USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1084 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 98 SER OG : rot 147:sc= 0.64 USER MOD Set 1.2: A 107 GLN :FLIP amide:sc= 0.528 F(o=-1.7,f=1.2) USER MOD Set 2.1: A 83 HIS : no HD1:sc= -0.192 X(o=-0.19,f=0.0073) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 35 ASN : amide:sc= -0.3 K(o=0.47,f=-4.5!) USER MOD Set 3.2: A 77 TYR OH : rot 2:sc= 0.771 USER MOD Set 4.1: A 34 ASN :FLIP amide:sc= -0.918 F(o=-3.5,f=-1.4) USER MOD Set 4.2: A 57 ASN : amide:sc= -0.452 K(o=-1.4,f=-3) USER MOD Single : A 14 CYS SG : rot -15:sc= -8.81! USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 155:sc= -4.71! (180deg=-6.64!) USER MOD Single : A 41 LYS NZ :NH3+ 172:sc= 0.311 (180deg=0.285) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl -131:sc= -0.0882 (180deg=-1.92!) USER MOD Single : A 56 GLN :FLIP amide:sc= -0.17 F(o=-1.3,f=-0.17) USER MOD Single : A 59 SER OG : rot 180:sc= -0.321 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.13 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot 81:sc= -4.49! USER MOD Single : A 97 SER OG : rot -61:sc= -0.0691 USER MOD Single : A 102 CYS SG : rot 180:sc= -1.29 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc=-0.00579 X(o=-0.0058,f=0) USER MOD Single : A 108 MET CE :methyl -158:sc= -0.016 (180deg=-0.579) USER MOD Single : A 109 MET CE :methyl -127:sc= -0.77 (180deg=-1.69) USER MOD Single : A 110 TYR OH : rot 96:sc= 0.22 USER MOD Single : A 113 SER OG : rot 113:sc= 1.33 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 119 GLN : amide:sc= -0.231 K(o=-0.23,f=-1.8!) USER MOD Single : A 120 THR OG1 : rot 81:sc= 1.13 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.149 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 180:sc= -1.03 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 142:sc= 0.0146 (180deg=-0.0337) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.858 -1.465 -0.994 1.00 52.44 N ATOM 136 CA VAL A 13 16.949 -0.325 -0.972 1.00 52.30 C ATOM 137 C VAL A 13 16.845 0.322 -2.349 1.00 30.51 C ATOM 138 O VAL A 13 17.798 0.302 -3.129 1.00 35.01 O ATOM 139 CB VAL A 13 17.402 0.736 0.048 1.00 1.31 C ATOM 140 CG1 VAL A 13 18.692 1.400 -0.410 1.00 22.03 C ATOM 141 CG2 VAL A 13 16.308 1.770 0.263 1.00 74.30 C ATOM 0 HA VAL A 13 15.971 -0.707 -0.678 1.00 52.30 H new ATOM 0 HB VAL A 13 17.594 0.241 1.000 1.00 1.31 H new ATOM 0 HG11 VAL A 13 18.997 2.147 0.323 1.00 22.03 H new ATOM 0 HG12 VAL A 13 19.474 0.647 -0.508 1.00 22.03 H new ATOM 0 HG13 VAL A 13 18.530 1.883 -1.374 1.00 22.03 H new ATOM 0 HG21 VAL A 13 16.646 2.512 0.987 1.00 74.30 H new ATOM 0 HG22 VAL A 13 16.082 2.262 -0.683 1.00 74.30 H new ATOM 0 HG23 VAL A 13 15.411 1.278 0.639 1.00 74.30 H new ATOM 151 N CYS A 14 15.681 0.893 -2.642 1.00 4.33 N ATOM 152 CA CYS A 14 15.452 1.546 -3.925 1.00 41.34 C ATOM 153 C CYS A 14 15.115 3.020 -3.733 1.00 4.44 C ATOM 154 O CYS A 14 15.227 3.554 -2.630 1.00 22.21 O ATOM 155 CB CYS A 14 14.322 0.847 -4.683 1.00 20.43 C ATOM 156 SG CYS A 14 12.687 1.560 -4.392 1.00 54.22 S ATOM 0 H CYS A 14 14.882 0.916 -2.008 1.00 4.33 H new ATOM 0 HA CYS A 14 16.370 1.475 -4.509 1.00 41.34 H new ATOM 0 HB2 CYS A 14 14.538 0.884 -5.751 1.00 20.43 H new ATOM 0 HB3 CYS A 14 14.304 -0.205 -4.398 1.00 20.43 H new ATOM 0 HG CYS A 14 12.731 2.334 -3.348 1.00 54.22 H new ATOM 162 N GLU A 15 14.703 3.674 -4.814 1.00 55.43 N ATOM 163 CA GLU A 15 14.351 5.089 -4.764 1.00 73.22 C ATOM 164 C GLU A 15 12.909 5.308 -5.213 1.00 23.33 C ATOM 165 O GLU A 15 12.424 4.643 -6.128 1.00 3.12 O ATOM 166 CB GLU A 15 15.300 5.904 -5.645 1.00 3.24 C ATOM 167 CG GLU A 15 14.941 5.871 -7.120 1.00 61.44 C ATOM 168 CD GLU A 15 16.144 6.083 -8.019 1.00 10.02 C ATOM 169 OE1 GLU A 15 16.527 7.253 -8.231 1.00 61.23 O ATOM 170 OE2 GLU A 15 16.702 5.079 -8.508 1.00 43.43 O ATOM 0 H GLU A 15 14.605 3.247 -5.735 1.00 55.43 H new ATOM 0 HA GLU A 15 14.446 5.424 -3.731 1.00 73.22 H new ATOM 0 HB2 GLU A 15 15.301 6.939 -5.303 1.00 3.24 H new ATOM 0 HB3 GLU A 15 16.314 5.526 -5.518 1.00 3.24 H new ATOM 0 HG2 GLU A 15 14.480 4.912 -7.356 1.00 61.44 H new ATOM 0 HG3 GLU A 15 14.198 6.641 -7.326 1.00 61.44 H new ATOM 177 N VAL A 16 12.228 6.245 -4.559 1.00 64.43 N ATOM 178 CA VAL A 16 10.842 6.553 -4.890 1.00 65.13 C ATOM 179 C VAL A 16 10.739 7.224 -6.255 1.00 3.10 C ATOM 180 O VAL A 16 10.876 8.443 -6.371 1.00 71.20 O ATOM 181 CB VAL A 16 10.203 7.468 -3.831 1.00 35.13 C ATOM 182 CG1 VAL A 16 11.022 8.738 -3.655 1.00 73.22 C ATOM 183 CG2 VAL A 16 8.767 7.799 -4.209 1.00 31.52 C ATOM 0 H VAL A 16 12.614 6.803 -3.798 1.00 64.43 H new ATOM 0 HA VAL A 16 10.304 5.605 -4.913 1.00 65.13 H new ATOM 0 HB VAL A 16 10.192 6.937 -2.879 1.00 35.13 H new ATOM 0 HG11 VAL A 16 10.553 9.372 -2.902 1.00 73.22 H new ATOM 0 HG12 VAL A 16 12.031 8.479 -3.334 1.00 73.22 H new ATOM 0 HG13 VAL A 16 11.069 9.275 -4.602 1.00 73.22 H new ATOM 0 HG21 VAL A 16 8.331 8.447 -3.449 1.00 31.52 H new ATOM 0 HG22 VAL A 16 8.753 8.309 -5.172 1.00 31.52 H new ATOM 0 HG23 VAL A 16 8.187 6.878 -4.277 1.00 31.52 H new ATOM 193 N ASP A 17 10.496 6.423 -7.286 1.00 50.15 N ATOM 194 CA ASP A 17 10.373 6.940 -8.644 1.00 54.14 C ATOM 195 C ASP A 17 9.747 8.330 -8.641 1.00 52.12 C ATOM 196 O ASP A 17 8.825 8.621 -7.880 1.00 14.24 O ATOM 197 CB ASP A 17 9.533 5.990 -9.500 1.00 74.22 C ATOM 198 CG ASP A 17 9.513 6.392 -10.961 1.00 71.01 C ATOM 199 OD1 ASP A 17 8.669 7.234 -11.334 1.00 23.20 O ATOM 200 OD2 ASP A 17 10.341 5.864 -11.733 1.00 44.24 O ATOM 0 H ASP A 17 10.380 5.413 -7.207 1.00 50.15 H new ATOM 0 HA ASP A 17 11.373 7.013 -9.071 1.00 54.14 H new ATOM 0 HB2 ASP A 17 9.929 4.978 -9.410 1.00 74.22 H new ATOM 0 HB3 ASP A 17 8.512 5.968 -9.118 1.00 74.22 H new ATOM 205 N PRO A 18 10.259 9.212 -9.513 1.00 34.11 N ATOM 206 CA PRO A 18 9.764 10.587 -9.630 1.00 42.21 C ATOM 207 C PRO A 18 8.367 10.651 -10.236 1.00 14.41 C ATOM 208 O PRO A 18 7.576 11.534 -9.902 1.00 33.15 O ATOM 209 CB PRO A 18 10.781 11.252 -10.561 1.00 24.31 C ATOM 210 CG PRO A 18 11.351 10.131 -11.362 1.00 72.22 C ATOM 211 CD PRO A 18 11.358 8.934 -10.452 1.00 43.14 C ATOM 0 HA PRO A 18 9.674 11.072 -8.658 1.00 42.21 H new ATOM 0 HB2 PRO A 18 10.305 11.994 -11.202 1.00 24.31 H new ATOM 0 HB3 PRO A 18 11.556 11.769 -9.996 1.00 24.31 H new ATOM 0 