79 -24.696 -5.719 -5.625 1.00 71.41 H new ATOM 0 HG23 VAL A 79 -23.936 -6.010 -4.042 1.00 71.41 H new ATOM 1099 N THR A 80 -25.739 -8.413 -6.170 1.00 2.23 N ATOM 1100 CA THR A 80 -26.898 -8.635 -6.965 1.00 40.35 C ATOM 1101 C THR A 80 -27.260 -7.343 -7.738 1.00 53.02 C ATOM 1102 O THR A 80 -26.827 -6.252 -7.362 1.00 23.12 O ATOM 1103 CB THR A 80 -28.036 -9.041 -6.028 1.00 35.22 C ATOM 1104 OG1 THR A 80 -27.529 -10.014 -5.104 1.00 54.53 O ATOM 1105 CG2 THR A 80 -29.135 -9.680 -6.797 1.00 24.44 C ATOM 0 H THR A 80 -25.929 -8.331 -5.171 1.00 2.23 H new ATOM 0 HA THR A 80 -26.720 -9.423 -7.696 1.00 40.35 H new ATOM 0 HB THR A 80 -28.412 -8.155 -5.517 1.00 35.22 H new ATOM 0 HG1 THR A 80 -27.102 -9.557 -4.349 1.00 54.53 H new ATOM 0 HG21 THR A 80 -29.938 -9.964 -6.117 1.00 24.44 H new ATOM 0 HG22 THR A 80 -29.518 -8.977 -7.537 1.00 24.44 H new ATOM 0 HG23 THR A 80 -28.757 -10.569 -7.302 1.00 24.44 H new ATOM 1113 N SER A 81 -28.034 -7.473 -8.812 1.00 0.14 N ATOM 1114 CA SER A 81 -28.420 -6.334 -9.645 1.00 73.34 C ATOM 1115 C SER A 81 -29.132 -5.229 -8.832 1.00 63.33 C ATOM 1116 O SER A 81 -28.842 -4.043 -8.999 1.00 21.24 O ATOM 1117 CB SER A 81 -29.281 -6.819 -10.801 1.00 21.45 C ATOM 1118 OG SER A 81 -28.602 -7.858 -11.511 1.00 22.52 O ATOM 0 H SER A 81 -28.411 -8.366 -9.130 1.00 0.14 H new ATOM 0 HA SER A 81 -27.513 -5.879 -10.044 1.00 73.34 H new ATOM 0 HB2 SER A 81 -30.236 -7.187 -10.425 1.00 21.45 H new ATOM 0 HB3 SER A 81 -29.501 -5.991 -11.474 1.00 21.45 H new ATOM 0 HG SER A 81 -27.721 -7.538 -11.796 1.00 22.52 H new ATOM 1124 N ASP A 82 -30.029 -5.626 -7.934 1.00 13.41 N ATOM 1125 CA ASP A 82 -30.716 -4.661 -7.061 1.00 62.53 C ATOM 1126 C ASP A 82 -29.739 -3.942 -6.158 1.00 24.24 C ATOM 1127 O ASP A 82 -29.829 -2.752 -5.971 1.00 50.20 O ATOM 1128 CB ASP A 82 -31.778 -5.341 -6.212 1.00 42.03 C ATOM 1129 CG ASP A 82 -32.406 -4.390 -5.213 1.00 32.41 C ATOM 1130 OD1 ASP A 82 -33.225 -3.544 -5.624 1.00 33.35 O ATOM 1131 OD2 ASP A 82 -32.092 -4.486 -3.998 1.00 15.53 O ATOM 0 H ASP A 82 -30.300 -6.598 -7.787 1.00 13.41 H new ATOM 0 HA ASP A 82 -31.197 -3.932 -7.714 1.00 62.53 H new ATOM 0 HB2 ASP A 82 -32.554 -5.748 -6.861 1.00 42.03 H new ATOM 0 HB3 ASP A 82 -31.333 -6.182 -5.680 1.00 42.03 H new ATOM 1136 N GLU A 83 -28.796 -4.681 -5.632 1.00 33.53 N ATOM 1137 CA GLU A 83 -27.781 -4.145 -4.733 1.00 71.40 C ATOM 1138 C GLU A 83 -26.812 -3.248 -5.535 1.00 41.15 C ATOM 1139 O GLU A 83 -26.233 -2.321 -5.007 1.00 3.32 O ATOM 1140 CB GLU A 83 -27.049 -5.301 -4.069 1.00 40.44 C ATOM 1141 CG GLU A 83 -27.988 -6.271 -3.372 1.00 24.32 C ATOM 1142 CD GLU A 83 -27.283 -7.448 -2.763 1.00 40.31 C ATOM 1143 OE1 GLU A 83 -26.562 -8.160 -3.495 1.00 72.31 O ATOM 1144 OE2 GLU A 83 -27.438 -7.685 -1.546 1.00 33.43 O ATOM 0 H GLU A 83 -28.702 -5.681 -5.811 1.00 33.53 H new ATOM 0 HA GLU A 83 -28.240 -3.536 -3.954 1.00 71.40 H new ATOM 0 HB2 GLU A 83 -26.471 -5.839 -4.821 1.00 40.44 H new ATOM 0 HB3 GLU A 83 -26.338 -4.906 -3.343 1.00 40.44 H new ATOM 0 HG2 GLU A 83 -28.534 -5.740 -2.592 1.00 24.32 H new ATOM 0 HG3 GLU A 83 -28.726 -6.630 -4.089 1.00 24.32 H new ATOM 1151 N LEU A 84 -26.656 -3.542 -6.815 1.00 1.11 N ATOM 1152 CA LEU A 84 -25.882 -2.691 -7.719 1.00 23.51 C ATOM 1153 C LEU A 84 -26.572 -1.325 -7.811 1.00 63.24 C ATOM 1154 O LEU A 84 -25.937 -0.270 -7.691 1.00 14.33 O ATOM 1155 CB LEU A 84 -25.816 -3.320 -9.117 1.00 22.51 C ATOM 1156 CG LEU A 84 -25.059 -2.525 -10.186 1.00 4.10 C ATOM 1157 CD1 LEU A 84 -23.587 -2.456 -9.875 1.00 3.01 C ATOM 1158 CD2 LEU A 84 -25.290 -3.113 -11.553 1.00 11.42 C ATOM 0 H LEU A 84 -27.056 -4.368 -7.259 1.00 1.11 H new ATOM 0 HA LEU A 84 -24.867 -2.582 -7.336 1.00 23.51 H new ATOM 0 HB2 LEU A 84 -25.351 -4.302 -9.028 1.00 22.51 H new ATOM 0 HB3 LEU A 84 -26.835 -3.480 -9.468 1.00 22.51 H new ATOM 0 HG LEU A 84 -25.448 -1.507 -10.182 1.00 4.10 H new ATOM 0 HD11 LEU A 84 -23.077 -1.886 -10.652 1.00 3.01 H new ATOM 0 HD12 LEU A 84 -23.441 -1.968 -8.911 1.00 3.01 H new ATOM 0 HD13 LEU A 84 -23.176 -3.465 -9.837 1.00 3.01 H new ATOM 0 HD21 LEU A 84 -24.743 -2.533 -12.296 1.00 11.42 H new ATOM 0 HD22 LEU A 84 -24.940 -4.145 -11.569 1.00 11.42 H new ATOM 0 HD23 LEU A 84 -26.355 -3.088 -11.785 1.00 11.42 H new ATOM 1170 N GLU A 85 -27.884 -1.370 -8.010 1.00 52.12 N ATOM 1171 CA GLU A 85 -28.717 -0.181 -8.059 1.00 73.12 C ATOM 1172 C GLU A 85 -28.793 0.467 -6.676 1.00 52.11 C ATOM 1173 O GLU A 85 -28.953 1.660 -6.547 1.00 4.33 O ATOM 1174 CB GLU A 85 -30.103 -0.522 -8.590 1.00 11.23 C ATOM 1175 CG GLU A 85 -30.086 -1.054 -10.012 1.00 23.44 C ATOM 1176 CD GLU A 85 -31.463 -1.371 -10.530 1.00 31.53 C ATOM 1177 OE1 GLU A 85 -32.267 -0.424 -10.732 1.00 32.10 O ATOM 1178 OE2 GLU A 85 -31.759 -2.554 -10.776 1.00 62.11 O ATOM 0 H GLU A 85 -28.400 -2.240 -8.142 1.00 52.12 H new ATOM 0 HA GLU A 85 -28.268 0.538 -8.744 1.00 73.12 H new ATOM 0 HB2 GLU A 85 -30.562 -1.264 -7.937 1.00 11.23 H new ATOM 0 HB3 GLU A 85 -30.729 0.369 -8.550 1.00 11.23 H new ATOM 0 HG2 GLU A 85 -29.617 -0.318 -10.665 1.00 23.44 H new ATOM 0 HG3 GLU A 85 -29.471 -1.953 -10.052 1.00 23.44 H new ATOM 1185 N ASN A 86 -28.672 -0.353 -5.669 1.00 10.33 N ATOM 1186 CA ASN A 86 -28.621 0.057 -4.274 1.00 62.21 C ATOM 1187 C ASN A 86 -27.382 0.916 -4.053 1.00 34.24 C ATOM 1188 O ASN A 86 -27.448 1.979 -3.453 1.00 54.31 O ATOM 1189 CB ASN A 86 -28.562 -1.212 -3.430 1.00 4.24 C ATOM 1190 CG ASN A 86 -28.374 -1.035 -1.955 1.00 23.44 C ATOM 1191 OD1 ASN A 86 -27.791 -1.886 -1.302 1.00 72.03 O ATOM 1192 ND2 ASN A 86 -28.854 0.011 -1.419 1.00 35.15 N ATOM 0 H ASN A 86 -28.603 -1.363 -5.791 1.00 10.33 H new ATOM 0 HA ASN A 86 -29.495 0.646 -3.995 1.00 62.21 H new ATOM 0 HB2 ASN A 86 -29.485 -1.769 -3.590 1.00 4.24 H new ATOM 0 HB3 ASN A 86 -27.747 -1.831 -3.804 1.00 4.24 H new ATOM 0 HD21 ASN A 86 -28.758 0.159 -0.414 1.00 35.15 H new ATOM 0 HD22 ASN A 86 -29.336 0.703 -1.993 1.00 35.15 H new ATOM 1199 N LEU A 87 -26.267 0.452 -4.577 1.00 61.42 N ATOM 1200 CA LEU A 87 -25.008 1.180 -4.521 1.00 35.52 C ATOM 1201 C LEU A 87 -25.138 2.473 -5.309 1.00 72.11 C ATOM 1202 O LEU A 87 -24.620 3.504 -4.909 1.00 20.41 O ATOM 1203 CB LEU A 87 -23.868 0.324 -5.077 1.00 71.41 C ATOM 1204 CG LEU A 87 -23.584 -0.982 -4.332 1.00 70.12 C ATOM 1205 CD1 LEU A 87 -22.491 -1.769 -5.036 1.00 12.23 C ATOM 1206 CD2 LEU A 87 -23.189 -0.706 -2.893 1.00 12.33 C ATOM 0 H LEU A 87 -26.204 -0.446 -5.057 1.00 61.42 H new ATOM 0 HA LEU A 87 -24.776 1.416 -3.482 1.00 35.52 H new ATOM 0 HB2 LEU A 87 -24.094 0.084 -6.116 1.00 71.41 H new ATOM 0 HB3 LEU A 87 -22.958 0.923 -5.079 1.00 71.41 H new ATOM 0 HG LEU A 87 -24.497 -1.577 -4.330 1.00 70.12 H new ATOM 0 HD11 LEU A 87 -22.302 -2.695 -4.493 1.00 12.23 H new ATOM 0 HD12 LEU A 87 -22.808 -2.003 -6.052 1.00 12.23 H new ATOM 0 HD13 LEU A 87 -21.578 -1.174 -5.069 1.00 12.23 H new ATOM 0 HD21 LEU A 87 -22.992 -1.649 -2.383 1.00 12.33 H new ATOM 0 HD22 LEU A 87 -22.291 -0.088 -2.874 1.00 12.33 H new ATOM 0 HD23 LEU A 87 -24.000 -0.182 -2.387 1.00 12.33 H new ATOM 1218 N ASP A 88 -25.839 2.389 -6.432 1.00 13.32 N ATOM 1219 CA ASP A 88 -26.182 3.561 -7.250 1.00 25.43 C ATOM 1220 C ASP A 88 -26.986 4.558 -6.436 1.00 21.41 C ATOM 1221 O ASP A 88 -26.702 5.734 -6.433 1.00 43.15 O ATOM 1222 CB ASP A 88 -26.997 3.129 -8.471 1.00 2.01 C ATOM 1223 CG ASP A 88 -27.617 4.288 -9.226 1.00 31.54 C ATOM 1224 OD1 ASP A 88 -26.938 4.898 -10.057 1.00 52.32 O ATOM 1225 OD2 ASP A 88 -28.815 4.578 -9.014 1.00 32.12 O ATOM 0 H ASP A 88 -26.190 1.508 -6.808 1.00 13.32 H new ATOM 0 HA ASP A 88 -25.256 4.033 -7.579 1.00 25.43 H new ATOM 0 HB2 ASP A 88 -26.353 2.568 -9.148 1.00 2.01 H new ATOM 0 HB3 ASP A 88 -27.788 2.451 -8.149 1.00 2.01 H new ATOM 1230 N ALA A 89 -27.978 4.057 -5.744 1.00 65.34 N ATOM 1231 CA ALA A 89 -28.839 4.860 -4.909 1.00 24.23 C ATOM 1232 C ALA A 89 -28.051 5.555 -3.809 1.00 72.51 C ATOM 1233 O ALA A 89 -28.215 6.754 -3.577 1.00 43.04 O ATOM 1234 CB ALA A 89 -29.919 3.978 -4.298 1.00 2.54 C ATOM 0 H ALA A 89 -28.215 3.065 -5.744 1.00 65.34 H new ATOM 0 HA ALA A 89 -29.299 5.630 -5.528 1.00 24.23 H new ATOM 0 HB1 ALA A 89 -30.570 4.584 -3.667 1.00 2.54 H new ATOM 0 HB2 ALA A 89 -30.508 3.520 -5.093 1.00 2.54 H new ATOM 0 HB3 ALA A 89 -29.454 3.198 -3.696 1.00 2.54 H new ATOM 1240 N VAL A 90 -27.220 4.796 -3.134 1.00 34.41 N ATOM 1241 CA VAL A 90 -26.438 5.305 -2.033 1.00 44.43 C ATOM 1242 C VAL A 90 -25.260 6.222 -2.484 1.00 4.41 C ATOM 1243 O VAL A 90 -25.184 7.387 -2.083 1.00 11.21 O ATOM 1244 CB VAL A 90 -25.917 4.137 -1.132 1.00 40.31 C ATOM 1245 CG1 VAL A 90 -25.098 4.659 0.036 1.00 21.50 C ATOM 1246 CG2 VAL A 90 -27.086 3.305 -0.613 1.00 52.12 C ATOM 0 H VAL A 90 -27.067 3.807 -3.333 1.00 34.41 H new ATOM 0 HA VAL A 90 -27.110 5.933 -1.448 1.00 44.43 H new ATOM 0 HB VAL A 90 -25.272 3.509 -1.746 1.00 40.31 H new ATOM 0 HG11 VAL A 90 -24.752 3.821 0.641 1.00 21.50 H new ATOM 0 HG12 VAL A 90 -24.239 5.214 -0.341 1.00 21.50 H new ATOM 0 HG13 VAL A 90 -25.715 5.318 0.647 1.00 21.50 H new ATOM 0 HG21 VAL A 90 -26.708 2.496 0.012 1.00 52.12 H new ATOM 0 HG22 VAL A 90 -27.750 3.938 -0.025 1.00 52.12 H new ATOM 0 HG23 VAL A 90 -27.636 2.885 -1.455 1.00 52.12 H new ATOM 1256 N GLU A 91 -24.365 5.697 -3.316 1.00 21.31 N ATOM 1257 CA GLU A 91 -23.156 6.426 -3.709 1.00 42.33 C ATOM 1258 C GLU A 91 -23.445 7.462 -4.813 1.00 52.42 C ATOM 1259 O GLU A 91 -22.880 8.567 -4.827 1.00 50.25 O ATOM 1260 CB GLU A 91 -22.091 5.448 -4.208 1.00 65.12 C ATOM 1261 CG GLU A 91 -20.689 5.998 -4.153 1.00 3.11 C ATOM 1262 CD GLU A 91 -20.187 6.181 -2.732 1.00 22.10 C ATOM 1263 OE1 GLU A 91 -20.763 6.986 -1.977 1.00 31.21 O ATOM 1264 OE2 GLU A 91 -19.215 5.502 -2.354 1.00 34.01 O ATOM 0 H GLU A 91 -24.451 4.770 -3.733 1.00 21.31 H new ATOM 0 HA GLU A 91 -22.796 6.955 -2.827 1.00 42.33 H new ATOM 0 HB2 GLU A 91 -22.138 4.538 -3.611 1.00 65.12 H new ATOM 0 HB3 GLU A 91 -22.321 5.167 -5.236 1.00 65.12 H new ATOM 0 HG2 GLU A 91 -20.018 5.325 -4.687 1.00 3.11 H new ATOM 0 HG3 GLU A 91 -20.658 6.957 -4.671 1.00 3.11 H new ATOM 1271 N GLY A 92 -24.351 7.088 -5.716 1.00 24.22 N ATOM 1272 CA GLY A 92 -24.670 7.857 -6.932 1.00 5.33 C ATOM 1273 C GLY A 92 -25.120 9.277 -6.692 1.00 44.41 C ATOM 1274 O GLY A 92 -25.115 10.098 -7.610 1.00 0.11 O ATOM 0 H GLY A 92 -24.896 6.230 -5.628 1.00 24.22 H new ATOM 0 HA2 GLY A 92 -23.789 7.875 -7.573 1.00 5.33 H new ATOM 0 HA3 GLY A 92 -25.452 7.332 -7.480 1.00 5.33 H new ATOM 1278 N ASN A 93 -25.513 9.572 -5.474 1.00 52.42 N ATOM 1279 CA ASN A 93 -25.938 10.919 -5.102 1.00 12.45 C ATOM 1280 C ASN A 93 -24.839 11.941 -5.338 1.00 43.20 C ATOM 1281 O ASN A 93 -25.123 13.095 -5.671 1.00 33.10 O ATOM 1282 CB ASN A 93 -26.394 10.980 -3.641 1.00 54.21 C ATOM 1283 CG ASN A 93 -27.664 10.202 -3.365 1.00 75.11 C ATOM 1284 OD1 ASN A 93 -27.845 9.667 -2.282 1.00 31.13 O ATOM 1285 ND2 ASN A 93 -28.563 10.164 -4.317 1.00 32.51 N ATOM 0 H ASN A 93 -25.550 8.896 -4.711 1.00 52.42 H new ATOM 0 HA ASN A 93 -26.784 11.166 -5.744 1.00 12.45 H new ATOM 0 HB2 ASN A 93 -25.597 10.595 -3.005 1.00 54.21 H new ATOM 0 HB3 ASN A 93 -26.549 12.022 -3.362 1.00 54.21 H new ATOM 0 HD21 ASN A 93 -29.446 9.677 -4.165 1.00 32.51 H new ATOM 0 HD22 ASN A 93 -28.380 10.622 -5.210 1.00 32.51 H new ATOM 1292 N GLU A 94 -23.586 11.523 -5.177 1.00 63.15 N ATOM 1293 CA GLU A 94 -22.457 12.425 -5.365 1.00 15.34 C ATOM 1294 C GLU A 94 -21.378 11.802 -6.264 1.00 21.51 C ATOM 1295 O GLU A 94 -20.365 12.433 -6.552 1.00 63.11 O ATOM 1296 CB GLU A 94 -21.867 12.836 -4.001 1.00 35.03 C ATOM 1297 CG GLU A 94 -22.869 13.552 -3.099 1.00 31.31 C ATOM 1298 CD GLU A 94 -22.316 13.935 -1.751 1.00 4.23 C ATOM 1299 OE1 GLU A 94 -22.364 13.100 -0.817 1.00 53.31 O ATOM 1300 OE2 GLU A 94 -21.857 15.093 -1.588 1.00 45.44 O ATOM 0 H GLU A 94 -23.329 10.570 -4.918 1.00 63.15 H new ATOM 0 HA GLU A 94 -22.823 13.319 -5.870 1.00 15.34 H new ATOM 0 HB2 GLU A 94 -21.500 11.946 -3.489 1.00 35.03 H new ATOM 0 HB3 GLU A 94 -21.008 13.487 -4.166 1.00 35.03 H new ATOM 0 HG2 GLU A 94 -23.220 14.451 -3.605 1.00 31.31 H new ATOM 0 HG3 GLU A 94 -23.737 12.908 -2.955 1.00 31.31 H new ATOM 1307 N TYR A 95 -21.625 10.587 -6.729 1.00 52.43 N ATOM 1308 CA TYR A 95 -20.655 9.835 -7.530 1.00 20.42 C ATOM 1309 C TYR A 95 -21.283 9.238 -8.780 1.00 23.00 C ATOM 1310 O TYR A 95 -22.499 9.167 -8.888 1.00 63.24 O ATOM 1311 CB TYR A 95 -20.026 8.732 -6.690 1.00 60.30 C ATOM 1312 CG TYR A 95 -19.066 9.229 -5.644 1.00 2.12 C ATOM 1313 CD1 TYR A 95 -17.751 9.475 -5.971 1.00 52.31 C ATOM 1314 CD2 TYR A 95 -19.469 9.448 -4.339 1.00 52.31 C ATOM 1315 CE1 TYR A 95 -16.853 9.924 -5.033 1.00 62.55 C ATOM 1316 CE2 TYR A 95 -18.577 9.900 -3.384 1.00 64.32 C ATOM 1317 CZ TYR A 95 -17.267 10.134 -3.740 1.00 43.13 C ATOM 1318 OH TYR A 95 -16.371 10.585 -2.801 1.00 2.31 O ATOM 0 H TYR A 95 -22.500 10.090 -6.565 1.00 52.43 H new ATOM 0 HA TYR A 95 -19.886 10.537 -7.851 1.00 20.42 H new ATOM 0 HB2 TYR A 95 -20.819 8.166 -6.201 1.00 60.30 H new ATOM 0 HB3 TYR A 95 -19.502 8.041 -7.350 1.00 60.30 H new ATOM 0 HD1 TYR A 95 -17.419 9.312 -6.986 1.00 52.31 H new ATOM 0 HD2 TYR A 95 -20.496 9.263 -4.062 1.00 52.31 H new ATOM 0 HE1 TYR A 95 -15.826 10.111 -5.311 1.00 62.55 H new ATOM 0 HE2 TYR A 95 -18.904 10.068 -2.369 1.00 64.32 H new ATOM 0 HH TYR A 95 -16.487 11.550 -2.675 1.00 2.31 H new ATOM 1328 N GLU A 96 -20.449 8.823 -9.724 1.00 42.31 N ATOM 1329 CA GLU A 96 -20.919 8.208 -10.957 1.00 74.54 C ATOM 1330 C GLU A 96 -20.264 6.853 -11.125 1.00 41.21 C ATOM 1331 O GLU A 96 -19.093 6.674 -10.771 1.00 11.51 O ATOM 1332 CB GLU A 96 -20.617 9.120 -12.170 1.00 41.42 C ATOM 1333 CG GLU A 96 -21.025 8.551 -13.532 1.00 24.02 C ATOM 1334 CD GLU A 96 -22.497 8.217 -13.618 1.00 64.23 C ATOM 1335 OE1 GLU A 96 -23.305 9.105 -13.894 1.00 64.15 O ATOM 1336 OE2 GLU A 96 -22.867 7.048 -13.402 1.00 34.01 O ATOM 0 H GLU A 96 -19.434 8.903 -9.657 1.00 42.31 H new ATOM 0 HA GLU A 96 -21.999 8.075 -10.903 1.00 74.54 H new ATOM 0 HB2 GLU A 96 -21.128 10.072 -12.024 1.00 41.42 H new ATOM 0 HB3 GLU A 96 -19.548 9.331 -12.188 1.00 41.42 H new ATOM 0 HG2 GLU A 96 -20.776 9.273 -14.310 1.00 24.02 H new ATOM 0 HG3 GLU A 96 -20.442 7.652 -13.733 1.00 24.02 H new ATOM 1343 N ARG A 97 -21.008 5.909 -11.653 1.00 12.51 N ATOM 1344 CA ARG A 97 -20.519 4.575 -11.843 1.00 74.02 C ATOM 1345 C ARG A 97 -20.039 4.412 -13.263 1.00 73.23 C ATOM 1346 O ARG A 97 -20.825 4.483 -14.220 1.00 41.33 O ATOM 1347 CB ARG A 97 -21.606 3.554 -11.539 1.00 40.25 C ATOM 1348 CG ARG A 97 -21.161 2.103 -11.640 1.00 45.22 C ATOM 1349 CD ARG A 97 -22.321 1.168 -11.355 1.00 52.24 C ATOM 1350 NE ARG A 97 -23.402 1.329 -12.337 1.00 31.13 N ATOM 1351 CZ ARG A 97 -24.703 1.422 -12.040 1.00 51.23 C ATOM 1352 NH1 ARG A 97 -25.112 1.427 -10.765 1.00 14.24 N ATOM 1353 NH2 ARG A 97 -25.595 1.536 -13.020 1.00 43.21 N ATOM 0 H ARG A 97 -21.970 6.051 -11.961 