HG2 PRO A 18 10.750 9.942 -12.251 1.00 72.22 H new ATOM 0 HG3 PRO A 18 12.359 10.368 -11.703 1.00 72.22 H new ATOM 0 HD2 PRO A 18 11.191 8.009 -11.004 1.00 43.14 H new ATOM 0 HD3 PRO A 18 12.311 8.828 -9.934 1.00 43.14 H new ATOM 219 N GLU A 19 8.069 9.712 -11.127 1.00 55.01 N ATOM 220 CA GLU A 19 6.765 9.663 -11.780 1.00 3.34 C ATOM 221 C GLU A 19 5.685 9.209 -10.801 1.00 41.44 C ATOM 222 O GLU A 19 4.509 9.539 -10.962 1.00 3.11 O ATOM 223 CB GLU A 19 6.808 8.721 -12.984 1.00 32.12 C ATOM 224 CG GLU A 19 6.432 7.287 -12.648 1.00 63.23 C ATOM 225 CD GLU A 19 5.034 6.926 -13.112 1.00 64.25 C ATOM 226 OE1 GLU A 19 4.073 7.192 -12.361 1.00 3.32 O ATOM 227 OE2 GLU A 19 4.902 6.376 -14.225 1.00 63.13 O ATOM 0 H GLU A 19 8.712 8.974 -11.414 1.00 55.01 H new ATOM 0 HA GLU A 19 6.520 10.668 -12.124 1.00 3.34 H new ATOM 0 HB2 GLU A 19 6.131 9.095 -13.752 1.00 32.12 H new ATOM 0 HB3 GLU A 19 7.811 8.735 -13.410 1.00 32.12 H new ATOM 0 HG2 GLU A 19 7.150 6.609 -13.110 1.00 63.23 H new ATOM 0 HG3 GLU A 19 6.502 7.140 -11.570 1.00 63.23 H new ATOM 234 N LEU A 20 6.091 8.451 -9.790 1.00 45.21 N ATOM 235 CA LEU A 20 5.159 7.951 -8.786 1.00 21.41 C ATOM 236 C LEU A 20 5.029 8.933 -7.627 1.00 14.10 C ATOM 237 O LEU A 20 3.925 9.210 -7.155 1.00 4.23 O ATOM 238 CB LEU A 20 5.622 6.589 -8.266 1.00 65.40 C ATOM 239 CG LEU A 20 4.517 5.619 -7.844 1.00 12.40 C ATOM 240 CD1 LEU A 20 5.097 4.250 -7.531 1.00 62.21 C ATOM 241 CD2 LEU A 20 3.758 6.166 -6.643 1.00 24.10 C ATOM 0 H LEU A 20 7.060 8.169 -9.643 1.00 45.21 H new ATOM 0 HA LEU A 20 4.182 7.841 -9.256 1.00 21.41 H new ATOM 0 HB2 LEU A 20 6.220 6.111 -9.042 1.00 65.40 H new ATOM 0 HB3 LEU A 20 6.279 6.753 -7.412 1.00 65.40 H new ATOM 0 HG LEU A 20 3.818 5.512 -8.674 1.00 12.40 H new ATOM 0 HD11 LEU A 20 4.295 3.575 -7.233 1.00 62.21 H new ATOM 0 HD12 LEU A 20 5.594 3.854 -8.417 1.00 62.21 H new ATOM 0 HD13 LEU A 20 5.818 4.338 -6.719 1.00 62.21 H new ATOM 0 HD21 LEU A 20 2.976 5.463 -6.356 1.00 24.10 H new ATOM 0 HD22 LEU A 20 4.446 6.303 -5.809 1.00 24.10 H new ATOM 0 HD23 LEU A 20 3.308 7.124 -6.903 1.00 24.10 H new ATOM 253 N LYS A 21 6.162 9.459 -7.173 1.00 34.04 N ATOM 254 CA LYS A 21 6.175 10.413 -6.071 1.00 52.32 C ATOM 255 C LYS A 21 4.995 11.376 -6.171 1.00 25.33 C ATOM 256 O LYS A 21 4.328 11.658 -5.177 1.00 3.00 O ATOM 257 CB LYS A 21 7.489 11.198 -6.065 1.00 73.33 C ATOM 258 CG LYS A 21 7.699 12.024 -4.808 1.00 73.23 C ATOM 259 CD LYS A 21 8.493 13.286 -5.096 1.00 12.41 C ATOM 260 CE LYS A 21 9.963 13.112 -4.748 1.00 3.23 C ATOM 261 NZ LYS A 21 10.652 14.421 -4.579 1.00 11.34 N ATOM 0 H LYS A 21 7.083 9.240 -7.552 1.00 34.04 H new ATOM 0 HA LYS A 21 6.088 9.855 -5.139 1.00 52.32 H new ATOM 0 HB2 LYS A 21 8.320 10.501 -6.174 1.00 73.33 H new ATOM 0 HB3 LYS A 21 7.512 11.859 -6.932 1.00 73.33 H new ATOM 0 HG2 LYS A 21 6.732 12.291 -4.381 1.00 73.23 H new ATOM 0 HG3 LYS A 21 8.223 11.426 -4.062 1.00 73.23 H new ATOM 0 HD2 LYS A 21 8.396 13.545 -6.150 1.00 12.41 H new ATOM 0 HD3 LYS A 21 8.079 14.116 -4.524 1.00 12.41 H new ATOM 0 HE2 LYS A 21 10.052 12.533 -3.829 1.00 3.23 H new ATOM 0 HE3 LYS A 21 10.457 12.540 -5.534 1.00 3.23 H new ATOM 0 HZ1 LYS A 21 11.652 14.259 -4.343 1.00 11.34 H new ATOM 0 HZ2 LYS A 21 10.589 14.963 -5.464 1.00 11.34 H new ATOM 0 HZ3 LYS A 21 10.197 14.956 -3.812 1.00 11.34 H new ATOM 275 N GLU A 22 4.746 11.876 -7.378 1.00 3.14 N ATOM 276 CA GLU A 22 3.647 12.806 -7.606 1.00 13.24 C ATOM 277 C GLU A 22 2.301 12.128 -7.362 1.00 53.31 C ATOM 278 O GLU A 22 1.423 12.684 -6.700 1.00 20.15 O ATOM 279 CB GLU A 22 3.703 13.357 -9.032 1.00 33.34 C ATOM 280 CG GLU A 22 5.084 13.835 -9.446 1.00 70.04 C ATOM 281 CD GLU A 22 5.032 14.924 -10.501 1.00 60.20 C ATOM 282 OE1 GLU A 22 4.201 15.845 -10.361 1.00 60.54 O ATOM 283 OE2 GLU A 22 5.823 14.854 -11.465 1.00 41.22 O ATOM 0 H GLU A 22 5.290 11.653 -8.211 1.00 3.14 H new ATOM 0 HA GLU A 22 3.751 13.631 -6.902 1.00 13.24 H new ATOM 0 HB2 GLU A 22 3.373 12.583 -9.725 1.00 33.34 H new ATOM 0 HB3 GLU A 22 3.000 14.185 -9.120 1.00 33.34 H new ATOM 0 HG2 GLU A 22 5.613 14.208 -8.569 1.00 70.04 H new ATOM 0 HG3 GLU A 22 5.657 12.991 -9.829 1.00 70.04 H new ATOM 290 N THR A 23 2.145 10.924 -7.903 1.00 13.41 N ATOM 291 CA THR A 23 0.907 10.171 -7.747 1.00 40.15 C ATOM 292 C THR A 23 0.431 10.188 -6.299 1.00 52.41 C ATOM 293 O THR A 23 -0.748 10.418 -6.026 1.00 21.35 O ATOM 294 CB THR A 23 1.078 8.709 -8.202 1.00 23.43 C ATOM 295 OG1 THR A 23 1.073 8.637 -9.631 1.00 63.54 O ATOM 296 CG2 THR A 23 -0.032 7.834 -7.640 1.00 54.32 C ATOM 0 H THR A 23 2.861 10.449 -8.453 1.00 13.41 H new ATOM 0 HA THR A 23 0.161 10.656 -8.377 1.00 40.15 H new ATOM 0 HB THR A 23 2.033 8.343 -7.824 1.00 23.43 H new ATOM 0 HG1 THR A 23 1.184 7.705 -9.912 1.00 63.54 H new ATOM 0 HG21 THR A 23 0.110 6.806 -7.975 1.00 54.32 H new ATOM 0 HG22 THR A 23 -0.006 7.868 -6.551 1.00 54.32 H new ATOM 0 HG23 THR A 23 -0.997 8.200 -7.991 1.00 54.32 H new ATOM 304 N LEU A 24 1.354 9.947 -5.375 1.00 50.30 N ATOM 305 CA LEU A 24 1.029 9.936 -3.953 1.00 50.04 C ATOM 306 C LEU A 24 0.542 11.308 -3.495 1.00 64.44 C ATOM 307 O LEU A 24 -0.495 11.423 -2.842 1.00 5.31 O ATOM 308 CB LEU A 24 2.250 9.516 -3.133 1.00 60.34 C ATOM 309 CG LEU A 24 3.049 8.332 -3.680 1.00 22.35 C ATOM 310 CD1 LEU A 24 4.199 7.989 -2.745 1.00 12.03 C ATOM 311 CD2 LEU A 24 2.144 7.126 -3.881 1.00 63.53 C ATOM 0 H LEU A 24 2.334 9.756 -5.585 1.00 50.30 H new ATOM 0 HA LEU A 24 0.227 9.214 -3.795 1.00 50.04 H new ATOM 0 HB2 LEU A 24 2.919 10.373 -3.049 1.00 60.34 H new ATOM 0 HB3 LEU A 24 1.919 9.270 -2.124 1.00 60.34 H new ATOM 0 HG LEU A 24 3.465 8.613 -4.647 1.00 22.35 H new ATOM 0 HD11 LEU A 24 4.757 7.144 -3.149 1.00 12.03 H new ATOM 0 HD12 LEU A 24 4.861 8.850 -2.651 1.00 12.03 H new ATOM 0 HD13 LEU A 24 3.804 7.727 -1.764 1.00 12.03 H new ATOM 0 HD21 LEU A 24 2.729 6.293 -4.271 1.00 63.53 H new ATOM 0 HD22 LEU A 24 1.699 6.842 -2.927 1.00 63.53 H new ATOM 0 HD23 LEU A 24 1.355 7.378 -4.589 1.00 63.53 H new ATOM 323 N ARG A 25 1.297 12.344 -3.845 1.00 11.42 N ATOM 324 CA ARG A 25 0.942 13.708 -3.471 1.00 32.23 C ATOM 325 C ARG A 25 -0.411 14.099 -4.059 1.00 62.44 C ATOM 326 O ARG A 25 -1.156 14.877 -3.464 1.00 54.24 O ATOM 327 CB ARG A 25 2.018 14.687 -3.946 1.00 61.45 C ATOM 328 CG ARG A 25 2.071 15.973 -3.139 1.00 2.03 C ATOM 329 CD ARG A 25 3.490 16.513 -3.043 1.00 55.11 C ATOM 330 NE ARG A 25 3.674 17.713 -3.855 1.00 40.11 N ATOM 331 CZ ARG A 25 3.319 18.930 -3.459 1.00 12.24 C ATOM 332 NH1 ARG A 25 2.765 19.108 -2.267 1.00 33.12 N ATOM 333 NH2 ARG A 25 3.519 19.974 -4.254 1.00 21.35 N ATOM 0 H ARG A 25 2.158 12.265 -4.387 1.00 11.42 H new ATOM 0 HA ARG A 25 0.873 13.753 -2.384 1.00 32.23 H new ATOM 0 HB2 ARG A 25 2.990 14.197 -3.897 1.00 61.45 H new ATOM 0 HB3 ARG A 25 1.837 14.932 -4.993 1.00 61.45 H new ATOM 0 HG2 ARG A 25 1.427 16.721 -3.601 1.00 2.03 H new ATOM 0 HG3 ARG A 25 1.681 15.792 -2.137 1.00 2.03 H new ATOM 0 HD2 ARG A 25 3.722 16.740 -2.002 1.00 55.11 H new ATOM 0 HD3 ARG A 25 4.193 15.745 -3.366 1.00 55.11 H new ATOM 0 HE ARG A 25 4.098 17.611 -4.777 1.00 40.11 H new ATOM 0 HH11 ARG A 25 2.611 18.309 -1.652 1.00 33.12 H new ATOM 0 HH12 ARG A 25 2.493 20.044 -1.965 1.00 33.12 H new ATOM 0 HH21 ARG A 25 3.946 19.842 -5.171 1.00 21.35 H new ATOM 0 HH22 ARG A 25 3.246 20.908 -3.948 1.00 21.35 H new ATOM 347 N LYS A 26 -0.720 13.553 -5.230 1.00 40.30 N ATOM 348 CA LYS A 26 -1.983 13.843 -5.900 1.00 43.41 C ATOM 349 C LYS A 26 -3.115 13.008 -5.312 1.00 23.55 C ATOM 350 O LYS A 26 -4.265 13.445 -5.268 1.00 51.13 O ATOM 351 CB LYS A 26 -1.862 13.573 -7.401 1.00 40.02 C ATOM 352 CG LYS A 26 -0.503 13.933 -7.977 1.00 1.15 C ATOM 353 CD LYS A 26 -0.629 14.908 -9.136 1.00 33.02 C ATOM 354 CE LYS A 26 0.457 14.680 -10.176 1.00 34.13 C ATOM 355 NZ LYS A 26 -0.030 14.954 -11.556 1.00 55.10 N ATOM 0 H LYS A 26 -0.113 12.907 -5.735 1.00 40.30 H new ATOM 0 HA LYS A 26 -2.214 14.897 -5.745 1.00 43.41 H new ATOM 0 HB2 LYS A 26 -2.059 12.517 -7.589 1.00 40.02 H new ATOM 0 HB3 LYS A 26 -2.631 14.139 -7.926 1.00 40.02 H new ATOM 0 HG2 LYS A 26 0.119 14.372 -7.197 1.00 1.15 H new ATOM 0 HG3 LYS A 26 0.001 13.028 -8.315 1.00 1.15 H new ATOM 0 HD2 LYS A 26 -1.609 14.798 -9.601 1.00 33.02 H new ATOM 0 HD3 LYS A 26 -0.567 15.930 -8.762 1.00 33.02 H new ATOM 0 HE2 LYS A 26 1.310 15.323 -9.958 1.00 34.13 H new ATOM 0 HE3 LYS A 26 0.810 13.651 -10.113 1.00 34.13 H new ATOM 0 HZ1 LYS A 26 0.740 14.787 -12.235 1.00 55.10 H new ATOM 0 HZ2 LYS A 26 -0.827 14.323 -11.774 1.00 55.10 H new ATOM 0 HZ3 LYS A 26 -0.343 15.944 -11.624 1.00 55.10 H new ATOM 369 N PHE A 27 -2.782 11.803 -4.858 1.00 5.42 N ATOM 370 CA PHE A 27 -3.771 10.907 -4.271 1.00 61.33 C ATOM 371 C PHE A 27 -4.294 11.463 -2.950 1.00 64.14 C ATOM 372 O PHE A 27 -5.481 11.355 -2.646 1.00 12.42 O ATOM 373 CB PHE A 27 -3.164 9.520 -4.049 1.00 50.10 C ATOM 374 CG PHE A 27 -4.190 8.431 -3.917 1.00 1.31 C ATOM 375 CD1 PHE A 27 -5.252 8.350 -4.804 1.00 43.21 C ATOM 376 CD2 PHE A 27 -4.094 7.488 -2.906 1.00 5.41 C ATOM 377 CE1 PHE A 27 -6.198 7.350 -4.684 1.00 21.24 C ATOM 378 CE2 PHE A 27 -5.036 6.485 -2.781 1.00 4.22 C ATOM 379 CZ PHE A 27 -6.089 6.415 -3.671 1.00 50.42 C ATOM 0 H PHE A 27 -1.835 11.425 -4.886 1.00 5.42 H new ATOM 0 HA PHE A 27 -4.607 10.824 -4.965 1.00 61.33 H new ATOM 0 HB2 PHE A 27 -2.501 9.285 -4.882 1.00 50.10 H new ATOM 0 HB3 PHE A 27 -2.550 9.541 -3.149 1.00 50.10 H new ATOM 0 HD1 PHE A 27 -5.341 9.077 -5.598 1.00 43.21 H new ATOM 0 HD2 PHE A 27 -3.272 7.538 -2.207 1.00 5.41 H new ATOM 0 HE1 PHE A 27 -7.022 7.299 -5.381 1.00 21.24 H new ATOM 0 HE2 PHE A 27 -4.949 5.757 -1.988 1.00 4.22 H new ATOM 0 HZ PHE A 27 -6.826 5.631 -3.576 1.00 50.42 H new ATOM 389 N ARG A 28 -3.397 12.057 -2.169 1.00 42.54 N ATOM 390 CA ARG A 28 -3.767 12.628 -0.880 1.00 44.53 C ATOM 391 C ARG A 28 -4.659 13.852 -1.063 1.00 41.44 C ATOM 392 O ARG A 28 -5.485 14.166 -0.206 1.00 43.41 O ATOM 393 CB ARG A 28 -2.514 13.012 -0.090 1.00 61.41 C ATOM 394 CG ARG A 28 -1.398 11.984 -0.183 1.00 25.12 C ATOM 395 CD ARG A 28 -0.835 11.647 1.190 1.00 54.43 C ATOM 396 NE ARG A 28 -0.199 12.802 1.819 1.00 31.31 N ATOM 397 CZ ARG A 28 -0.014 12.915 3.129 1.00 14.31 C ATOM 398 NH1 ARG A 28 -0.416 11.950 3.945 1.00 42.22 N ATOM 399 NH2 ARG A 28 0.573 13.996 3.627 1.00 62.25 N ATOM 0 H ARG A 28 -2.410 12.155 -2.407 1.00 42.54 H new ATOM 0 HA ARG A 28 -4.323 11.874 -0.324 1.00 44.53 H new ATOM 0 HB2 ARG A 28 -2.145 13.971 -0.454 1.00 61.41 H new ATOM 0 HB3 ARG A 28 -2.783 13.150 0.957 1.00 61.41 H new ATOM 0 HG2 ARG A 28 -1.776 11.077 -0.655 1.00 25.12 H new ATOM 0 HG3 ARG A 28 -0.601 12.367 -0.820 1.00 25.12 H new ATOM 0 HD2 ARG A 28 -1.637 11.281 1.831 1.00 54.43 H new ATOM 0 HD3 ARG A 28 -0.109 10.840 1.096 1.00 54.43 H new ATOM 0 HE ARG A 28 0.120 13.563 1.219 1.00 31.31 H new ATOM 0 HH11 ARG A 28 -0.869 11.118 3.567 1.00 42.22 H new ATOM 0 HH12 ARG A 28 -0.272 12.040 4.951 1.00 42.22 H new ATOM 0 HH21 ARG A 28 0.883 14.741 3.003 1.00 62.25 H new ATOM 0 HH22 ARG A 28 0.714 14.082 4.634 1.00 62.25 H new ATOM 413 N PHE A 29 -4.488 14.541 -2.188 1.00 24.42 N ATOM 414 CA PHE A 29 -5.276 15.732 -2.484 1.00 70.40 C ATOM 415 C PHE A 29 -5.941 15.617 -3.853 1.00 22.03 C ATOM 416 O PHE A 29 -5.998 16.585 -4.609 1.00 52.14 O ATOM 417 CB PHE A 29 -4.391 16.979 -2.437 1.00 34.23 C ATOM 418 CG PHE A 29 -3.128 16.789 -1.648 1.00 1.41 C ATOM 419 CD1 PHE A 29 -3.173 16.318 -0.346 1.00 2.34 C ATOM 420 CD2 PHE A 29 -1.894 17.081 -2.209 1.00 13.32 C ATOM 421 CE1 PHE A 29 -2.012 16.141 0.383 1.00 3.33 C ATOM 422 CE2 PHE A 29 -0.731 16.907 -1.485 1.00 1.11 C ATOM 423 CZ PHE A 29 -0.789 16.438 -0.187 1.00 73.44 C ATOM 0 H PHE A 29 -3.810 14.294 -2.909 1.00 24.42 H new ATOM 0 HA PHE A 29 -6.055 15.820 -1.727 1.00 70.40 H new ATOM 0 HB2 PHE A 29 -4.133 17.270 -3.455 1.00 34.23 H new ATOM 0 HB3 PHE A 29 -4.960 17.802 -2.004 1.00 34.23 H new ATOM 0 HD1 PHE A 29 -4.127 16.086 0.105 1.00 2.34 H new ATOM 0 HD2 PHE A 29 -1.842 17.449 -3.223 1.00 13.32 H new ATOM 0 HE1 PHE A 29 -2.061 15.771 1.397 1.00 3.33 H new ATOM 0 HE2 PHE A 29 0.224 17.138 -1.934 1.00 1.11 H new ATOM 0 HZ PHE A 29 0.120 16.304 0.381 1.00 73.44 H new ATOM 433 N ARG A 30 -6.442 14.425 -4.162 1.00 23.23 N ATOM 434 CA ARG A 30 -7.102 14.182 -5.440 1.00 2.55 C ATOM 435 C ARG A 30 -8.458 14.877 -5.491 1.00 52.52 C ATOM 436 O ARG A 30 -8.980 15.324 -4.469 1.00 65.40 O ATOM 437 CB ARG A 30 -7.277 12.680 -5.669 1.00 62.15 C ATOM 438 CG ARG A 30 -8.061 11.983 -4.570 1.00 15.15 C ATOM 439 CD ARG A 30 -7.667 10.520 -4.447 1.00 72.40 C ATOM 440 NE ARG A 30 -8.661 9.633 -5.045 