1.00 12.51 H new ATOM 0 HA ARG A 97 -19.689 4.404 -11.157 1.00 74.02 H new ATOM 0 HB2 ARG A 97 -21.984 3.735 -10.533 1.00 40.25 H new ATOM 0 HB3 ARG A 97 -22.438 3.713 -12.225 1.00 40.25 H new ATOM 0 HG2 ARG A 97 -20.765 1.907 -12.636 1.00 45.22 H new ATOM 0 HG3 ARG A 97 -20.353 1.915 -10.933 1.00 45.22 H new ATOM 0 HD2 ARG A 97 -21.969 0.137 -11.367 1.00 52.24 H new ATOM 0 HD3 ARG A 97 -22.707 1.361 -10.354 1.00 52.24 H new ATOM 0 HE ARG A 97 -23.140 1.373 -13.322 1.00 31.13 H new ATOM 0 HH11 ARG A 97 -24.429 1.360 -10.010 1.00 14.24 H new ATOM 0 HH12 ARG A 97 -26.106 1.498 -10.549 1.00 14.24 H new ATOM 0 HH21 ARG A 97 -25.286 1.552 -13.992 1.00 43.21 H new ATOM 0 HH22 ARG A 97 -26.588 1.607 -12.800 1.00 43.21 H new ATOM 1367 N VAL A 98 -18.775 4.203 -13.406 1.00 74.03 N ATOM 1368 CA VAL A 98 -18.176 4.039 -14.698 1.00 41.05 C ATOM 1369 C VAL A 98 -17.577 2.677 -14.870 1.00 23.12 C ATOM 1370 O VAL A 98 -17.337 1.953 -13.889 1.00 45.31 O ATOM 1371 CB VAL A 98 -17.153 5.123 -15.049 1.00 24.32 C ATOM 1372 CG1 VAL A 98 -17.858 6.466 -15.206 1.00 64.50 C ATOM 1373 CG2 VAL A 98 -16.063 5.193 -13.981 1.00 61.22 C ATOM 0 H VAL A 98 -18.118 4.140 -12.628 1.00 74.03 H new ATOM 0 HA VAL A 98 -18.999 4.149 -15.404 1.00 41.05 H new ATOM 0 HB VAL A 98 -16.675 4.872 -15.996 1.00 24.32 H new ATOM 0 HG11 VAL A 98 -17.126 7.234 -15.456 1.00 64.50 H new ATOM 0 HG12 VAL A 98 -18.598 6.397 -16.003 1.00 64.50 H new ATOM 0 HG13 VAL A 98 -18.354 6.728 -14.272 1.00 64.50 H new ATOM 0 HG21 VAL A 98 -15.344 5.968 -14.245 1.00 61.22 H new ATOM 0 HG22 VAL A 98 -16.513 5.429 -13.017 1.00 61.22 H new ATOM 0 HG23 VAL A 98 -15.553 4.232 -13.918 1.00 61.22 H new ATOM 1383 N THR A 99 -17.349 2.333 -16.097 1.00 41.20 N ATOM 1384 CA THR A 99 -16.828 1.073 -16.464 1.00 65.45 C ATOM 1385 C THR A 99 -15.311 1.103 -16.405 1.00 12.54 C ATOM 1386 O THR A 99 -14.649 1.936 -17.065 1.00 22.22 O ATOM 1387 CB THR A 99 -17.314 0.731 -17.879 1.00 23.24 C ATOM 1388 OG1 THR A 99 -17.151 1.885 -18.736 1.00 63.52 O ATOM 1389 CG2 THR A 99 -18.770 0.308 -17.871 1.00 62.54 C ATOM 0 H THR A 99 -17.529 2.948 -16.891 1.00 41.20 H new ATOM 0 HA THR A 99 -17.176 0.307 -15.771 1.00 65.45 H new ATOM 0 HB THR A 99 -16.718 -0.101 -18.255 1.00 23.24 H new ATOM 0 HG1 THR A 99 -16.289 2.312 -18.549 1.00 63.52 H new ATOM 0 HG21 THR A 99 -19.086 0.072 -18.887 1.00 62.54 H new ATOM 0 HG22 THR A 99 -18.890 -0.573 -17.240 1.00 62.54 H new ATOM 0 HG23 THR A 99 -19.383 1.120 -17.480 1.00 62.54 H new ATOM 1397 N VAL A 100 -14.753 0.228 -15.608 1.00 61.43 N ATOM 1398 CA VAL A 100 -13.314 0.210 -15.408 1.00 45.21 C ATOM 1399 C VAL A 100 -12.741 -1.207 -15.478 1.00 1.22 C ATOM 1400 O VAL A 100 -13.480 -2.194 -15.440 1.00 11.20 O ATOM 1401 CB VAL A 100 -12.906 0.873 -14.053 1.00 62.20 C ATOM 1402 CG1 VAL A 100 -13.289 2.354 -14.009 1.00 33.03 C ATOM 1403 CG2 VAL A 100 -13.519 0.137 -12.872 1.00 54.02 C ATOM 0 H VAL A 100 -15.265 -0.482 -15.085 1.00 61.43 H new ATOM 0 HA VAL A 100 -12.890 0.795 -16.225 1.00 45.21 H new ATOM 0 HB VAL A 100 -11.821 0.802 -13.980 1.00 62.20 H new ATOM 0 HG11 VAL A 100 -12.989 2.779 -13.051 1.00 33.03 H new ATOM 0 HG12 VAL A 100 -12.784 2.885 -14.816 1.00 33.03 H new ATOM 0 HG13 VAL A 100 -14.368 2.455 -14.128 1.00 33.03 H new ATOM 0 HG21 VAL A 100 -13.216 0.622 -11.944 1.00 54.02 H new ATOM 0 HG22 VAL A 100 -14.606 0.158 -12.955 1.00 54.02 H new ATOM 0 HG23 VAL A 100 -13.175 -0.897 -12.869 1.00 54.02 H new ATOM 1413 N GLY A 101 -11.443 -1.298 -15.592 1.00 22.11 N ATOM 1414 CA GLY A 101 -10.790 -2.575 -15.610 1.00 20.11 C ATOM 1415 C GLY A 101 -9.842 -2.683 -14.454 1.00 31.33 C ATOM 1416 O GLY A 101 -9.017 -1.793 -14.244 1.00 3.23 O ATOM 0 H GLY A 101 -10.816 -0.498 -15.674 1.00 22.11 H new ATOM 0 HA2 GLY A 101 -11.531 -3.372 -15.559 1.00 20.11 H new ATOM 0 HA3 GLY A 101 -10.249 -2.703 -16.548 1.00 20.11 H new ATOM 1420 N ILE A 102 -9.958 -3.732 -13.686 1.00 45.14 N ATOM 1421 CA ILE A 102 -9.112 -3.909 -12.528 1.00 52.24 C ATOM 1422 C ILE A 102 -8.252 -5.133 -12.668 1.00 62.31 C ATOM 1423 O ILE A 102 -8.548 -6.006 -13.468 1.00 63.33 O ATOM 1424 CB ILE A 102 -9.914 -3.893 -11.174 1.00 22.40 C ATOM 1425 CG1 ILE A 102 -11.039 -4.943 -11.109 1.00 40.34 C ATOM 1426 CG2 ILE A 102 -10.497 -2.534 -10.930 1.00 25.12 C ATOM 1427 CD1 ILE A 102 -10.611 -6.364 -10.935 1.00 62.12 C ATOM 0 H ILE A 102 -10.632 -4.482 -13.839 1.00 45.14 H new ATOM 0 HA ILE A 102 -8.449 -3.045 -12.485 1.00 52.24 H new ATOM 0 HB ILE A 102 -9.192 -4.147 -10.398 1.00 22.40 H new ATOM 0 HG12 ILE A 102 -11.703 -4.682 -10.284 1.00 40.34 H new ATOM 0 HG13 ILE A 102 -11.626 -4.872 -12.025 1.00 40.34 H new ATOM 0 HG21 ILE A 102 -11.049 -2.538 -9.990 1.00 25.12 H new ATOM 0 HG22 ILE A 102 -9.695 -1.798 -10.876 1.00 25.12 H new ATOM 0 HG23 ILE A 102 -11.172 -2.276 -11.746 1.00 25.12 H new ATOM 0 HD11 ILE A 102 -11.490 -7.008 -10.904 1.00 62.12 H new ATOM 0 HD12 ILE A 102 -9.976 -6.658 -11.771 1.00 62.12 H new ATOM 0 HD13 ILE A 102 -10.054 -6.465 -10.003 1.00 62.12 H new ATOM 1439 N VAL A 103 -7.205 -5.200 -11.907 1.00 0.23 N ATOM 1440 CA VAL A 103 -6.280 -6.295 -11.977 1.00 74.54 C ATOM 1441 C VAL A 103 -6.073 -6.847 -10.577 1.00 52.24 C ATOM 1442 O VAL A 103 -5.727 -6.099 -9.676 1.00 72.53 O ATOM 1443 CB VAL A 103 -4.917 -5.830 -12.581 1.00 31.23 C ATOM 1444 CG1 VAL A 103 -3.946 -6.979 -12.700 1.00 62.33 C ATOM 1445 CG2 VAL A 103 -5.111 -5.162 -13.937 1.00 71.43 C ATOM 0 H VAL A 103 -6.963 -4.492 -11.213 1.00 0.23 H new ATOM 0 HA VAL A 103 -6.686 -7.071 -12.626 1.00 74.54 H new ATOM 0 HB VAL A 103 -4.496 -5.096 -11.894 1.00 31.23 H new ATOM 0 HG11 VAL A 103 -3.008 -6.620 -13.124 1.00 62.33 H new ATOM 0 HG12 VAL A 103 -3.760 -7.402 -11.713 1.00 62.33 H new ATOM 0 HG13 VAL A 103 -4.368 -7.746 -13.350 1.00 62.33 H new ATOM 0 HG21 VAL A 103 -4.144 -4.850 -14.331 1.00 71.43 H new ATOM 0 HG22 VAL A 103 -5.573 -5.868 -14.627 1.00 71.43 H new ATOM 0 HG23 VAL A 103 -5.755 -4.290 -13.824 1.00 71.43 H new ATOM 1455 N ARG A 104 -6.309 -8.148 -10.391 1.00 24.21 N ATOM 1456 CA ARG A 104 -6.178 -8.754 -9.064 1.00 72.24 C ATOM 1457 C ARG A 104 -4.778 -8.696 -8.548 1.00 51.20 C ATOM 1458 O ARG A 104 -3.813 -8.813 -9.306 1.00 31.40 O ATOM 1459 CB ARG A 104 -6.637 -10.212 -8.980 1.00 22.32 C ATOM 1460 CG ARG A 104 -8.083 -10.462 -9.266 1.00 75.25 C ATOM 1461 CD ARG A 104 -8.514 -11.808 -8.681 1.00 21.10 C ATOM 1462 NE ARG A 104 -7.793 -12.955 -9.215 1.00 74.53 N ATOM 1463 CZ ARG A 104 -7.985 -14.234 -8.804 1.00 21.34 C ATOM 1464 NH1 ARG A 104 -8.757 -14.492 -7.756 1.00 53.02 N ATOM 1465 NH2 ARG A 104 -7.388 -15.231 -9.429 1.00 71.12 N ATOM 0 H ARG A 104 -6.588 -8.794 -11.130 1.00 24.21 H new ATOM 0 HA ARG A 104 -6.844 -8.147 -8.450 1.00 72.24 H new ATOM 0 HB2 ARG A 104 -6.042 -10.800 -9.679 1.00 22.32 H new ATOM 0 HB3 ARG A 104 -6.415 -10.585 -7.980 1.00 22.32 H new ATOM 0 HG2 ARG A 104 -8.689 -9.662 -8.840 1.00 75.25 H new ATOM 0 HG3 ARG A 104 -8.255 -10.454 -10.342 1.00 75.25 H new ATOM 0 HD2 ARG A 104 -8.379 -11.780 -7.600 1.00 21.10 H new ATOM 0 HD3 ARG A 104 -9.579 -11.946 -8.865 1.00 21.10 H new ATOM 0 HE ARG A 104 -7.100 -12.786 -9.944 1.00 74.53 H new ATOM 0 HH11 ARG A 104 -9.209 -13.727 -7.255 1.00 53.02 H new ATOM 0 HH12 ARG A 104 -8.898 -15.455 -7.451 1.00 53.02 H new ATOM 0 HH21 ARG A 104 -6.779 -15.042 -10.225 1.00 71.12 H new ATOM 0 HH22 ARG A 104 -7.536 -16.191 -9.116 1.00 71.12 H new ATOM 1479 N GLU A 105 -4.682 -8.575 -7.255 1.00 62.41 N ATOM 1480 CA GLU A 105 -3.425 -8.555 -6.547 1.00 53.21 C ATOM 1481 C GLU A 105 -2.933 -9.980 -6.310 1.00 33.31 C ATOM 1482 O GLU A 105 -1.862 -10.199 -5.729 1.00 43.04 O ATOM 1483 CB GLU A 105 -3.624 -7.849 -5.218 1.00 24.01 C ATOM 1484 CG GLU A 105 -3.970 -6.380 -5.340 1.00 1.44 C ATOM 1485 CD GLU A 105 -2.823 -5.557 -5.854 1.00 54.11 C ATOM 1486 OE1 GLU A 105 -2.579 -5.529 -7.081 1.00 4.13 O ATOM 1487 OE2 GLU A 105 -2.137 -4.912 -5.029 1.00 64.31 O ATOM 0 H GLU A 105 -5.494 -8.485 -6.644 1.00 62.41 H new ATOM 0 HA GLU A 105 -2.679 -8.026 -7.140 1.00 53.21 H new ATOM 0 HB2 GLU A 105 -4.418 -8.353 -4.667 1.00 24.01 H new ATOM 0 HB3 GLU A 105 -2.714 -7.948 -4.627 1.00 24.01 H new ATOM 0 HG2 GLU A 105 -4.823 -6.266 -6.009 1.00 1.44 H new ATOM 0 HG3 GLU A 105 -4.277 -6.001 -4.365 1.00 1.44 H new ATOM 1494 N ASP A 106 -3.732 -10.942 -6.751 1.00 21.13 N ATOM 1495 CA ASP A 106 -3.411 -12.344 -6.606 1.00 33.51 C ATOM 1496 C ASP A 106 -2.267 -12.745 -7.495 1.00 70.34 C ATOM 1497 O ASP A 106 -1.232 -13.216 -7.013 1.00 12.15 O ATOM 1498 CB ASP A 106 -4.620 -13.222 -6.915 1.00 72.41 C ATOM 1499 CG ASP A 106 -5.749 -13.050 -5.943 1.00 71.04 C ATOM 1500 OD1 ASP A 106 -6.494 -12.075 -6.061 1.00 64.40 O ATOM 1501 OD2 ASP A 106 -5.900 -13.904 -5.033 1.00 65.15 O ATOM 0 H ASP A 106 -4.621 -10.766 -7.219 1.00 21.13 H new ATOM 0 HA ASP A 106 -3.117 -12.492 -5.567 1.00 33.51 H new ATOM 0 HB2 ASP A 106 -4.978 -12.994 -7.919 1.00 72.41 H new ATOM 0 HB3 ASP A 106 -4.309 -14.267 -6.917 1.00 72.41 H new ATOM 1506 N ASN A 107 -2.429 -12.565 -8.794 1.00 0.21 N ATOM 1507 CA ASN A 107 -1.372 -12.993 -9.731 1.00 2.12 C ATOM 1508 C ASN A 107 -1.198 -12.002 -10.855 1.00 34.52 C ATOM 1509 O ASN A 107 -0.404 -12.240 -11.769 1.00 10.42 O ATOM 1510 CB ASN A 107 -1.700 -14.368 -10.347 1.00 34.04 C ATOM 1511 CG ASN A 107 -2.834 -14.324 -11.375 1.00 33.52 C ATOM 1512 OD1 ASN A 107 -2.597 -14.146 -12.571 1.00 64.53 O ATOM 1513 ND2 ASN A 107 -4.032 -14.489 -10.934 1.00 32.44 N ATOM 0 H ASN A 107 -3.249 -12.141 -9.227 1.00 0.21 H new ATOM 0 HA ASN A 107 -0.450 -13.056 -9.153 1.00 2.12 H new ATOM 0 HB2 ASN A 107 -0.804 -14.766 -10.823 1.00 34.04 H new ATOM 0 HB3 ASN A 107 -1.971 -15.059 -9.549 1.00 34.04 H new ATOM 0 HD21 ASN A 107 -4.820 -14.475 -11.581 1.00 32.44 H new ATOM 0 HD22 ASN A 107 -4.193 -14.634 -9.937 1.00 32.44 H new ATOM 1520 N SER A 108 -1.906 -10.892 -10.757 1.00 65.24 N ATOM 1521 CA SER A 108 -1.970 -9.886 -11.798 1.00 25.13 C ATOM 1522 C SER A 108 -2.754 -10.407 -13.024 1.00 73.00 C ATOM 1523 O SER A 108 -2.180 -10.872 -14.008 1.00 41.14 O ATOM 1524 CB SER A 108 -0.569 -9.321 -12.181 1.00 4.31 C ATOM 1525 OG SER A 108 -0.658 -8.224 -13.093 1.00 63.40 O ATOM 0 H SER A 108 -2.463 -10.661 -9.935 1.00 65.24 H new ATOM 0 HA SER A 108 -2.522 -9.039 -11.392 1.00 25.13 H new ATOM 0 HB2 SER A 108 -0.050 -8.999 -11.278 1.00 4.31 H new ATOM 0 HB3 SER A 108 0.031 -10.114 -12.627 1.00 4.31 H new ATOM 0 HG SER A 108 0.243 -7.900 -13.304 1.00 63.40 H new ATOM 1531 N GLU A 109 -4.071 -10.401 -12.897 1.00 41.12 N ATOM 1532 CA GLU A 109 -4.955 -10.747 -13.959 1.00 61.14 C ATOM 1533 C GLU A 109 -6.083 -9.745 -13.946 1.00 25.13 C ATOM 1534 O GLU A 109 -6.411 -9.212 -12.882 1.00 44.40 O ATOM 1535 CB GLU A 109 -5.467 -12.162 -13.809 1.00 33.15 C ATOM 1536 CG GLU A 109 -6.353 -12.448 -12.632 1.00 70.14 C ATOM 1537 CD GLU A 109 -6.836 -13.866 -12.681 1.00 54.11 C ATOM 1538 OE1 GLU A 109 -7.553 -14.225 -13.608 1.00 43.43 O ATOM 1539 OE2 GLU A 109 -6.461 -14.650 -11.814 1.00 62.34 O ATOM 0 H GLU A 109 -4.548 -10.149 -12.031 1.00 41.12 H new ATOM 0 HA GLU A 109 -4.433 -10.715 -14.915 1.00 61.14 H new ATOM 0 HB2 GLU A 109 -6.014 -12.421 -14.715 1.00 33.15 H new ATOM 0 HB3 GLU A 109 -4.607 -12.829 -13.754 1.00 33.15 H new ATOM 0 HG2 GLU A 109 -5.806 -12.274 -11.705 1.00 70.14 H new ATOM 0 HG3 GLU A 109 -7.203 -11.766 -12.633 1.00 70.14 H new ATOM 1546 N LYS A 110 -6.679 -9.493 -15.071 1.00 53.14 N ATOM 1547 CA LYS A 110 -7.615 -8.381 -15.160 1.00 42.12 C ATOM 1548 C LYS A 110 -9.083 -8.836 -15.188 1.00 63.03 C ATOM 1549 O LYS A 110 -9.409 -9.928 -15.664 1.00 53.33 O ATOM 1550 CB LYS A 110 -7.310 -7.488 -16.382 1.00 31.05 C ATOM 1551 CG LYS A 110 -7.848 -7.990 -17.714 1.00 71.30 C ATOM 1552 CD LYS A 110 -7.353 -7.127 -18.858 1.00 71.34 C ATOM 1553 CE LYS A 110 -8.171 -7.329 -20.134 1.00 24.04 C ATOM 1554 NZ LYS A 110 -8.324 -8.745 -20.513 1.00 73.33 N ATOM 0 H LYS A 110 -6.548 -10.022 -15.933 1.00 53.14 H new ATOM 0 HA LYS A 110 -7.476 -7.796 -14.251 1.00 42.12 H new ATOM 0 HB2 LYS A 110 -7.720 -6.496 -16.196 1.00 31.05 H new ATOM 0 HB3 LYS A 110 -6.229 -7.375 -16.466 1.00 31.05 H new ATOM 0 HG2 LYS A 110 -7.536 -9.023 -17.871 1.00 71.30 H new ATOM 0 HG3 LYS A 110 -8.938 -7.986 -17.695 1.00 71.30 H new ATOM 0 HD2 LYS A 110 -7.396 -6.078 -18.564 1.00 71.34 H new ATOM 0 HD3 LYS A 110 -6.307 -7.359 -19.059 1.00 71.34 H new ATOM 0 HE2 LYS A 110 -9.159 -6.888 -19.997 1.00 24.04 H new ATOM 0 HE3 LYS A 110 -7.693 -6.791 -20.952 1.00 24.04 H new ATOM 0 HZ1 LYS A 110 -8.753 -8.807 -21.459 1.00 73.33 H new ATOM 0 HZ2 LYS A 110 -7.391 -9.204 -20.525 1.00 73.33 H new ATOM 0 HZ3 LYS A 110 -8.937 -9.225 -19.823 1.00 73.33 H new ATOM 1568 N MET A 111 -9.938 -8.008 -14.636 1.00 0.42 N ATOM 1569 CA MET A 111 -11.378 -8.203 -14.661 1.00 13.51 C ATOM 1570 C MET A 111 -12.040 -6.922 -14.970 1.00 72.12 C ATOM 1571 O MET A 111 -11.441 -5.846 -14.852 1.00 70.00 O ATOM 1572 CB MET A 111 -11.990 -8.720 -13.381 1.00 44.23 C ATOM 1573 CG MET A 111 -11.495 -10.037 -12.915 1.00 75.23 C ATOM 1574 SD MET A 111 -12.487 -10.690 -11.550 1.00 13.32 S ATOM 1575 CE MET A 111 -12.570 -9.276 -10.475 1.00 21.21 C ATOM 0 H MET A 111 -9.651 -7.161 -14.146 1.00 0.42 H new ATOM 0 HA MET A 111 -11.536 -8.969 -15.421 1.00 13.51 H new ATOM 0 HB2 MET A 111 -11.813 -7.987 -12.594 1.00 44.23 H new ATOM 0 HB3 MET A 111 -13.069 -8.786 -13.517 1.00 44.23 H new ATOM 0 HG2 MET A 111 -11.510 -10.744 -13.744 1.00 75.23 H new ATOM 0 HG3 MET A 111 -10.457 -9.942 -12.596 1.00 75.23 H new ATOM 0 HE1 MET A 111 -13.059 -9.556 -9.542 1.00 21.21 H new ATOM 0 HE2 MET A 111 -11.562 -8.920 -10.263 1.00 21.21 H new ATOM 0 HE3 MET A 111 -13.140 -8.484 -10.960 1.00 21.21 H new ATOM 1585 N ALA A 112 -13.247 -7.023 -15.344 1.00 14.41 N ATOM 1586 CA ALA A 112 -14.018 -5.862 -15.710 1.00 12.31 C ATOM 1587 C ALA A 112 -15.029 -5.570 -14.637 1.00 3.02 C ATOM 1588 O ALA A 112 -15.911 -6.385 -14.356 1.00 40.54 O ATOM 1589 CB ALA A 112 -14.695 -6.048 -17.050 1.00 15.51 C ATOM 0 H ALA A 112 -13.752 -7.906 -15.413 1.00 14.41 H new ATOM 0 HA ALA A 112 -13.341 -5.013 -15.805 1.00 12.31 H new ATOM 0 HB1 ALA A 112 -15.268 -5.154 -17.295 1.00 15.51 H new ATOM 0 HB2 ALA A 112 -13.941 -6.218 -17.818 1.00 15.51 H new ATOM 0 HB3 ALA A 112 -15.365 -6.907 -17.003 1.00 15.51 H new ATOM 1595 N VAL A 113 -14.914 -4.429 -14.036 1.00 61.01 N ATOM 1596 CA VAL A 113 -15.782 -4.065 -12.948 1.00 2.12 C ATOM 1597 C VAL A 113 -16.251 -2.642 -13.125 1.00 54.10 C ATOM 1598 O VAL A 113 -15.820 -1.945 -14.040 1.00 1.22 O ATOM 1599 CB VAL A 113 -15.078 -4.190 -11.565 1.00 1.41 C ATOM 1600 CG1 VAL A 113 -14.588 -5.605 -11.300 1.00 3.04 C ATOM 1601 CG2 VAL A 113 -13.943 -3.204 -11.452 1.00 1.53 C ATOM 0 H VAL A 113 -14.221 -3.722 -14.280 1.00 61.01 H new ATOM 0 HA VAL A 113 -16.625 -4.756 -12.965 1.00 2.12 H new ATOM 0 HB VAL A 113 -15.821 -3.956 -10.803 1.00 1.41 