1.00 53.21 N ATOM 441 CZ ARG A 30 -9.750 9.215 -4.411 1.00 1.23 C ATOM 442 NH1 ARG A 30 -9.985 9.601 -3.164 1.00 10.10 N ATOM 443 NH2 ARG A 30 -10.608 8.409 -5.023 1.00 34.12 N ATOM 0 H ARG A 30 -6.404 13.613 -3.546 1.00 23.23 H new ATOM 0 HA ARG A 30 -6.473 14.592 -6.230 1.00 2.55 H new ATOM 0 HB2 ARG A 30 -7.784 12.523 -6.621 1.00 62.15 H new ATOM 0 HB3 ARG A 30 -6.294 12.217 -5.752 1.00 62.15 H new ATOM 0 HG2 ARG A 30 -7.887 12.489 -3.620 1.00 15.15 H new ATOM 0 HG3 ARG A 30 -9.128 12.057 -4.780 1.00 15.15 H new ATOM 0 HD2 ARG A 30 -6.703 10.362 -4.931 1.00 72.40 H new ATOM 0 HD3 ARG A 30 -7.541 10.266 -3.395 1.00 72.40 H new ATOM 0 HE ARG A 30 -8.510 9.317 -6.003 1.00 53.21 H new ATOM 0 HH11 ARG A 30 -9.328 10.221 -2.690 1.00 10.10 H new ATOM 0 HH12 ARG A 30 -10.823 9.278 -2.679 1.00 10.10 H new ATOM 0 HH21 ARG A 30 -10.431 8.110 -5.982 1.00 34.12 H new ATOM 0 HH22 ARG A 30 -11.444 8.089 -4.535 1.00 34.12 H new ATOM 508 N ASN A 34 -14.321 8.993 -3.628 1.00 61.44 N ATOM 509 CA ASN A 34 -14.623 7.573 -3.489 1.00 30.14 C ATOM 510 C ASN A 34 -13.379 6.790 -3.078 1.00 14.22 C ATOM 511 O ASN A 34 -12.304 7.361 -2.905 1.00 5.43 O ATOM 512 CB ASN A 34 -15.180 7.016 -4.801 1.00 4.13 C ATOM 513 CG ASN A 34 -14.305 7.359 -5.991 1.00 44.31 C ATOM 514 OD1 ASN A 34 -13.627 6.355 -6.536 1.00 51.00 O flip ATOM 515 ND2 ASN A 34 -14.239 8.512 -6.416 1.00 32.34 N flip ATOM 0 HA ASN A 34 -15.375 7.462 -2.708 1.00 30.14 H new ATOM 0 HB2 ASN A 34 -15.274 5.933 -4.722 1.00 4.13 H new ATOM 0 HB3 ASN A 34 -16.182 7.412 -4.964 1.00 4.13 H new ATOM 0 HD21 ASN A 34 -14.777 9.253 -5.967 1.00 32.34 H new ATOM 0 HD22 ASN A 34 -13.646 8.727 -7.218 1.00 32.34 H new ATOM 522 N ASN A 35 -13.535 5.480 -2.925 1.00 30.23 N ATOM 523 CA ASN A 35 -12.425 4.618 -2.535 1.00 23.03 C ATOM 524 C ASN A 35 -11.562 4.263 -3.741 1.00 71.45 C ATOM 525 O ASN A 35 -12.076 3.961 -4.818 1.00 20.23 O ATOM 526 CB ASN A 35 -12.950 3.341 -1.876 1.00 60.11 C ATOM 527 CG ASN A 35 -13.449 3.581 -0.464 1.00 43.21 C ATOM 528 OD1 ASN A 35 -13.227 4.647 0.112 1.00 42.32 O ATOM 529 ND2 ASN A 35 -14.127 2.590 0.101 1.00 72.30 N ATOM 0 H ASN A 35 -14.419 4.991 -3.065 1.00 30.23 H new ATOM 0 HA ASN A 35 -11.810 5.162 -1.818 1.00 23.03 H new ATOM 0 HB2 ASN A 35 -13.760 2.931 -2.480 1.00 60.11 H new ATOM 0 HB3 ASN A 35 -12.157 2.594 -1.856 1.00 60.11 H new ATOM 0 HD21 ASN A 35 -14.488 2.694 1.049 1.00 72.30 H new ATOM 0 HD22 ASN A 35 -14.288 1.724 -0.413 1.00 72.30 H new ATOM 536 N ALA A 36 -10.247 4.300 -3.553 1.00 41.54 N ATOM 537 CA ALA A 36 -9.312 3.981 -4.625 1.00 72.11 C ATOM 538 C ALA A 36 -8.027 3.378 -4.071 1.00 3.13 C ATOM 539 O ALA A 36 -7.682 3.589 -2.908 1.00 41.51 O ATOM 540 CB ALA A 36 -9.004 5.225 -5.445 1.00 64.21 C ATOM 0 H ALA A 36 -9.805 4.548 -2.668 1.00 41.54 H new ATOM 0 HA ALA A 36 -9.780 3.240 -5.273 1.00 72.11 H new ATOM 0 HB1 ALA A 36 -8.305 4.972 -6.242 1.00 64.21 H new ATOM 0 HB2 ALA A 36 -9.926 5.611 -5.880 1.00 64.21 H new ATOM 0 HB3 ALA A 36 -8.561 5.985 -4.801 1.00 64.21 H new ATOM 546 N ALA A 37 -7.320 2.626 -4.908 1.00 54.15 N ATOM 547 CA ALA A 37 -6.072 1.994 -4.502 1.00 62.20 C ATOM 548 C ALA A 37 -4.986 2.195 -5.554 1.00 50.32 C ATOM 549 O ALA A 37 -5.281 2.391 -6.734 1.00 30.21 O ATOM 550 CB ALA A 37 -6.291 0.510 -4.243 1.00 52.41 C ATOM 0 H ALA A 37 -7.592 2.440 -5.873 1.00 54.15 H new ATOM 0 HA ALA A 37 -5.738 2.467 -3.579 1.00 62.20 H new ATOM 0 HB1 ALA A 37 -5.350 0.051 -3.940 1.00 52.41 H new ATOM 0 HB2 ALA A 37 -7.028 0.384 -3.450 1.00 52.41 H new ATOM 0 HB3 ALA A 37 -6.652 0.031 -5.153 1.00 52.41 H new ATOM 556 N ILE A 38 -3.732 2.146 -5.120 1.00 41.41 N ATOM 557 CA ILE A 38 -2.603 2.323 -6.025 1.00 21.42 C ATOM 558 C ILE A 38 -1.510 1.296 -5.748 1.00 10.33 C ATOM 559 O ILE A 38 -0.795 1.391 -4.750 1.00 64.51 O ATOM 560 CB ILE A 38 -2.005 3.737 -5.909 1.00 43.23 C ATOM 561 CG1 ILE A 38 -3.114 4.789 -5.951 1.00 12.12 C ATOM 562 CG2 ILE A 38 -0.997 3.978 -7.024 1.00 3.05 C ATOM 563 CD1 ILE A 38 -2.599 6.211 -5.970 1.00 1.30 C ATOM 0 H ILE A 38 -3.472 1.985 -4.147 1.00 41.41 H new ATOM 0 HA ILE A 38 -2.984 2.181 -7.036 1.00 21.42 H new ATOM 0 HB ILE A 38 -1.488 3.820 -4.953 1.00 43.23 H new ATOM 0 HG12 ILE A 38 -3.728 4.622 -6.836 1.00 12.12 H new ATOM 0 HG13 ILE A 38 -3.761 4.657 -5.084 1.00 12.12 H new ATOM 0 HG21 ILE A 38 -0.583 4.982 -6.929 1.00 3.05 H new ATOM 0 HG22 ILE A 38 -0.193 3.245 -6.952 1.00 3.05 H new ATOM 0 HG23 ILE A 38 -1.492 3.880 -7.990 1.00 3.05 H new ATOM 0 HD11 ILE A 38 -3.441 6.903 -6.000 1.00 1.30 H new ATOM 0 HD12 ILE A 38 -2.009 6.396 -5.073 1.00 1.30 H new ATOM 0 HD13 ILE A 38 -1.975 6.360 -6.851 1.00 1.30 H new ATOM 575 N ILE A 39 -1.386 0.317 -6.638 1.00 52.23 N ATOM 576 CA ILE A 39 -0.378 -0.725 -6.490 1.00 73.24 C ATOM 577 C ILE A 39 0.929 -0.327 -7.168 1.00 12.00 C ATOM 578 O ILE A 39 0.969 -0.101 -8.377 1.00 23.35 O ATOM 579 CB ILE A 39 -0.861 -2.063 -7.081 1.00 55.12 C ATOM 580 CG1 ILE A 39 -2.185 -2.481 -6.436 1.00 60.42 C ATOM 581 CG2 ILE A 39 0.194 -3.141 -6.885 1.00 23.24 C ATOM 582 CD1 ILE A 39 -3.128 -3.179 -7.391 1.00 74.21 C ATOM 0 H ILE A 39 -1.971 0.224 -7.469 1.00 52.23 H new ATOM 0 HA ILE A 39 -0.207 -0.848 -5.421 1.00 73.24 H new ATOM 0 HB ILE A 39 -1.024 -1.933 -8.151 1.00 55.12 H new ATOM 0 HG12 ILE A 39 -1.977 -3.142 -5.595 1.00 60.42 H new ATOM 0 HG13 ILE A 39 -2.678 -1.597 -6.032 1.00 60.42 H new ATOM 0 HG21 ILE A 39 -0.163 -4.080 -7.308 1.00 23.24 H new ATOM 0 HG22 ILE A 39 1.115 -2.844 -7.386 1.00 23.24 H new ATOM 0 HG23 ILE A 39 0.386 -3.273 -5.820 1.00 23.24 H new ATOM 0 HD11 ILE A 39 -4.045 -3.447 -6.866 1.00 74.21 H new ATOM 0 HD12 ILE A 39 -3.366 -2.512 -8.220 1.00 74.21 H new ATOM 0 HD13 ILE A 39 -2.654 -4.082 -7.776 1.00 74.21 H new ATOM 594 N MET A 40 1.995 -0.244 -6.379 1.00 43.54 N ATOM 595 CA MET A 40 3.305 0.125 -6.905 1.00 4.24 C ATOM 596 C MET A 40 4.281 -1.042 -6.800 1.00 40.04 C ATOM 597 O MET A 40 4.220 -1.835 -5.860 1.00 14.43 O ATOM 598 CB MET A 40 3.859 1.336 -6.149 1.00 53.10 C ATOM 599 CG MET A 40 2.817 2.410 -5.877 1.00 4.11 C ATOM 600 SD MET A 40 3.059 3.223 -4.285 1.00 61.22 S ATOM 601 CE MET A 40 1.603 2.671 -3.400 1.00 54.31 C ATOM 0 H MET A 40 1.978 -0.427 -5.376 1.00 43.54 H new ATOM 0 HA MET A 40 3.186 0.384 -7.957 1.00 4.24 H new ATOM 0 HB2 MET A 40 4.280 1.001 -5.201 1.00 53.10 H new ATOM 0 HB3 MET A 40 4.676 1.771 -6.725 1.00 53.10 H new ATOM 0 HG2 MET A 40 2.853 3.156 -6.671 1.00 4.11 H new ATOM 0 HG3 MET A 40 1.823 1.963 -5.905 1.00 4.11 H new ATOM 0 HE1 MET A 40 1.798 2.695 -2.328 1.00 54.31 H new ATOM 0 HE2 MET A 40 0.765 3.329 -3.631 1.00 54.31 H new ATOM 0 HE3 MET A 40 1.358 1.653 -3.702 1.00 54.31 H new ATOM 611 N LYS A 41 5.181 -1.145 -7.773 1.00 14.11 N ATOM 612 CA LYS A 41 6.170 -2.215 -7.792 1.00 63.53 C ATOM 613 C LYS A 41 7.585 -1.647 -7.843 1.00 41.43 C ATOM 614 O LYS A 41 7.775 -0.433 -7.925 1.00 31.31 O ATOM 615 CB LYS A 41 5.934 -3.134 -8.992 1.00 71.45 C ATOM 616 CG LYS A 41 6.325 -2.512 -10.322 1.00 34.42 C ATOM 617 CD LYS A 41 6.867 -3.553 -11.286 1.00 64.15 C ATOM 618 CE LYS A 41 6.448 -3.258 -12.718 1.00 34.40 C ATOM 619 NZ LYS A 41 7.278 -4.003 -13.704 1.00 64.13 N ATOM 0 H LYS A 41 5.245 -0.499 -8.560 1.00 14.11 H new ATOM 0 HA LYS A 41 6.062 -2.792 -6.874 1.00 63.53 H new ATOM 0 HB2 LYS A 41 6.500 -4.055 -8.851 1.00 71.45 H new ATOM 0 HB3 LYS A 41 4.880 -3.410 -9.026 1.00 71.45 H new ATOM 0 HG2 LYS A 41 5.458 -2.022 -10.764 1.00 34.42 H new ATOM 0 HG3 LYS A 41 7.077 -1.741 -10.157 1.00 34.42 H new ATOM 0 HD2 LYS A 41 7.955 -3.578 -11.222 1.00 64.15 H new ATOM 0 HD3 LYS A 41 6.508 -4.541 -10.997 1.00 64.15 H new ATOM 0 HE2 LYS A 41 5.399 -3.524 -12.852 1.00 34.40 H new ATOM 0 HE3 LYS A 41 6.532 -2.188 -12.908 1.00 34.40 H new ATOM 0 HZ1 LYS A 41 6.878 -3.883 -14.656 1.00 64.13 H new ATOM 0 HZ2 LYS A 41 8.250 -3.634 -13.688 1.00 64.13 H new ATOM 0 HZ3 LYS A 41 7.287 -5.013 -13.457 1.00 64.13 H new ATOM 633 N VAL A 42 8.575 -2.533 -7.797 1.00 65.04 N ATOM 634 CA VAL A 42 9.972 -2.119 -7.841 1.00 22.33 C ATOM 635 C VAL A 42 10.726 -2.846 -8.950 1.00 33.24 C ATOM 636 O VAL A 42 11.018 -4.036 -8.840 1.00 23.45 O ATOM 637 CB VAL A 42 10.678 -2.384 -6.498 1.00 43.01 C ATOM 638 CG1 VAL A 42 10.047 -3.572 -5.788 1.00 5.22 C ATOM 639 CG2 VAL A 42 12.167 -2.611 -6.714 1.00 61.03 C ATOM 0 H VAL A 42 8.435 -3.541 -7.729 1.00 65.04 H new ATOM 0 HA VAL A 42 9.979 -1.048 -8.042 1.00 22.33 H new ATOM 0 HB VAL A 42 10.556 -1.506 -5.864 1.00 43.01 H new ATOM 0 HG11 VAL A 42 10.559 -3.744 -4.841 1.00 5.22 H new ATOM 0 HG12 VAL A 42 8.994 -3.365 -5.599 1.00 5.22 H new ATOM 0 HG13 VAL A 42 10.136 -4.459 -6.415 1.00 5.22 H new ATOM 0 HG21 VAL A 42 12.650 -2.797 -5.755 1.00 61.03 H new ATOM 0 HG22 VAL A 42 12.313 -3.472 -7.366 1.00 61.03 H new ATOM 0 HG23 VAL A 42 12.607 -1.727 -7.176 1.00 61.03 H new ATOM 649 N ASP A 43 11.037 -2.121 -10.019 1.00 71.20 N ATOM 650 CA ASP A 43 11.759 -2.695 -11.148 1.00 54.02 C ATOM 651 C ASP A 43 13.142 -3.178 -10.722 1.00 13.41 C ATOM 652 O ASP A 43 13.955 -2.401 -10.222 1.00 73.20 O ATOM 653 CB ASP A 43 11.887 -1.668 -12.274 1.00 45.30 C ATOM 654 CG ASP A 43 10.584 -1.458 -13.019 1.00 42.12 C ATOM 655 OD1 ASP A 43 9.692 -2.326 -12.910 1.00 50.54 O ATOM 656 OD2 ASP A 43 10.456 -0.426 -13.711 1.00 72.41 O ATOM 0 H ASP A 43 10.800 -1.135 -10.127 1.00 71.20 H new ATOM 0 HA ASP A 43 11.192 -3.552 -11.511 1.00 54.02 H new ATOM 0 HB2 ASP A 43 12.221 -0.718 -11.858 1.00 45.30 H new ATOM 0 HB3 ASP A 43 12.654 -1.996 -12.975 1.00 45.30 H new ATOM 661 N LYS A 44 13.401 -4.465 -10.922 1.00 30.00 N ATOM 662 CA LYS A 44 14.684 -5.053 -10.559 1.00 4.14 C ATOM 663 C LYS A 44 15.769 -4.650 -11.553 1.00 13.50 C ATOM 664 O LYS A 44 16.926 -5.049 -11.422 1.00 34.23 O ATOM 665 CB LYS A 44 14.573 -6.578 -10.502 1.00 12.13 C ATOM 666 CG LYS A 44 15.741 -7.247 -9.798 1.00 35.51 C ATOM 667 CD LYS A 44 16.508 -8.163 -10.739 1.00 15.42 C ATOM 668 CE LYS A 44 17.111 -9.345 -9.997 1.00 50.22 C ATOM 669 NZ LYS A 44 18.175 -10.016 -10.794 1.00 51.15 N ATOM 0 H LYS A 44 12.738 -5.122 -11.334 1.00 30.00 H new ATOM 0 HA LYS A 44 14.960 -4.677 -9.574 1.00 4.14 H new ATOM 0 HB2 LYS A 44 13.649 -6.848 -9.991 1.00 12.13 H new ATOM 0 HB3 LYS A 44 14.501 -6.967 -11.518 1.00 12.13 H new ATOM 0 HG2 LYS A 44 16.413 -6.486 -9.402 1.00 35.51 H new ATOM 0 HG3 LYS A 44 15.374 -7.822 -8.948 1.00 35.51 H new ATOM 0 HD2 LYS A 44 15.840 -8.525 -11.521 1.00 15.42 H new ATOM 0 HD3 LYS A 44 17.300 -7.599 -11.232 1.00 15.42 H new ATOM 0 HE2 LYS A 44 17.528 -9.004 -9.049 1.00 50.22 H new ATOM 0 HE3 LYS A 44 16.327 -10.064 -9.761 1.00 50.22 H new ATOM 0 HZ1 LYS A 44 18.561 -10.816 -10.254 1.00 51.15 H new ATOM 0 HZ2 LYS A 44 17.772 -10.364 -11.688 1.00 51.15 H new ATOM 0 HZ3 LYS A 44 18.936 -9.337 -10.998 1.00 51.15 H new ATOM 683 N ASP A 45 15.387 -3.855 -12.547 1.00 53.21 N ATOM 684 CA ASP A 45 16.327 -3.394 -13.562 1.00 64.33 C ATOM 685 C ASP A 45 16.745 -1.951 -13.302 1.00 1.23 C ATOM 686 O ASP A 45 17.850 -1.541 -13.659 1.00 14.44 O ATOM 687 CB ASP A 45 15.705 -3.515 -14.955 1.00 64.42 C ATOM 688 CG ASP A 45 16.562 -4.332 -15.902 1.00 45.20 C ATOM 689 OD1 ASP A 45 17.291 -5.225 -15.423 1.00 31.34 O ATOM 690 OD2 ASP A 45 16.503 -4.078 -17.124 1.00 4.24 O ATOM 0 H ASP A 45 14.433 -3.517 -12.671 1.00 53.21 H new ATOM 0 HA ASP A 45 17.215 -4.024 -13.512 1.00 64.33 H new ATOM 0 HB2 ASP A 45 14.721 -3.975 -14.872 1.00 64.42 H new ATOM 0 HB3 ASP A 45 15.557 -2.519 -15.371 1.00 64.42 H new ATOM 695 N ARG A 46 15.855 -1.186 -12.678 1.00 44.31 N ATOM 696 CA ARG A 46 16.132 0.213 -12.372 1.00 61.31 C ATOM 697 C ARG A 46 16.208 0.434 -10.864 1.00 73.00 C ATOM 698 O ARG A 46 16.504 1.536 -10.404 1.00 55.31 O ATOM 699 CB ARG A 46 15.052 1.112 -12.976 1.00 72.31 C ATOM 700 CG ARG A 46 14.828 0.881 -14.462 1.00 23.03 C ATOM 701 CD ARG A 46 13.688 1.735 -14.993 1.00 3.42 C ATOM 702 NE ARG A 46 14.172 2.858 -15.792 1.00 4.42 N ATOM 703 CZ ARG A 46 13.446 3.463 -16.725 1.00 2.25 C ATOM 704 NH1 ARG A 46 12.210 3.056 -16.976 1.00 21.03 N ATOM 705 NH2 ARG A 46 13.956 4.479 -17.410 1.00 2.12 N ATOM 0 H ARG A 46 14.937 -1.511 -12.375 1.00 44.31 H new ATOM 0 HA ARG A 46 17.097 0.471 -12.809 1.00 61.31 H new ATOM 0 HB2 ARG A 46 14.114 0.946 -12.446 1.00 72.31 H new ATOM 0 HB3 ARG A 46 15.328 2.154 -12.816 1.00 72.31 H new ATOM 0 HG2 ARG A 46 15.742 1.112 -15.009 1.00 23.03 H new ATOM 0 HG3 ARG A 46 14.608 -0.172 -14.639 1.00 23.03 H new ATOM 0 HD2 ARG A 46 13.025 1.118 -15.599 1.00 3.42 H new ATOM 0 HD3 ARG A 46 13.098 2.112 -14.158 1.00 3.42 H new ATOM 0 HE ARG A 46 15.120 3.196 -15.624 1.00 4.42 H new ATOM 0 HH11 ARG A 46 11.814 2.276 -16.452 1.00 21.03 H new ATOM 0 HH12 ARG A 46 11.655 3.523 -17.693 1.00 21.03 H new ATOM 0 HH21 ARG A 46 14.907 4.796 -17.220 1.00 2.12 H new ATOM 0 HH22 ARG A 46 13.397 4.943 -18.126 1.00 2.12 H new ATOM 719 N GLN A 47 15.938 -0.621 -10.101 1.00 55.54 N ATOM 720 CA GLN A 47 15.974 -0.540 -8.646 1.00 62.44 C ATOM 721 C GLN A 47 15.235 0.698 -8.151 1.00 4.32 C ATOM 722 O GLN A 47 15.796 1.518 -7.425 1.00 4.42 O ATOM 723 CB GLN A 47 17.422 -0.517 -8.152 1.00 61.22 C ATOM 724 CG GLN A 47 18.292 -1.602 -8.766 1.00 54.23 C ATOM 725 CD GLN A 47 18.547 -2.754 -7.815 1.00 72.01 C ATOM 726 OE1 GLN A 47 19.541 -2.766 -7.087 1.00 73.33 O ATOM 727 NE2 GLN A 47 17.649 -3.733 -7.816 1.00 41.24 N ATOM 0 H GLN A 47 15.692 -1.541 -10.467 1.00 55.54 H new ATOM 0 HA GLN A 47 15.475 -1.422 -8.245 1.00 62.44 H new ATOM 0 HB2 GLN A 47 17.858 0.457 -8.376 1.00 61.22 H new ATOM 0 HB3 GLN A 47 17.429 -0.628 -7.068 1.00 61.22 H new ATOM 0 HG2 GLN A 47 17.811 -1.980 -9.668 1.00 54.23 H new ATOM 0 HG3 GLN A 47 19.245 -1.169 -9.070 1.00 54.23 H new ATOM 0 HE21 GLN A 47 16.840 -3.682 -8.435 1.00 41.24 H new ATOM 0 HE22 GLN A 47 17.768 -4.535 -7.197 1.00 41.24 H new ATOM 736 N MET A 48 13.974 0.828 -8.548 1.00 61.24 N ATOM 737 CA MET A 48 13.158 1.966 -8.143 1.00 63.02 C ATOM 738 C MET A 48 11.684 1.581 -8.069 1.00 63.41 C ATOM 739 O MET A 48 11.179 0.853 -8.924 1.00 62.12 O ATOM 740 CB MET A 48 13.345 3.128 -9.122 1.00 12.40 C ATOM 741 CG MET A 48 12.385 3.091 -10.300 1.00 73.30 C ATOM 742 SD MET A 48 13.095 3.801 -11.797 1.00 51.32 S ATOM 743 CE MET A 48 13.298 5.509 -11.298 1.00 2.42 C ATOM 0 H MET A 48 13.495 0.159 -9.150 1.00 61.24 H new ATOM 0 HA MET A 48 13.483 2.279 -7.151 1.00 63.02 H new ATOM 0 HB2 MET A 48 13.214 4.068 -8.586 1.00 12.40 H new ATOM 0 HB3 MET A 48 14.368 3.115 -9.497 1.00 12.40 H new ATOM 0 HG2 MET A 48 12.094 2.059 -10.495 1.00 73.30 H new ATOM 0 HG3 MET A 48 11.476 3.634 -10.040 1.00 73.30 H new ATOM 0 HE1 MET A 48 12.883 6.164 -12.064 1.00 2.42 H new ATOM 0 HE2 MET A 48 12.777 5.677 -10.356 1.00 2.42 H new ATOM 0 HE3 MET A 48 14.358 5.727 -11.170 1.00 2.42 H new ATOM 753 N VAL A 49 11.000 2.073 -7.042 1.00 34.30 N ATOM 754 CA VAL A 49 9.583 1.780 -6.857 1.00 40.11 C ATOM 755 C VAL A 49 8.726 2.559 -7.849 1.00 3.42 C ATOM 756 O VAL A 49 8.459 3.746 -7.657 1.00 72.40 O ATOM 757 CB VAL A 49 9.124 2.114 -5.426 1.00 31.14 C ATOM 758 CG1 VAL A 49 7.605 2.140 -5.344 1.00 54.30 C ATOM 759 CG2 VAL A 49 9.701 1.115 -4.434 1.00 22.52 C ATOM 0 H VAL A 49 11.403 2.676 -6.325 1.00 34.30 H new ATOM 0 HA VAL A 49 9.455 0.712 -7.032 1.00 40.11 H new ATOM 0 HB VAL A 49 9.496 3.105 -5.167 1.00 31.14 H new ATOM 0 HG11 VAL A 49 7.300 2.378 -4.325 1.00 54.30 H new ATOM 0 HG12 VAL A 49 7.217 2.897 -6.025 1.00 54.30 H new ATOM 0 HG13 VAL A 49 7.209 1.164 -5.623 1.00 54.30 H new ATOM 0 HG21 VAL A 49 9.366 1.367 -3.428 1.00 22.52 H new ATOM 0 HG22 VAL A 49 9.361 0.111 -4.689 1.00 22.52 H new ATOM 0 HG23 VAL A 49 10.790 1.150 -4.473 1.00 22.52 H new ATOM 769 N VAL A 50 8.298 1.884 -8.910 1.00 62.30 N ATOM 770 CA VAL A 50 7.470 2.512 -9.933 1.00 33.41 C ATOM 771 C VAL A 50 6.050 1.957 -9.907 1.00 1.55 C ATOM 772 O VAL A 50 5.840 0.768 -9.668 1.00 61.12 O ATOM 773 CB VAL A 50 8.064 2.307 -11.339 1.00 74.01 C ATOM 774 CG1 VAL A 50 9.452 2.921 -11.428 1.00 22.33 C ATOM 775 CG2 VAL A 50 8.102 0.828 -11.691 1.00 33.32 C ATOM 0 H VAL A 50 8.511 0.902 -9.084 1.00 62.30 H new ATOM 0 HA VAL A 50 7.444 3.579 -9.710 1.00 33.41 H new ATOM 0 HB VAL A 50 7.423 2.812 -12.062 1.00 74.01 H new ATOM 0 HG11 VAL A 50 9.855 2.766 -12.429 1.00 22.33 H new ATOM 0 HG12 VAL A 50 9.391 3.990 -11.223 1.00 22.33 H new ATOM 0 HG13 VAL A 50 10.107 2.448 -10.696 1.00 22.33 H new ATOM 0 HG21 VAL A 50 8.525 0.702 -12.688 1.00 33.32 H new ATOM 0 HG22 VAL A 50 8.719 0.297 -10.966 1.00 33.32 H new ATOM 0 HG23 VAL A 50 7.090 0.423 -11.672 1.00 33.32 H new ATOM 785 N LEU A 51 5.077 2.828 -10.153 1.00 75.32 N ATOM 786 CA LEU A 51 3.675 2.426 -10.159 1.00 10.11 C ATOM 787 C LEU A 51 3.485 1.121 -10.926 1.00 3.15 C ATOM 788 O LEU A 51 4.171 0.867 -11.915 1.00 4.42 O ATOM 789 CB LEU A 51 2.811 3.525 -10.779 1.00 42.32 C ATOM 790 CG LEU A 51 1.343 3.548 -10.350 1.00 4.51 C ATOM 791 CD1 LEU A 51 0.843 4.979 -10.234 1.00 40.21 C ATOM 792 CD2 LEU A 51 0.488 2.760 -11.332 1.00 10.12 C ATOM 0 H LEU A 51 5.233 3.816 -10.351 1.00 75.32 H new ATOM 0 HA LEU A 51 3.365 2.267 -9.126 1.00 10.11 H new ATOM 0 HB2 LEU A 51 3.255 4.490 -10.534 1.00 42.32 H new ATOM 0 HB3 LEU A 51 2.850 3.422 -11.863 1.00 42.32 H new ATOM 0 HG LEU A 51 1.263 3.077 -9.370 1.00 4.51 H new ATOM 0 HD11 LEU A 51 -0.203 4.975 -9.928 1.00 40.21 H new ATOM 0 HD12 LEU A 51 1.436 5.513 -9.492 1.00 40.21 H new ATOM 0 HD13 LEU A 51 0.937 5.477 -11.199 1.00 40.21 H new ATOM 0 HD21 LEU A 51 -0.553 2.787 -11.011 1.00 10.12 H new ATOM 0 HD22 LEU A 51 0.573 3.202 -12.325 1.00 10.12 H new ATOM 0 HD23 LEU A 51 0.831 1.726 -11.364 1.00 10.12 H new ATOM 804 N GLU A 52 2.548 0.299 -10.464 1.00 22.14 N ATOM 805 CA GLU A 52 2.268 -0.979 -11.108 1.00 11.04 C ATOM 806 C GLU A 52 0.832 -1.025 -11.621 1.00 73.33 C ATOM 807 O GLU A 52 0.559 -1.585 -12.683 1.00 71.34 O ATOM 808 CB GLU A 52 2.510 -2.132 -10.132 1.00 3.44 C ATOM 809 CG GLU A 52 2.121 -3.491 -10.687 1.00 13.12 C ATOM 810 CD GLU A 52 3.001 -3.924 -11.843 1.00 24.15 C ATOM 811 OE1 GLU A 52 2.880 -3.333 -12.936 1.00 15.24 O ATOM 812 OE2 GLU A 52 3.812 -4.855 -11.654 1.00 13.03 O ATOM 0 H GLU A 52 1.970 0.495 -9.647 1.00 22.14 H new ATOM 0 HA GLU A 52 2.943 -1.085 -11.957 1.00 11.04 H new ATOM 0 HB2 GLU A 52 3.565 -2.149 -9.858 1.00 3.44 H new ATOM 0 HB3 GLU A 52 1.946 -1.947 -9.218 1.00 3.44 H new ATOM 0 HG2 GLU A 52 2.181 -4.234 -9.892 1.00 13.12 H new ATOM 0 HG3 GLU A 52 1.083 -3.460 -11.018 1.00 13.12 H new ATOM 819 N ASP A 53 -0.083 -0.436 -10.859 1.00 45.51 N ATOM 820 CA ASP A 53 -1.491 -0.409 -11.235 1.00 4.22 C ATOM 821 C ASP A 53 -2.258 0.609 -10.397 1.00 21.32 C ATOM 822 O ASP A 53 -1.784 1.047 -9.349 1.00 52.45 O ATOM 823 CB ASP A 53 -2.111 -1.797 -11.069 1.00 12.01 C ATOM 824 CG ASP A 53 -1.780 -2.721 -12.223 1.00 61.34 C ATOM 825 OD1 ASP A 53 -1.826 -2.261 -13.385 1.00 33.24 O ATOM 826 OD2 ASP A 53 -1.473 -3.905 -11.967 1.00 54.51 O ATOM 0 H ASP A 53 0.126 0.030 -9.976 1.00 45.51 H new ATOM 