H new ATOM 0 HG11 VAL A 113 -14.104 -5.646 -10.324 1.00 3.04 H new ATOM 0 HG12 VAL A 113 -15.434 -6.292 -11.314 1.00 3.04 H new ATOM 0 HG13 VAL A 113 -13.874 -5.893 -12.072 1.00 3.04 H new ATOM 0 HG21 VAL A 113 -13.465 -3.309 -10.478 1.00 1.53 H new ATOM 0 HG22 VAL A 113 -13.212 -3.399 -12.237 1.00 1.53 H new ATOM 0 HG23 VAL A 113 -14.329 -2.190 -11.559 1.00 1.53 H new ATOM 1611 N LYS A 114 -17.127 -2.219 -12.291 1.00 53.11 N ATOM 1612 CA LYS A 114 -17.561 -0.863 -12.326 1.00 72.51 C ATOM 1613 C LYS A 114 -17.172 -0.214 -11.022 1.00 51.11 C ATOM 1614 O LYS A 114 -17.007 -0.908 -10.020 1.00 11.24 O ATOM 1615 CB LYS A 114 -19.057 -0.794 -12.523 1.00 2.25 C ATOM 1616 CG LYS A 114 -19.535 -1.542 -13.744 1.00 42.30 C ATOM 1617 CD LYS A 114 -21.005 -1.357 -13.925 1.00 53.33 C ATOM 1618 CE LYS A 114 -21.569 -2.242 -15.024 1.00 40.32 C ATOM 1619 NZ LYS A 114 -20.992 -1.966 -16.350 1.00 40.03 N ATOM 0 H LYS A 114 -17.563 -2.793 -11.569 1.00 53.11 H new ATOM 0 HA LYS A 114 -17.091 -0.340 -13.159 1.00 72.51 H new ATOM 0 HB2 LYS A 114 -19.552 -1.200 -11.640 1.00 2.25 H new ATOM 0 HB3 LYS A 114 -19.358 0.251 -12.605 1.00 2.25 H new ATOM 0 HG2 LYS A 114 -19.006 -1.185 -14.627 1.00 42.30 H new ATOM 0 HG3 LYS A 114 -19.305 -2.603 -13.642 1.00 42.30 H new ATOM 0 HD2 LYS A 114 -21.514 -1.578 -12.987 1.00 53.33 H new ATOM 0 HD3 LYS A 114 -21.211 -0.313 -14.161 1.00 53.33 H new ATOM 0 HE2 LYS A 114 -21.389 -3.286 -14.768 1.00 40.32 H new ATOM 0 HE3 LYS A 114 -22.650 -2.107 -15.071 1.00 40.32 H new ATOM 0 HZ1 LYS A 114 -21.489 -2.529 -17.069 1.00 40.03 H new ATOM 0 HZ2 LYS A 114 -21.096 -0.955 -16.570 1.00 40.03 H new ATOM 0 HZ3 LYS A 114 -19.983 -2.218 -16.349 1.00 40.03 H new ATOM 1633 N THR A 115 -16.996 1.075 -11.014 1.00 52.21 N ATOM 1634 CA THR A 115 -16.651 1.747 -9.791 1.00 24.25 C ATOM 1635 C THR A 115 -17.288 3.124 -9.782 1.00 64.13 C ATOM 1636 O THR A 115 -17.845 3.560 -10.800 1.00 22.01 O ATOM 1637 CB THR A 115 -15.108 1.855 -9.592 1.00 34.14 C ATOM 1638 OG1 THR A 115 -14.816 2.259 -8.245 1.00 32.52 O ATOM 1639 CG2 THR A 115 -14.508 2.880 -10.548 1.00 73.14 C ATOM 0 H THR A 115 -17.084 1.679 -11.831 1.00 52.21 H new ATOM 0 HA THR A 115 -17.033 1.156 -8.959 1.00 24.25 H new ATOM 0 HB THR A 115 -14.673 0.876 -9.795 1.00 34.14 H new ATOM 0 HG1 THR A 115 -15.016 1.521 -7.632 1.00 32.52 H new ATOM 0 HG21 THR A 115 -13.431 2.938 -10.390 1.00 73.14 H new ATOM 0 HG22 THR A 115 -14.709 2.580 -11.576 1.00 73.14 H new ATOM 0 HG23 THR A 115 -14.955 3.857 -10.362 1.00 73.14 H new ATOM 1647 N TYR A 116 -17.207 3.789 -8.665 1.00 70.01 N ATOM 1648 CA TYR A 116 -17.794 5.081 -8.493 1.00 10.41 C ATOM 1649 C TYR A 116 -16.696 6.111 -8.304 1.00 0.35 C ATOM 1650 O TYR A 116 -15.969 6.089 -7.315 1.00 44.31 O ATOM 1651 CB TYR A 116 -18.781 5.078 -7.309 1.00 33.04 C ATOM 1652 CG TYR A 116 -19.977 4.151 -7.505 1.00 52.41 C ATOM 1653 CD1 TYR A 116 -19.875 2.786 -7.255 1.00 70.53 C ATOM 1654 CD2 TYR A 116 -21.203 4.645 -7.947 1.00 73.50 C ATOM 1655 CE1 TYR A 116 -20.953 1.940 -7.446 1.00 2.35 C ATOM 1656 CE2 TYR A 116 -22.286 3.805 -8.134 1.00 24.13 C ATOM 1657 CZ TYR A 116 -22.155 2.455 -7.885 1.00 63.23 C ATOM 1658 OH TYR A 116 -23.230 1.608 -8.096 1.00 42.41 O ATOM 0 H TYR A 116 -16.723 3.441 -7.837 1.00 70.01 H new ATOM 0 HA TYR A 116 -18.364 5.343 -9.384 1.00 10.41 H new ATOM 0 HB2 TYR A 116 -18.248 4.782 -6.405 1.00 33.04 H new ATOM 0 HB3 TYR A 116 -19.143 6.093 -7.148 1.00 33.04 H new ATOM 0 HD1 TYR A 116 -18.937 2.380 -6.906 1.00 70.53 H new ATOM 0 HD2 TYR A 116 -21.309 5.701 -8.147 1.00 73.50 H new ATOM 0 HE1 TYR A 116 -20.854 0.882 -7.252 1.00 2.35 H new ATOM 0 HE2 TYR A 116 -23.230 4.205 -8.474 1.00 24.13 H new ATOM 0 HH TYR A 116 -22.902 0.723 -8.361 1.00 42.41 H new ATOM 1668 N MET A 117 -16.559 6.977 -9.272 1.00 62.45 N ATOM 1669 CA MET A 117 -15.536 8.001 -9.248 1.00 21.24 C ATOM 1670 C MET A 117 -16.177 9.363 -9.121 1.00 0.03 C ATOM 1671 O MET A 117 -17.380 9.527 -9.421 1.00 35.33 O ATOM 1672 CB MET A 117 -14.581 7.962 -10.469 1.00 13.22 C ATOM 1673 CG MET A 117 -15.222 8.295 -11.781 1.00 14.11 C ATOM 1674 SD MET A 117 -14.051 8.402 -13.138 1.00 52.53 S ATOM 1675 CE MET A 117 -15.183 8.684 -14.486 1.00 24.52 C ATOM 0 H MET A 117 -17.151 6.997 -10.102 1.00 62.45 H new ATOM 0 HA MET A 117 -14.913 7.796 -8.377 1.00 21.24 H new ATOM 0 HB2 MET A 117 -13.762 8.660 -10.294 1.00 13.22 H new ATOM 0 HB3 MET A 117 -14.143 6.966 -10.538 1.00 13.22 H new ATOM 0 HG2 MET A 117 -15.970 7.537 -12.015 1.00 14.11 H new ATOM 0 HG3 MET A 117 -15.749 9.245 -11.689 1.00 14.11 H new ATOM 0 HE1 MET A 117 -15.025 7.931 -15.258 1.00 24.52 H new ATOM 0 HE2 MET A 117 -16.208 8.619 -14.120 1.00 24.52 H new ATOM 0 HE3 MET A 117 -15.010 9.675 -14.905 1.00 24.52 H new ATOM 1685 N TRP A 118 -15.405 10.316 -8.648 1.00 13.25 N ATOM 1686 CA TRP A 118 -15.863 11.668 -8.446 1.00 63.15 C ATOM 1687 C TRP A 118 -16.156 12.273 -9.821 1.00 54.44 C ATOM 1688 O TRP A 118 -15.289 12.300 -10.698 1.00 33.01 O ATOM 1689 CB TRP A 118 -14.769 12.434 -7.706 1.00 24.04 C ATOM 1690 CG TRP A 118 -15.146 13.793 -7.267 1.00 31.33 C ATOM 1691 CD1 TRP A 118 -14.632 14.969 -7.701 1.00 10.23 C ATOM 1692 CD2 TRP A 118 -16.128 14.113 -6.298 1.00 62.00 C ATOM 1693 NE1 TRP A 118 -15.226 16.001 -7.047 1.00 14.22 N ATOM 1694 CE2 TRP A 118 -16.158 15.504 -6.178 1.00 64.00 C ATOM 1695 CE3 TRP A 118 -16.984 13.348 -5.517 1.00 13.23 C ATOM 1696 CZ2 TRP A 118 -17.019 16.157 -5.301 1.00 42.00 C ATOM 1697 CZ3 TRP A 118 -17.835 13.976 -4.652 1.00 3.02 C ATOM 1698 CH2 TRP A 118 -17.854 15.376 -4.543 1.00 64.41 C ATOM 0 H TRP A 118 -14.429 10.169 -8.390 1.00 13.25 H new ATOM 0 HA TRP A 118 -16.773 11.712 -7.848 1.00 63.15 H new ATOM 0 HB2 TRP A 118 -14.470 11.856 -6.832 1.00 24.04 H new ATOM 0 HB3 TRP A 118 -13.896 12.507 -8.354 1.00 24.04 H new ATOM 0 HD1 TRP A 118 -13.865 15.071 -8.454 1.00 10.23 H new ATOM 0 HE1 TRP A 118 -15.011 16.989 -7.182 1.00 14.22 H new ATOM 0 HE3 TRP A 118 -16.977 12.271 -5.592 1.00 13.23 H new ATOM 0 HZ2 TRP A 118 -17.029 17.234 -5.221 1.00 42.00 H new ATOM 0 HZ3 TRP A 118 -18.504 13.386 -4.042 1.00 3.02 H new ATOM 0 HH2 TRP A 118 -18.537 15.846 -3.851 1.00 64.41 H new ATOM 1709 N ILE A 119 -17.373 12.761 -9.980 1.00 44.15 N ATOM 1710 CA ILE A 119 -17.924 13.091 -11.291 1.00 2.24 C ATOM 1711 C ILE A 119 -17.248 14.282 -11.966 1.00 13.20 C ATOM 1712 O ILE A 119 -16.929 14.220 -13.152 1.00 40.31 O ATOM 1713 CB ILE A 119 -19.436 13.367 -11.182 1.00 62.43 C ATOM 1714 CG1 ILE A 119 -20.093 12.238 -10.392 1.00 55.10 C ATOM 1715 CG2 ILE A 119 -20.052 13.455 -12.581 1.00 52.41 C ATOM 1716 CD1 ILE A 119 -21.567 12.418 -10.152 1.00 5.21 C ATOM 0 H ILE A 119 -18.012 12.942 -9.205 1.00 44.15 H new ATOM 0 HA ILE A 119 -17.733 12.220 -11.917 1.00 2.24 H new ATOM 0 HB ILE A 119 -19.599 14.314 -10.668 1.00 62.43 H new ATOM 0 HG12 ILE A 119 -19.937 11.300 -10.925 1.00 55.10 H new ATOM 0 HG13 ILE A 119 -19.590 12.145 -9.429 1.00 55.10 H new ATOM 0 HG21 ILE A 119 -21.121 13.650 -12.496 1.00 52.41 H new ATOM 0 HG22 ILE A 119 -19.578 14.264 -13.137 1.00 52.41 H new ATOM 0 HG23 ILE A 119 -19.896 12.513 -13.107 1.00 52.41 H new ATOM 0 HD11 ILE A 119 -21.949 11.570 -9.584 1.00 5.21 H new ATOM 0 HD12 ILE A 119 -21.735 13.336 -9.589 1.00 5.21 H new ATOM 0 HD13 ILE A 119 -22.087 12.478 -11.108 1.00 5.21 H new ATOM 1728 N ASN A 120 -16.983 15.340 -11.228 1.00 22.51 N ATOM 1729 CA ASN A 120 -16.368 16.512 -11.853 1.00 