0 HA ASP A 53 -1.557 -0.113 -12.282 1.00 4.22 H new ATOM 0 HB2 ASP A 53 -1.756 -2.241 -10.139 1.00 12.01 H new ATOM 0 HB3 ASP A 53 -3.193 -1.700 -10.984 1.00 12.01 H new ATOM 831 N GLU A 54 -3.445 0.981 -10.867 1.00 2.13 N ATOM 832 CA GLU A 54 -4.277 1.949 -10.161 1.00 64.42 C ATOM 833 C GLU A 54 -5.758 1.647 -10.368 1.00 25.54 C ATOM 834 O GLU A 54 -6.283 1.784 -11.473 1.00 50.12 O ATOM 835 CB GLU A 54 -3.962 3.368 -10.638 1.00 70.12 C ATOM 836 CG GLU A 54 -2.998 4.116 -9.733 1.00 15.31 C ATOM 837 CD GLU A 54 -2.845 5.574 -10.120 1.00 42.24 C ATOM 838 OE1 GLU A 54 -2.564 5.847 -11.306 1.00 52.22 O ATOM 839 OE2 GLU A 54 -3.007 6.442 -9.237 1.00 22.32 O ATOM 0 H GLU A 54 -3.852 0.627 -11.733 1.00 2.13 H new ATOM 0 HA GLU A 54 -4.055 1.874 -9.097 1.00 64.42 H new ATOM 0 HB2 GLU A 54 -3.540 3.319 -11.642 1.00 70.12 H new ATOM 0 HB3 GLU A 54 -4.892 3.933 -10.710 1.00 70.12 H new ATOM 0 HG2 GLU A 54 -3.349 4.053 -8.703 1.00 15.31 H new ATOM 0 HG3 GLU A 54 -2.023 3.631 -9.768 1.00 15.31 H new ATOM 846 N LEU A 55 -6.426 1.234 -9.297 1.00 32.42 N ATOM 847 CA LEU A 55 -7.847 0.911 -9.360 1.00 10.55 C ATOM 848 C LEU A 55 -8.674 1.944 -8.601 1.00 1.14 C ATOM 849 O LEU A 55 -8.329 2.330 -7.484 1.00 21.44 O ATOM 850 CB LEU A 55 -8.100 -0.484 -8.784 1.00 4.43 C ATOM 851 CG LEU A 55 -7.149 -1.585 -9.253 1.00 30.22 C ATOM 852 CD1 LEU A 55 -6.990 -2.648 -8.175 1.00 42.33 C ATOM 853 CD2 LEU A 55 -7.652 -2.208 -10.547 1.00 43.40 C ATOM 0 H LEU A 55 -6.007 1.115 -8.375 1.00 32.42 H new ATOM 0 HA LEU A 55 -8.151 0.926 -10.407 1.00 10.55 H new ATOM 0 HB2 LEU A 55 -8.045 -0.422 -7.697 1.00 4.43 H new ATOM 0 HB3 LEU A 55 -9.119 -0.780 -9.035 1.00 4.43 H new ATOM 0 HG LEU A 55 -6.173 -1.139 -9.442 1.00 30.22 H new ATOM 0 HD11 LEU A 55 -6.310 -3.424 -8.526 1.00 42.33 H new ATOM 0 HD12 LEU A 55 -6.585 -2.192 -7.271 1.00 42.33 H new ATOM 0 HD13 LEU A 55 -7.961 -3.090 -7.954 1.00 42.33 H new ATOM 0 HD21 LEU A 55 -6.963 -2.990 -10.866 1.00 43.40 H new ATOM 0 HD22 LEU A 55 -8.640 -2.639 -10.383 1.00 43.40 H new ATOM 0 HD23 LEU A 55 -7.714 -1.442 -11.320 1.00 43.40 H new ATOM 865 N GLN A 56 -9.767 2.386 -9.214 1.00 22.03 N ATOM 866 CA GLN A 56 -10.644 3.373 -8.594 1.00 40.34 C ATOM 867 C GLN A 56 -12.016 2.776 -8.301 1.00 72.42 C ATOM 868 O GLN A 56 -12.395 1.756 -8.876 1.00 51.55 O ATOM 869 CB GLN A 56 -10.791 4.597 -9.502 1.00 64.43 C ATOM 870 CG GLN A 56 -9.520 5.423 -9.619 1.00 0.02 C ATOM 871 CD GLN A 56 -8.564 4.879 -10.661 1.00 43.00 C ATOM 872 OE1 GLN A 56 -7.456 4.305 -10.206 1.00 34.42 O flip ATOM 873 NE2 GLN A 56 -8.816 4.975 -11.863 1.00 72.24 N flip ATOM 0 H GLN A 56 -10.067 2.077 -10.139 1.00 22.03 H new ATOM 0 HA GLN A 56 -10.193 3.680 -7.650 1.00 40.34 H new ATOM 0 HB2 GLN A 56 -11.093 4.268 -10.496 1.00 64.43 H new ATOM 0 HB3 GLN A 56 -11.592 5.230 -9.119 1.00 64.43 H new ATOM 0 HG2 GLN A 56 -9.781 6.450 -9.872 1.00 0.02 H new ATOM 0 HG3 GLN A 56 -9.019 5.451 -8.651 1.00 0.02 H new ATOM 0 HE21 GLN A 56 -9.679 5.424 -12.169 1.00 72.24 H new ATOM 0 HE22 GLN A 56 -8.161 4.606 -12.552 1.00 72.24 H new ATOM 882 N ASN A 57 -12.756 3.417 -7.402 1.00 70.54 N ATOM 883 CA ASN A 57 -14.086 2.947 -7.032 1.00 12.41 C ATOM 884 C ASN A 57 -14.078 1.444 -6.768 1.00 12.20 C ATOM 885 O ASN A 57 -14.873 0.700 -7.342 1.00 31.33 O ATOM 886 CB ASN A 57 -15.092 3.278 -8.137 1.00 61.54 C ATOM 887 CG ASN A 57 -15.047 4.738 -8.543 1.00 13.13 C ATOM 888 OD1 ASN A 57 -15.760 5.571 -7.982 1.00 72.10 O ATOM 889 ND2 ASN A 57 -14.207 5.055 -9.521 1.00 32.51 N ATOM 0 H ASN A 57 -12.457 4.263 -6.917 1.00 70.54 H new ATOM 0 HA ASN A 57 -14.383 3.457 -6.115 1.00 12.41 H new ATOM 0 HB2 ASN A 57 -14.888 2.655 -9.008 1.00 61.54 H new ATOM 0 HB3 ASN A 57 -16.097 3.030 -7.796 1.00 61.54 H new ATOM 0 HD21 ASN A 57 -14.133 6.022 -9.836 1.00 32.51 H new ATOM 0 HD22 ASN A 57 -13.635 4.331 -9.957 1.00 32.51 H new ATOM 896 N ILE A 58 -13.176 1.008 -5.897 1.00 20.41 N ATOM 897 CA ILE A 58 -13.066 -0.405 -5.555 1.00 34.32 C ATOM 898 C ILE A 58 -13.126 -0.612 -4.046 1.00 23.32 C ATOM 899 O ILE A 58 -12.561 0.167 -3.279 1.00 65.21 O ATOM 900 CB ILE A 58 -11.759 -1.016 -6.094 1.00 54.44 C ATOM 901 CG1 ILE A 58 -11.127 -1.932 -5.045 1.00 34.25 C ATOM 902 CG2 ILE A 58 -10.788 0.084 -6.498 1.00 55.25 C ATOM 903 CD1 ILE A 58 -10.421 -1.184 -3.936 1.00 14.51 C ATOM 0 H ILE A 58 -12.510 1.612 -5.415 1.00 20.41 H new ATOM 0 HA ILE A 58 -13.912 -0.909 -6.022 1.00 34.32 H new ATOM 0 HB ILE A 58 -11.991 -1.612 -6.976 1.00 54.44 H new ATOM 0 HG12 ILE A 58 -11.903 -2.563 -4.610 1.00 34.25 H new ATOM 0 HG13 ILE A 58 -10.415 -2.595 -5.536 1.00 34.25 H new ATOM 0 HG21 ILE A 58 -9.869 -0.363 -6.877 1.00 55.25 H new ATOM 0 HG22 ILE A 58 -11.239 0.700 -7.276 1.00 55.25 H new ATOM 0 HG23 ILE A 58 -10.559 0.704 -5.631 1.00 55.25 H new ATOM 0 HD11 ILE A 58 -9.997 -1.897 -3.229 1.00 14.51 H new ATOM 0 HD12 ILE A 58 -9.623 -0.574 -4.359 1.00 14.51 H new ATOM 0 HD13 ILE A 58 -11.134 -0.541 -3.420 1.00 14.51 H new ATOM 915 N SER A 59 -13.814 -1.670 -3.625 1.00 42.22 N ATOM 916 CA SER A 59 -13.949 -1.979 -2.207 1.00 40.30 C ATOM 917 C SER A 59 -12.748 -2.777 -1.707 1.00 42.54 C ATOM 918 O SER A 59 -11.920 -3.253 -2.485 1.00 33.22 O ATOM 919 CB SER A 59 -15.237 -2.764 -1.955 1.00 33.30 C ATOM 920 OG SER A 59 -16.191 -1.974 -1.265 1.00 43.24 O ATOM 0 H SER A 59 -14.286 -2.327 -4.246 1.00 42.22 H new ATOM 0 HA SER A 59 -13.992 -1.038 -1.658 1.00 40.30 H new ATOM 0 HB2 SER A 59 -15.655 -3.097 -2.905 1.00 33.30 H new ATOM 0 HB3 SER A 59 -15.013 -3.659 -1.374 1.00 33.30 H new ATOM 0 HG SER A 59 -17.005 -2.499 -1.118 1.00 43.24 H new ATOM 926 N PRO A 60 -12.649 -2.926 -0.379 1.00 33.44 N ATOM 927 CA PRO A 60 -11.553 -3.666 0.256 1.00 53.21 C ATOM 928 C PRO A 60 -11.640 -5.166 -0.005 1.00 32.13 C ATOM 929 O PRO A 60 -10.823 -5.938 0.494 1.00 62.35 O ATOM 930 CB PRO A 60 -11.742 -3.370 1.746 1.00 33.03 C ATOM 931 CG PRO A 60 -13.192 -3.058 1.890 1.00 31.12 C ATOM 932 CD PRO A 60 -13.600 -2.385 0.609 1.00 43.14 C ATOM 0 HA PRO A 60 -10.579 -3.366 -0.132 1.00 53.21 H new ATOM 0 HB2 PRO A 60 -11.459 -4.226 2.359 1.00 33.03 H new ATOM 0 HB3 PRO A 60 -11.123 -2.531 2.064 1.00 33.03 H new ATOM 0 HG2 PRO A 60 -13.772 -3.966 2.056 1.00 31.12 H new ATOM 0 HG3 PRO A 60 -13.368 -2.407 2.746 1.00 31.12 H new ATOM 0 HD2 PRO A 60 -14.631 -2.618 