63.34 C ATOM 1730 C ASN A 120 -14.859 16.375 -11.877 1.00 13.33 C ATOM 1731 O ASN A 120 -14.172 17.174 -12.503 1.00 3.54 O ATOM 1732 CB ASN A 120 -16.806 17.844 -11.209 1.00 40.21 C ATOM 1733 CG ASN A 120 -16.312 18.033 -9.799 1.00 63.24 C ATOM 1734 OD1 ASN A 120 -16.971 17.639 -8.834 1.00 53.21 O ATOM 1735 ND2 ASN A 120 -15.177 18.665 -9.660 1.00 41.24 N ATOM 0 H ASN A 120 -17.172 15.422 -10.229 1.00 22.51 H new ATOM 0 HA ASN A 120 -16.730 16.547 -12.881 1.00 63.34 H new ATOM 0 HB2 ASN A 120 -16.445 18.669 -11.823 1.00 40.21 H new ATOM 0 HB3 ASN A 120 -17.895 17.897 -11.212 1.00 40.21 H new ATOM 0 HD21 ASN A 120 -14.806 18.848 -8.728 1.00 41.24 H new ATOM 0 HD22 ASN A 120 -14.662 18.975 -10.484 1.00 41.24 H new ATOM 1742 N LYS A 121 -14.366 15.342 -11.159 1.00 11.01 N ATOM 1743 CA LYS A 121 -12.939 14.872 -11.092 1.00 43.22 C ATOM 1744 C LYS A 121 -11.852 15.895 -10.682 1.00 12.14 C ATOM 1745 O LYS A 121 -10.814 15.503 -10.148 1.00 44.44 O ATOM 1746 CB LYS A 121 -12.523 14.072 -12.357 1.00 35.15 C ATOM 1747 CG LYS A 121 -12.589 14.851 -13.673 1.00 52.43 C ATOM 1748 CD LYS A 121 -12.347 13.978 -14.906 1.00 72.42 C ATOM 1749 CE LYS A 121 -13.429 12.906 -15.070 1.00 74.31 C ATOM 1750 NZ LYS A 121 -13.295 12.169 -16.350 1.00 2.24 N ATOM 0 H LYS A 121 -14.977 14.773 -10.573 1.00 11.01 H new ATOM 0 HA LYS A 121 -12.970 14.206 -10.229 1.00 43.22 H new ATOM 0 HB2 LYS A 121 -11.504 13.709 -12.219 1.00 35.15 H new ATOM 0 HB3 LYS A 121 -13.165 13.195 -12.440 1.00 35.15 H new ATOM 0 HG2 LYS A 121 -13.567 15.325 -13.758 1.00 52.43 H new ATOM 0 HG3 LYS A 121 -11.848 15.650 -13.651 1.00 52.43 H new ATOM 0 HD2 LYS A 121 -12.321 14.607 -15.796 1.00 72.42 H new ATOM 0 HD3 LYS A 121 -11.371 13.499 -14.826 1.00 72.42 H new ATOM 0 HE2 LYS A 121 -13.371 12.203 -14.239 1.00 74.31 H new ATOM 0 HE3 LYS A 121 -14.412 13.374 -15.023 1.00 74.31 H new ATOM 0 HZ1 LYS A 121 -13.982 11.388 -16.375 1.00 2.24 H new ATOM 0 HZ2 LYS A 121 -13.477 12.816 -17.144 1.00 2.24 H new ATOM 0 HZ3 LYS A 121 -12.332 11.785 -16.430 1.00 2.24 H new ATOM 1764 N ALA A 122 -12.058 17.151 -10.923 1.00 25.23 N ATOM 1765 CA ALA A 122 -11.054 18.133 -10.611 1.00 25.23 C ATOM 1766 C ALA A 122 -11.461 19.026 -9.460 1.00 63.12 C ATOM 1767 O ALA A 122 -12.220 19.986 -9.627 1.00 60.31 O ATOM 1768 CB ALA A 122 -10.679 18.942 -11.838 1.00 72.33 C ATOM 0 H ALA A 122 -12.912 17.527 -11.335 1.00 25.23 H new ATOM 0 HA ALA A 122 -10.167 17.589 -10.285 1.00 25.23 H new ATOM 0 HB1 ALA A 122 -9.918 19.676 -11.571 1.00 72.33 H new ATOM 0 HB2 ALA A 122 -10.287 18.276 -12.607 1.00 72.33 H new ATOM 0 HB3 ALA A 122 -11.562 19.456 -12.219 1.00 72.33 H new ATOM 1774 N ASP A 123 -11.000 18.669 -8.296 1.00 74.25 N ATOM 1775 CA ASP A 123 -11.198 19.472 -7.088 1.00 24.32 C ATOM 1776 C ASP A 123 -9.898 19.727 -6.383 1.00 23.55 C ATOM 1777 O ASP A 123 -9.224 18.785 -5.949 1.00 62.34 O ATOM 1778 CB ASP A 123 -12.208 18.858 -6.090 1.00 31.24 C ATOM 1779 CG ASP A 123 -13.645 19.115 -6.444 1.00 32.14 C ATOM 1780 OD1 ASP A 123 -14.194 18.410 -7.262 1.00 30.14 O ATOM 1781 OD2 ASP A 123 -14.250 20.054 -5.883 1.00 21.20 O ATOM 0 H ASP A 123 -10.471 17.811 -8.140 1.00 74.25 H new ATOM 0 HA ASP A 123 -11.621 20.413 -7.440 1.00 24.32 H new ATOM 0 HB2 ASP A 123 -12.044 17.782 -6.038 1.00 31.24 H new ATOM 0 HB3 ASP A 123 -12.011 19.259 -5.096 1.00 31.24 H new ATOM 1786 N PRO A 124 -9.504 21.008 -6.244 1.00 12.13 N ATOM 1787 CA PRO A 124 -8.303 21.391 -5.483 1.00 51.15 C ATOM 1788 C PRO A 124 -8.514 21.111 -3.997 1.00 70.23 C ATOM 1789 O PRO A 124 -7.569 21.075 -3.207 1.00 40.04 O ATOM 1790 CB PRO A 124 -8.189 22.908 -5.713 1.00 60.44 C ATOM 1791 CG PRO A 124 -9.066 23.195 -6.883 1.00 3.34 C ATOM 1792 CD PRO A 124 -10.170 22.184 -6.836 1.00 31.53 C ATOM 0 HA PRO A 124 -7.414 20.843 -5.793 1.00 51.15 H new ATOM 0 HB2 PRO A 124 -8.512 23.465 -4.833 1.00 60.44 H new ATOM 0 HB3 PRO A 124 -7.158 23.199 -5.913 1.00 60.44 H new ATOM 0 HG2 PRO A 124 -9.464 24.208 -6.832 1.00 3.34 H new ATOM 0 HG3 PRO A 124 -8.508 23.119 -7.816 1.00 3.34 H new ATOM 0 HD2 PRO A 124 -11.007 22.525 -6.227 1.00 31.53 H new ATOM 0 HD3 PRO A 124 -10.565 21.969 -7.829 1.00 31.53 H new ATOM 1800 N ASP A 125 -9.780 20.916 -3.655 1.00 14.33 N ATOM 1801 CA ASP A 125 -10.242 20.605 -2.311 1.00 65.55 C ATOM 1802 C ASP A 125 -9.633 19.354 -1.776 1.00 5.04 C ATOM 1803 O ASP A 125 -9.260 19.306 -0.605 1.00 15.52 O ATOM 1804 CB ASP A 125 -11.751 20.434 -2.287 1.00 0.40 C ATOM 1805 CG ASP A 125 -12.509 21.697 -2.516 1.00 50.15 C ATOM 1806 OD1 ASP A 125 -12.343 22.319 -3.568 1.00 64.42 O ATOM 1807 OD2 ASP A 125 -13.303 22.080 -1.637 1.00 10.10 O ATOM 0 H ASP A 125 -10.541 20.972 -4.332 1.00 14.33 H new ATOM 0 HA ASP A 125 -9.938 21.445 -1.686 1.00 65.55 H new ATOM 0 HB2 ASP A 125 -12.036 19.708 -3.049 1.00 0.40 H new ATOM 0 HB3 ASP A 125 -12.044 20.017 -1.324 1.00 0.40 H new ATOM 1812 N MET A 126 -9.530 18.328 -2.615 1.00 12.31 N ATOM 1813 CA MET A 126 -9.023 17.049 -2.164 1.00 51.13 C ATOM 1814 C MET A 126 -7.525 17.049 -1.906 1.00 35.44 C ATOM 1815 O MET A 126 -6.707 16.687 -2.754 1.00 53.05 O ATOM 1816 CB MET A 126 -9.514 15.865 -3.024 1.00 64.34 C ATOM 1817 CG MET A 126 -9.251 16.021 -4.505 1.00 4.20 C ATOM 1818 SD MET A 126 -9.983 14.714 -5.494 1.00 23.44 S ATOM 1819 CE MET A 126 -9.619 15.330 -7.123 1.00 45.41 C ATOM 0 H MET A 126 -9.790 18.362 -3.601 1.00 12.31 H new ATOM 0 HA MET A 126 -9.468 16.886 -1.183 1.00 51.13 H new ATOM 0 HB2 MET A 126 -9.031 14.953 -2.675 1.00 64.34 H new ATOM 0 HB3 MET A 126 -10.585 15.738 -2.868 1.00 64.34 H new ATOM 0 HG2 MET A 126 -9.642 16.982 -4.838 1.00 4.20 H new ATOM 0 HG3 MET A 126 -8.175 16.038 -4.677 1.00 4.20 H new ATOM 0 HE1 MET A 126 -10.526 15.317 -7.728 1.00 45.41 H new ATOM 0 HE2 MET A 126 -9.245 16.351 -7.051 1.00 45.41 H new ATOM 0 HE3 MET A 126 -8.862 14.699 -7.590 1.00 45.41 H new ATOM 2066 N LYS A 140 7.989 9.080 -7.468 1.00 5.12 N ATOM 2067 CA LYS A 140 8.027 10.159 -8.457 1.00 30.14 C ATOM 2068 C LYS A 140 9.239 11.064 -8.223 1.00 5.21 C ATOM 2069 O LYS A 140 9.844 11.575 -9.181 1.00 55.41 O ATOM 2070 CB LYS A 140 6.715 10.962 -8.347 1.00 21.13 C ATOM 2071 CG LYS A 140 6.584 12.204 -9.220 1.00 11.22 C ATOM 2072 CD LYS A 140 5.211 12.843 -9.013 1.00 33.01 C ATOM 2073 CE LYS A 140 5.055 14.147 -9.785 1.00 23.54 C ATOM 2074 NZ LYS A 140 3.716 14.748 -9.587 1.00 73.43 N ATOM 0 HA LYS A 140 8.122 9.741 -9.459 1.00 30.14 H new ATOM 0 HB2 LYS A 140 5.888 10.293 -8.585 1.00 21.13 H new ATOM 0 HB3 LYS A 140 6.590 11.265 -7.307 1.00 21.13 H new ATOM 0 HG2 LYS A 140 7.369 12.919 -8.971 1.00 11.22 H new ATOM 0 HG3 LYS A 140 6.716 11.938 -10.269 1.00 11.22 H new ATOM 0 HD2 LYS A 140 4.437 12.143 -9.327 1.00 33.01 H new ATOM 0 HD3 LYS A 140 5.058 13.032 -7.951 1.00 33.01 H new ATOM 0 HE2 LYS A 140 5.821 14.853 -9.464 1.00 23.54 H new ATOM 0 HE3 LYS A 140 5.217 13.962 -10.847 1.00 23.54 H new ATOM 0 HZ1 LYS A 140 3.649 15.633 -10.128 1.00 73.43 H new ATOM 0 HZ2 LYS A 140 2.986 14.085 -9.917 1.00 73.43 H new ATOM 0 HZ3 LYS A 140 3.571 14.948 -8.577 1.00 73.43 H new ATOM 2088 N LYS A 141 9.599 11.235 -6.939 1.00 55.41 N ATOM 2089 CA LYS A 141 10.706 12.099 -6.509 1.00 73.41 C ATOM 2090 C LYS A 141 11.999 11.881 -7.266 1.00 23.51 C ATOM 2091 O LYS A 141 12.755 12.823 -7.451 1.00 3.21 O ATOM 2092 CB LYS A 141 10.970 12.019 -5.011 1.00 33.34 C ATOM 2093 CG LYS A 141 9.876 12.580 -4.125 1.00 21.31 C ATOM 2094 CD LYS A 141 9.563 14.031 -4.469 1.00 31.33 C ATOM 2095 CE LYS A 141 8.676 14.667 -3.417 1.00 31.43 C ATOM 2096 NZ LYS A 141 9.360 14.728 -2.099 1.00 44.21 N ATOM 0 H LYS A 141 9.123 10.771 -6.165 1.00 55.41 H new ATOM 0 HA LYS A 141 10.356 13.102 -6.753 1.00 73.41 H new ATOM 0 HB2 LYS A 141 11.131 10.975 -4.743 1.00 33.34 H new ATOM 0 HB3 LYS A 141 11.897 12.550 -4.794 1.00 33.34 H new ATOM 0 HG2 LYS A 141 8.974 11.977 -4.234 1.00 21.31 H new ATOM 0 HG3 LYS A 141 10.182 12.511 -3.081 1.00 21.31 H new ATOM 0 HD2 LYS A 141 10.492 14.595 -4.554 1.00 31.33 H new ATOM 0 HD3 LYS A 141 9.071 14.079 -5.440 1.00 31.33 H new ATOM 0 HE2 LYS A 141 8.399 15.673 -3.732 1.00 31.43 H new ATOM 0 HE3 LYS A 141 7.752 14.096 -3.324 1.00 31.43 H new ATOM 0 HZ1 LYS A 141 8.932 15.479 -1.520 1.00 44.21 H new ATOM 0 HZ2 LYS A 141 9.257 13.815 -1.612 1.00 44.21 H new ATOM 0 HZ3 LYS A 141 10.370 14.933 -2.241 1.00 44.21 H new ATOM 2110 N LYS A 142 12.245 10.657 -7.710 1.00 2.04 N ATOM 2111 CA LYS A 142 13.449 10.339 -8.473 1.00 31.34 C ATOM 2112 C LYS A 142 13.580 11.255 -9.689 1.00 11.42 C ATOM 2113 O LYS A 142 14.647 11.820 -9.951 1.00 72.34 O ATOM 2114 CB LYS A 142 13.425 8.873 -8.919 1.00 42.03 C ATOM 2115 CG LYS A 142 14.589 8.488 -9.813 1.00 34.01 C ATOM 2116 CD LYS A 142 14.565 7.019 -10.170 1.00 31.41 C ATOM 2117 CE LYS A 142 15.689 6.676 -11.131 1.00 40.03 C ATOM 2118 NZ LYS A 142 17.028 7.034 -10.592 1.00 62.51 N ATOM 0 H LYS A 142 11.625 9.862 -7.555 1.00 2.04 H new ATOM 0 HA LYS A 142 14.312 10.499 -7.827 1.00 31.34 H new ATOM 0 HB2 LYS A 142 13.430 8.234 -8.036 1.00 42.03 H new ATOM 0 HB3 LYS A 142 12.492 8.679 -9.448 1.00 42.03 H new ATOM 0 HG2 LYS A 142 14.558 9.084 -10.725 1.00 34.01 H new ATOM 0 HG3 LYS A 142 15.527 8.724 -9.310 1.00 34.01 H new ATOM 0 HD2 LYS A 142 14.660 6.419 -9.265 1.00 31.41 H new ATOM 0 HD3 LYS A 142 13.606 6.766 -10.621 1.00 31.41 H new ATOM 0 HE2 LYS A 142 15.663 5.609 -11.350 1.00 40.03 H new ATOM 0 HE3 LYS A 142 15.529 7.199 -12.074 1.00 40.03 H new ATOM 0 HZ1 LYS A 142 17.767 6.602 -11.183 1.00 62.51 H new ATOM 0 HZ2 LYS A 142 17.140 8.068 -10.598 1.00 62.51 H new ATOM 0 HZ3 LYS A 142 17.115 6.682 -9.617 1.00 62.51 H new ATOM 2132 N PHE A 143 12.495 11.414 -10.406 1.00 35.13 N ATOM 2133 CA PHE A 143 12.465 12.258 -11.582 1.00 20.51 C ATOM 2134 C PHE A 143 12.420 13.711 -11.152 1.00 32.01 C ATOM 2135 O PHE A 143 13.039 14.586 -11.765 1.00 34.51 O ATOM 2136 CB PHE A 143 11.234 11.931 -12.435 1.00 21.44 C ATOM 2137 CG PHE A 143 11.155 10.494 -12.865 1.00 51.43 C ATOM 2138 CD1 PHE A 143 11.740 10.077 -14.048 1.00 4.31 C ATOM 2139 CD2 PHE A 143 10.498 9.560 -12.079 1.00 61.01 C ATOM 2140 CE1 PHE A 143 11.669 8.752 -14.442 1.00 72.43 C ATOM 2141 CE2 PHE A 143 10.425 8.236 -12.466 1.00 33.12 C ATOM 2142 CZ PHE A 143 11.011 7.832 -13.650 1.00 53.25 C ATOM 0 H PHE A 143 11.605 10.963 -10.193 1.00 35.13 H new ATOM 0 HA PHE A 143 13.361 12.079 -12.177 1.00 20.51 H new ATOM 0 HB2 PHE A 143 10.336 12.181 -11.870 1.00 21.44 H new ATOM 0 HB3 PHE A 143 11.240 12.565 -13.321 1.00 21.44 H new ATOM 0 HD1 PHE A 143 12.257 10.793 -14.670 1.00 4.31 H new ATOM 0 HD2 PHE A 143 10.038 9.871 -11.153 1.00 61.01 H new ATOM 0 HE1 PHE A 143 12.128 8.438 -15.368 1.00 72.43 H new ATOM 0 HE2 PHE A 143 9.911 7.518 -11.844 1.00 33.12 H new ATOM 0 HZ PHE A 143 10.955 6.798 -13.956 1.00 53.25 H new ATOM 2152 N ILE A 144 11.709 13.943 -10.065 1.00 3.22 N ATOM 2153 CA ILE A 144 11.500 15.271 -9.528 1.00 55.24 C ATOM 2154 C ILE A 144 12.799 15.934 -9.109 1.00 73.30 C ATOM 2155 O ILE A 144 12.922 17.121 -9.232 1.00 1.30 O ATOM 2156 CB ILE A 144 10.469 15.279 -8.368 1.00 53.10 C ATOM 2157 CG1 ILE A 144 9.134 14.700 -8.843 1.00 3.21 C ATOM 2158 CG2 ILE A 144 10.275 16.673 -7.784 1.00 13.35 C ATOM 2159 CD1 ILE A 144 8.531 15.415 -10.043 1.00 0.01 C ATOM 0 H ILE A 144 11.256 13.206 -9.525 1.00 3.22 H new ATOM 0 HA ILE A 144 11.081 15.863 -10.341 1.00 55.24 H new ATOM 0 HB ILE A 144 10.865 14.651 -7.570 1.00 53.10 H new ATOM 0 HG12 ILE A 144 9.277 13.649 -9.095 1.00 3.21 H new ATOM 0 HG13 ILE A 144 8.422 14.736 -8.018 1.00 3.21 H new ATOM 0 HG21 ILE A 144 9.545 16.630 -6.976 1.00 13.35 H new ATOM 0 HG22 ILE A 144 11.225 17.040 -7.396 1.00 13.35 H new ATOM 0 HG23 ILE A 144 9.916 17.347 -8.562 1.00 13.35 H new ATOM 0 HD11 ILE A 144 7.588 14.941 -10.313 1.00 0.01 H new ATOM 0 HD12 ILE A 144 8.353 16.461 -9.792 1.00 0.01 H new ATOM 0 HD13 ILE A 144 9.220 15.357 -10.885 1.00 0.01 H new ATOM 2171 N GLU A 145 13.770 15.162 -8.629 1.00 45.52 N ATOM 2172 CA GLU A 145 15.081 15.729 -8.264 1.00 51.21 C ATOM 2173 C GLU A 145 15.682 16.511 -9.447 1.00 12.35 C ATOM 2174 O GLU A 145 16.303 17.555 -9.266 1.00 15.43 O ATOM 2175 CB GLU A 145 16.050 14.643 -7.812 1.00 63.54 C ATOM 2176 CG GLU A 145 15.579 13.830 -6.617 1.00 51.54 C ATOM 2177 CD GLU A 145 15.225 14.664 -5.405 1.00 41.41 C ATOM 2178 OE1 GLU A 145 16.066 15.453 -4.919 1.00 24.11 O ATOM 2179 OE2 GLU A 145 14.105 14.511 -4.885 1.00 31.15 O ATOM 0 H GLU A 145 13.685 14.156 -8.482 1.00 45.52 H new ATOM 0 HA GLU A 145 14.922 16.413 -7.430 1.00 51.21 H new ATOM 0 HB2 GLU A 145 16.231 13.966 -8.647 1.00 63.54 H new ATOM 0 HB3 GLU A 145 17.005 15.107 -7.565 1.00 63.54 H new ATOM 0 HG2 GLU A 145 14.707 13.245 -6.910 1.00 51.54 H new ATOM 0 HG3 GLU A 145 16.360 13.122 -6.342 1.00 51.54 H new ATOM 2186 N THR A 146 15.454 16.010 -10.645 1.00 63.30 N ATOM 2187 CA THR A 146 15.896 16.666 -11.845 1.00 72.11 C ATOM 2188 C THR A 146 14.995 17.892 -12.122 1.00 74.03 C ATOM 2189 O THR A 146 15.479 18.984 -12.461 1.00 53.33 O ATOM 2190 CB THR A 146 15.825 15.679 -13.035 1.00 21.21 C ATOM 2191 OG1 THR A 146 16.640 14.518 -12.742 1.00 14.33 O ATOM 2192 CG2 THR A 146 16.301 16.331 -14.328 1.00 54.33 C ATOM 0 H THR A 146 14.956 15.135 -10.807 1.00 63.30 H new ATOM 0 HA THR A 146 16.927 16.998 -11.720 1.00 72.11 H new ATOM 0 HB THR A 146 14.786 15.381 -13.174 1.00 21.21 H new ATOM 0 HG1 THR A 146 16.596 13.890 -13.493 1.00 14.33 H new ATOM 0 HG21 THR A 146 16.238 15.610 -15.143 1.00 54.33 H new ATOM 0 HG22 THR A 146 15.671 17.191 -14.555 1.00 54.33 H new ATOM 0 HG23 THR A 146 17.334 16.658 -14.212 1.00 54.33 H new ATOM 2200 N PHE A 147 13.693 17.697 -11.940 1.00 51.10 N ATOM 2201 CA PHE A 147 12.696 18.742 -12.158 1.00 25.40 C ATOM 2202 C PHE A 147 12.759 19.883 -11.177 1.00 41.31 C ATOM 2203 O PHE A 147 12.392 20.999 -11.524 1.00 44.04 O ATOM 2204 CB PHE A 147 11.280 18.198 -12.312 1.00 71.54 C ATOM 2205 CG PHE A 147 11.081 17.534 -13.624 1.00 61.55 C ATOM 2206 CD1 PHE A 147 10.993 18.307 -14.755 1.00 21.23 C ATOM 2207 CD2 PHE A 147 11.008 16.159 -13.742 1.00 30.34 C ATOM 2208 CE1 PHE A 147 10.833 17.747 -15.984 1.00 1.12 C ATOM 2209 CE2 PHE A 147 10.847 15.573 -14.983 1.00 53.11 C ATOM 2210 CZ PHE A 147 10.760 16.371 -16.113 1.00 14.12 C ATOM 0 H PHE A 147 13.297 16.807 -11.636 1.00 51.10 H new ATOM 0 HA PHE A 147 12.977 19.174 -13.119 1.00 25.40 H new ATOM 0 HB2 PHE A 147 11.075 17.488 -11.511 1.00 71.54 H new ATOM 0 HB3 PHE A 147 10.564 19.013 -12.206 1.00 71.54 H new ATOM 0 HD1 PHE A 147 11.052 19.382 -14.667 1.00 21.23 H new ATOM 0 HD2 PHE A 147 11.077 15.539 -12.860 1.00 30.34 H new ATOM 0 HE1 PHE A 147 10.763 18.376 -16.859 1.00 1.12 H new ATOM 0 HE2 PHE A 147 10.789 14.498 -15.072 1.00 53.11 H new ATOM 0 HZ PHE A 147 10.636 15.922 -17.087 1.00 14.12 H new ATOM 2220 N LYS A 148 13.207 19.610 -9.955 1.00 45.21 N ATOM 2221 CA LYS A 148 13.374 20.648 -8.951 1.00 14.00 C ATOM 2222 C LYS A 148 14.219 21.744 -9.511 1.00 4.03 C ATOM 2223 O LYS A 148 13.839 22.890 -9.493 1.00 55.24 O ATOM 2224 CB LYS A 148 14.085 20.124 -7.702 1.00 11.33 C ATOM 2225 CG LYS A 148 13.329 19.117 -6.881 1.00 61.50 C ATOM 2226 CD LYS A 148 14.180 18.680 -5.709 1.00 1.05 C ATOM 2227 CE LYS A 148 13.455 17.709 -4.816 1.00 2.43 C ATOM 2228 NZ LYS A 148 14.318 17.253 -3.714 1.00 70.53 N ATOM 0 H LYS A 148 13.461 18.674 -9.638 1.00 45.21 H new ATOM 0 HA LYS A 148 12.378 20.999 -8.680 1.00 14.00 H new ATOM 0 HB2 LYS A 148 15.030 19.676 -8.009 1.00 11.33 H new ATOM 0 HB3 LYS A 148 14.327 20.974 -7.064 1.00 11.33 H new ATOM 0 HG2 LYS A 148 12.395 19.551 -6.524 1.00 61.50 H new ATOM 0 HG3 LYS A 148 13.066 18.255 -7.495 1.00 61.50 H new ATOM 0 HD2 LYS A 148 15.096 18.218 -6.078 1.00 1.05 H new ATOM 0 HD3 LYS A 148 14.475 19.555 -5.129 1.00 1.05 H new ATOM 0 HE2 LYS A 148 12.561 18.182 -4.410 1.00 2.43 H new ATOM 0 HE3 LYS A 148 13.123 16.851 -5.401 1.00 2.43 H new ATOM 0 HZ1 LYS A 148 13.798 16.572 -3.125 1.00 70.53 H new ATOM 0 HZ2 LYS A 148 15.167 16.796 -4.104 1.00 70.53 H new ATOM 0 HZ3 LYS A 148 14.600 18.069 -3.134 1.00 70.53 H new ATOM 2242 N LYS A 149 15.334 21.352 -10.090 1.00 24.42 N ATOM 2243 CA LYS A 149 16.312 22.275 -10.610 1.00 64.10 C ATOM 2244 C LYS A 149 15.760 23.013 -11.814 1.00 44.52 C ATOM 2245 O LYS A 149 16.012 24.205 -11.999 1.00 13.14 O ATOM 2246 CB LYS A 149 17.581 21.518 -10.956 1.00 52.42 C ATOM 2247 CG LYS A 149 18.145 20.755 -9.762 1.00 3.32 C ATOM 2248 CD LYS A 149 19.401 19.982 -10.101 1.00 61.23 C ATOM 2249 CE LYS A 149 20.517 20.902 -10.543 1.00 44.33 C ATOM 2250 NZ LYS A 149 21.754 20.163 -10.821 1.00 51.14 N ATOM 0 H LYS A 149 15.587 20.371 -10.213 1.00 24.42 H new ATOM 0 HA LYS A 149 16.548 23.022 -9.852 1.00 64.10 H new ATOM 0 HB2 LYS A 149 17.375 20.819 -11.766 1.00 52.42 H new ATOM 0 HB3 LYS A 149 18.331 22.219 -11.323 1.00 52.42 H new ATOM 0 HG2 LYS A 149 18.362 21.457 -8.957 1.00 3.32 H new ATOM 0 HG3 LYS A 149 17.389 20.065 -9.387 1.00 3.32 H new ATOM 0 HD2 LYS A 149 19.723 19.410 -9.231 1.00 61.23 H new ATOM 0 HD3 LYS A 149 19.185 19.264 -10.892 1.00 61.23 H new ATOM 0 HE2 LYS A 149 20.209 21.444 -11.437 1.00 44.33 H new ATOM 0 HE3 LYS A 149 20.704 21.645 -9.768 1.00 44.33 H new ATOM 0 HZ1 LYS A 149 22.495 20.828 -11.121 1.00 51.14 H new ATOM 0 HZ2 LYS A 149 22.062 19.666 -9.961 1.00 51.14 H new ATOM 0 HZ3 LYS A 149 21.582 19.471 -11.578 1.00 51.14 H new ATOM 2264 N ILE A 150 14.975 22.305 -12.607 1.00 70.32 N ATOM 2265 CA ILE A 150 14.319 22.880 -13.766 1.00 64.10 C ATOM 2266 C ILE A 150 13.320 23.953 -13.315 1.00 15.44 C ATOM 2267 O ILE A 150 13.220 25.030 -13.920 1.00 21.13 O ATOM 2268 CB ILE A 150 13.606 21.774 -14.619 1.00 54.34 C ATOM 2269 CG1 ILE A 150 14.663 20.772 -15.107 1.00 54.12 C ATOM 2270 CG2 ILE A 150 12.858 22.393 -15.798 1.00 13.34 C ATOM 2271 CD1 ILE A 150 14.107 19.587 -15.849 1.00 5.21 C ATOM 0 H ILE A 150 14.775 21.315 -12.465 1.00 70.32 H new ATOM 0 HA ILE A 150 15.074 23.344 -14.400 1.00 64.10 H new ATOM 0 HB ILE A 150 12.870 21.257 -14.004 1.00 54.34 H new ATOM 0 HG12 ILE A 150 15.366 21.293 -15.756 1.00 54.12 H new ATOM 0 HG13 ILE A 150 15.229 20.413 -14.247 1.00 54.12 H new ATOM 0 HG21 ILE A 150 12.372 21.606 -16.374 1.00 13.34 H new ATOM 0 HG22 ILE A 150 12.105 23.088 -15.427 1.00 13.34 H new ATOM 0 HG23 ILE A 150 13.562 22.927 -16.436 1.00 13.34 H new ATOM 0 HD11 ILE A 150 14.924 18.934 -16.156 1.00 5.21 H new ATOM 0 HD12 ILE A 150 13.427 19.037 -15.199 1.00 5.21 H new ATOM 0 HD13 ILE A 150 13.567 19.931 -16.731 1.00 5.21 H new ATOM 2283 N MET A 151 12.631 23.666 -12.232 1.00 52.31 N ATOM 2284 CA MET A 151 11.675 24.553 -11.655 1.00 74.52 C ATOM 2285 C MET A 151 12.379 25.724 -10.953 1.00 12.55 C ATOM 2286 O MET A 151 11.921 26.854 -11.029 1.00 12.01 O ATOM 2287 CB MET A 151 10.793 23.773 -10.685 1.00 3.32 C ATOM 2288 CG MET A 151 9.729 24.600 -10.036 1.00 64.14 C ATOM 2289 SD MET A 151 8.661 23.650 -8.921 1.00 5.25 S ATOM 2290 CE MET A 151 9.850 23.046 -7.716 1.00 41.44 C ATOM 0 H MET A 151 12.731 22.786 -11.725 1.00 52.31 H new ATOM 0 HA MET A 151 11.047 24.976 -12.440 1.00 74.52 H new ATOM 0 HB2 MET A 151 10.323 22.948 -11.220 1.00 3.32 H new ATOM 0 HB3 MET A 151 11.422 23.334 -9.910 1.00 3.32 H new ATOM 0 HG2 MET A 151 10.198 25.409 -9.476 1.00 64.14 H new ATOM 0 HG3 MET A 151 9.115 25.062 -10.809 1.00 64.14 H new ATOM 0 HE1 MET A 151 9.325 22.728 -6.815 1.00 41.44 H new ATOM 0 HE2 MET A 151 10.396 22.201 -8.136 1.00 41.44 H new ATOM 0 HE3 MET A 151 10.551 23.843 -7.465 1.00 41.44 H new ATOM 2300 N GLU A 152 13.500 25.440 -10.291 1.00 74.53 N ATOM 2301 CA GLU A 152 14.311 26.470 -9.613 1.00 2.12 C ATOM 2302 C GLU A 152 14.851 27.464 -10.613 1.00 24.34 C ATOM 2303 O GLU A 152 14.998 28.643 -10.319 1.00 21.53 O ATOM 2304 CB GLU A 152 15.482 25.839 -8.861 1.00 63.20 C ATOM 2305 CG GLU A 152 15.083 24.913 -7.736 1.00 73.04 C ATOM 2306 CD GLU A 152 16.270 24.280 -7.066 1.00 35.02 C ATOM 2307 OE1 GLU A 152 16.952 23.467 -7.700 1.00 25.43 O ATOM 2308 OE2 GLU A 152 16.543 24.602 -5.899 1.00 5.11 O ATOM 0 H GLU A 152 13.877 24.496 -10.205 1.00 74.53 H new ATOM 0 HA GLU A 152 13.662 26.981 -8.902 1.00 2.12 H new ATOM 0 HB2 GLU A 152 16.095 25.284 -9.571 1.00 63.20 H new ATOM 0 HB3 GLU A 152 16.106 26.635 -8.455 1.00 63.20 H new ATOM 0 HG2 GLU A 152 14.507 25.470 -6.997 1.00 73.04 H new ATOM 0 HG3 GLU A 152 14.430 24.132 -8.126 1.00 73.04 H new ATOM 2315 N CYS A 153 15.159 26.968 -11.782 1.00 12.44 N ATOM 2316 CA CYS A 153 15.652 27.776 -12.863 1.00 2.13 C ATOM 2317 C CYS A 153 14.564 28.750 -13.326 1.00 61.42 C ATOM 2318 O CYS A 153 14.849 29.898 -13.676 1.00 55.55 O ATOM 2319 CB CYS A 153 16.086 26.857 -14.009 1.00 33.11 C ATOM 2320 SG CYS A 153 16.812 27.679 -15.442 1.00 32.12 S ATOM 0 H CYS A 153 15.073 25.978 -12.012 1.00 12.44 H new ATOM 0 HA CYS A 153 16.509 28.362 -12.531 1.00 2.13 H new ATOM 0 HB2 CYS A 153 16.809 26.139 -13.621 1.00 33.11 H new ATOM 0 HB3 CYS A 153 15.218 26.287 -14.341 1.00 33.11 H new ATOM 0 HG CYS A 153 17.136 26.791 -16.334 1.00 32.12 H new ATOM 2326 N LYS A 154 13.320 28.293 -13.302 1.00 34.43 N ATOM 2327 CA LYS A 154 12.197 29.102 -13.727 1.00 70.13 C ATOM 2328 C LYS A 154 11.723 30.033 -12.628 1.00 71.21 C ATOM 2329 O LYS A 154 11.455 31.205 -12.872 1.00 54.32 O ATOM 2330 CB LYS A 154 11.052 28.225 -14.174 1.00 3.04 C ATOM 2331 CG LYS A 154 11.391 27.336 -15.340 1.00 30.11 C ATOM 2332 CD LYS A 154 10.186 26.554 -15.765 1.00 13.41 C ATOM 2333 CE LYS A 154 10.480 25.618 -16.935 1.00 2.10 C ATOM 2334 NZ LYS A 154 10.909 26.343 -18.153 1.00 24.43 N ATOM 0 H LYS A 154 13.066 27.356 -12.989 1.00 34.43 H new ATOM 0 HA LYS A 154 12.539 29.711 -14.564 1.00 70.13 H new ATOM 0 HB2 LYS A 154 10.732 27.605 -13.336 1.00 3.04 H new ATOM 0 HB3 LYS A 154 10.206 28.857 -14.444 1.00 3.04 H new ATOM 0 HG2 LYS A 154 11.754 27.939 -16.172 1.00 30.11 H new ATOM 0 HG3 LYS A 154 12.196 26.655 -15.065 1.00 30.11 H new ATOM 0 HD2 LYS A 154 9.819 25.971 -14.921 1.00 13.41 H new ATOM 0 HD3 LYS A 154 9.390 27.243 -16.046 1.00 13.41 H new ATOM 0 HE2 LYS A 154 11.258 24.913 -16.644 1.00 2.10 H new ATOM 0 HE3 LYS A 154 9.588 25.033 -17.160 1.00 2.10 H new ATOM 0 HZ1 LYS A 154 10.964 25.679 -18.951 1.00 24.43 H new ATOM 0 HZ2 LYS A 154 10.221 27.091 -18.372 1.00 24.43 H new ATOM 0 HZ3 LYS A 154 11.844 26.769 -17.992 1.00 24.43 H new