0.343 1.00 43.14 H new ATOM 0 HD3 PRO A 60 -13.527 -1.300 0.684 1.00 43.14 H new ATOM 940 N GLU A 61 -12.635 -5.569 -0.789 1.00 62.12 N ATOM 941 CA GLU A 61 -12.826 -6.978 -1.115 1.00 75.03 C ATOM 942 C GLU A 61 -12.318 -7.285 -2.521 1.00 12.31 C ATOM 943 O GLU A 61 -11.987 -8.427 -2.836 1.00 44.54 O ATOM 944 CB GLU A 61 -14.305 -7.353 -1.002 1.00 33.33 C ATOM 945 CG GLU A 61 -14.640 -8.131 0.260 1.00 60.12 C ATOM 946 CD GLU A 61 -15.924 -8.928 0.131 1.00 41.03 C ATOM 947 OE1 GLU A 61 -16.289 -9.281 -1.010 1.00 33.44 O ATOM 948 OE2 GLU A 61 -16.562 -9.197 1.169 1.00 33.34 O ATOM 0 H GLU A 61 -13.320 -4.941 -1.210 1.00 62.12 H new ATOM 0 HA GLU A 61 -12.252 -7.571 -0.403 1.00 75.03 H new ATOM 0 HB2 GLU A 61 -14.905 -6.443 -1.028 1.00 33.33 H new ATOM 0 HB3 GLU A 61 -14.588 -7.947 -1.871 1.00 33.33 H new ATOM 0 HG2 GLU A 61 -13.818 -8.808 0.494 1.00 60.12 H new ATOM 0 HG3 GLU A 61 -14.730 -7.438 1.097 1.00 60.12 H new ATOM 955 N GLU A 62 -12.261 -6.256 -3.361 1.00 50.52 N ATOM 956 CA GLU A 62 -11.796 -6.416 -4.733 1.00 63.33 C ATOM 957 C GLU A 62 -10.277 -6.282 -4.812 1.00 54.12 C ATOM 958 O GLU A 62 -9.609 -7.063 -5.490 1.00 64.31 O ATOM 959 CB GLU A 62 -12.458 -5.381 -5.644 1.00 52.35 C ATOM 960 CG GLU A 62 -13.669 -5.914 -6.392 1.00 12.42 C ATOM 961 CD GLU A 62 -14.629 -6.663 -5.488 1.00 33.05 C ATOM 962 OE1 GLU A 62 -15.319 -6.005 -4.681 1.00 71.53 O ATOM 963 OE2 GLU A 62 -14.689 -7.906 -5.586 1.00 11.52 O ATOM 0 H GLU A 62 -12.531 -5.304 -3.115 1.00 50.52 H new ATOM 0 HA GLU A 62 -12.074 -7.415 -5.069 1.00 63.33 H new ATOM 0 HB2 GLU A 62 -12.761 -4.522 -5.044 1.00 52.35 H new ATOM 0 HB3 GLU A 62 -11.724 -5.023 -6.366 1.00 52.35 H new ATOM 0 HG2 GLU A 62 -14.194 -5.084 -6.865 1.00 12.42 H new ATOM 0 HG3 GLU A 62 -13.336 -6.577 -7.191 1.00 12.42 H new ATOM 970 N LEU A 63 -9.741 -5.286 -4.116 1.00 25.31 N ATOM 971 CA LEU A 63 -8.302 -5.048 -4.106 1.00 61.10 C ATOM 972 C LEU A 63 -7.541 -6.326 -3.765 1.00 50.24 C ATOM 973 O LEU A 63 -6.596 -6.703 -4.459 1.00 55.21 O ATOM 974 CB LEU A 63 -7.953 -3.950 -3.100 1.00 11.21 C ATOM 975 CG LEU A 63 -6.996 -2.866 -3.595 1.00 42.31 C ATOM 976 CD1 LEU A 63 -6.385 -2.117 -2.422 1.00 2.13 C ATOM 977 CD2 LEU A 63 -5.907 -3.473 -4.468 1.00 52.54 C ATOM 0 H LEU A 63 -10.281 -4.630 -3.551 1.00 25.31 H new ATOM 0 HA LEU A 63 -8.006 -4.725 -5.104 1.00 61.10 H new ATOM 0 HB2 LEU A 63 -8.878 -3.471 -2.780 1.00 11.21 H new ATOM 0 HB3 LEU A 63 -7.515 -4.418 -2.219 1.00 11.21 H new ATOM 0 HG LEU A 63 -7.563 -2.156 -4.197 1.00 42.31 H new ATOM 0 HD11 LEU A 63 -5.707 -1.349 -2.794 1.00 2.13 H new ATOM 0 HD12 LEU A 63 -7.177 -1.649 -1.837 1.00 2.13 H new ATOM 0 HD13 LEU A 63 -5.833 -2.815 -1.792 1.00 2.13 H new ATOM 0 HD21 LEU A 63 -5.235 -2.686 -4.811 1.00 52.54 H new ATOM 0 HD22 LEU A 63 -5.343 -4.205 -3.890 1.00 52.54 H new ATOM 0 HD23 LEU A 63 -6.362 -3.963 -5.329 1.00 52.54 H new ATOM 989 N LYS A 64 -7.959 -6.989 -2.693 1.00 63.41 N ATOM 990 CA LYS A 64 -7.320 -8.227 -2.261 1.00 54.02 C ATOM 991 C LYS A 64 -7.250 -9.231 -3.406 1.00 61.12 C ATOM 992 O LYS A 64 -6.307 -10.018 -3.499 1.00 41.34 O ATOM 993 CB LYS A 64 -8.083 -8.833 -1.081 1.00 73.12 C ATOM 994 CG LYS A 64 -8.422 -10.302 -1.268 1.00 34.23 C ATOM 995 CD LYS A 64 -8.779 -10.964 0.053 1.00 41.21 C ATOM 996 CE LYS A 64 -10.277 -11.200 0.172 1.00 72.22 C ATOM 997 NZ LYS A 64 -10.624 -12.643 0.043 1.00 3.31 N ATOM 0 H LYS A 64 -8.738 -6.690 -2.106 1.00 63.41 H new ATOM 0 HA LYS A 64 -6.303 -7.992 -1.946 1.00 54.02 H new ATOM 0 HB2 LYS A 64 -7.487 -8.718 -0.176 1.00 73.12 H new ATOM 0 HB3 LYS A 64 -9.005 -8.272 -0.928 1.00 73.12 H new ATOM 0 HG2 LYS A 64 -9.257 -10.398 -1.962 1.00 34.23 H new ATOM 0 HG3 LYS A 64 -7.573 -10.818 -1.717 1.00 34.23 H new ATOM 0 HD2 LYS A 64 -8.252 -11.914 0.139 1.00 41.21 H new ATOM 0 HD3 LYS A 64 -8.442 -10.337 0.878 1.00 41.21 H new ATOM 0 HE2 LYS A 64 -10.628 -10.827 1.134 1.00 72.22 H new ATOM 0 HE3 LYS A 64 -10.797 -10.631 -0.599 1.00 72.22 H new ATOM 0 HZ1 LYS A 64 -11.654 -12.762 0.130 1.00 3.31 H new ATOM 0 HZ2 LYS A 64 -10.312 -12.993 -0.885 1.00 3.31 H new ATOM 0 HZ3 LYS A 64 -10.149 -13.183 0.794 1.00 3.31 H new ATOM 1011 N LEU A 65 -8.254 -9.200 -4.277 1.00 4.10 N ATOM 1012 CA LEU A 65 -8.305 -10.108 -5.417 1.00 54.34 C ATOM 1013 C LEU A 65 -7.311 -9.686 -6.495 1.00 15.54 C ATOM 1014 O LEU A 65 -6.661 -10.525 -7.116 1.00 60.14 O ATOM 1015 CB LEU A 65 -9.719 -10.147 -5.999 1.00 21.40 C ATOM 1016 CG LEU A 65 -10.831 -10.562 -5.034 1.00 61.14 C ATOM 1017 CD1 LEU A 65 -12.196 -10.363 -5.675 1.00 22.52 C ATOM 1018 CD2 LEU A 65 -10.649 -12.010 -4.602 1.00 44.02 C ATOM 0 H LEU A 65 -9.043 -8.556 -4.215 1.00 4.10 H new ATOM 0 HA LEU A 65 -8.034 -11.105 -5.069 1.00 54.34 H new ATOM 0 HB2 LEU A 65 -9.956 -9.158 -6.391 1.00 21.40 H new ATOM 0 HB3 LEU A 65 -9.724 -10.835 -6.844 1.00 21.40 H new ATOM 0 HG LEU A 65 -10.772 -9.929 -4.149 1.00 61.14 H new ATOM 0 HD11 LEU A 65 -12.975 -10.664 -4.974 1.00 22.52 H new ATOM 0 HD12 LEU A 65 -12.327 -9.312 -5.934 1.00 22.52 H new ATOM 0 HD13 LEU A 65 -12.266 -10.970 -6.577 1.00 22.52 H new ATOM 0 HD21 LEU A 65 -11.449 -12.288 -3.916 1.00 44.02 H new ATOM 0 HD22 LEU A 65 -10.681 -12.658 -5.478 1.00 44.02 H new ATOM 0 HD23 LEU A 65 -9.687 -12.122 -4.102 1.00 44.02 H new ATOM 1030 N GLU A 66 -7.198 -8.378 -6.708 1.00 53.33 N ATOM 1031 CA GLU A 66 -6.282 -7.845 -7.710 1.00 4.21 C ATOM 1032 C GLU A 66 -4.832 -8.114 -7.319 1.00 32.43 C ATOM 1033 O GLU A 66 -3.946 -8.166 -8.173 1.00 50.20 O ATOM 1034 CB GLU A 66 -6.503 -6.341 -7.886 1.00 54.32 C ATOM 1035 CG GLU A 66 -7.924 -5.977 -8.284 1.00 31.45 C ATOM 1036 CD GLU A 66 -8.289 -6.477 -9.667 1.00 54.01 C ATOM 1037 OE1 GLU A 66 -7.954 -5.790 -10.654 1.00 53.22 O ATOM 1038 OE2 GLU A 66 -8.910 -7.557 -9.763 1.00 70.12 O ATOM 0 H GLU A 66 -7.728 -7.669 -6.201 1.00 53.33 H new ATOM 0 HA GLU A 66 -6.485 -8.348 -8.655 1.00 4.21 H new ATOM 0 HB2 GLU A 66 -6.255 -5.834 -6.953 1.00 54.32 H new ATOM 0 HB3 GLU A 66 -5.815 -5.968 -8.645 1.00 54.32 H new ATOM 0 HG2 GLU A 66 -8.619 -6.394 -7.556 1.00 31.45 H new ATOM 0 HG3 GLU A 66 -8.040 -4.894 -8.251 1.00 31.45 H new ATOM 1045 N LEU A 67 -4.597 -8.285 -6.023 1.00 2.24 N ATOM 1046 CA LEU A 67 -3.255 -8.548 -5.517 1.00 24.33 C ATOM 1047 C LEU A 67 -2.868 -10.008 -5.730 1.00 71.43 C ATOM 1048 O LEU A 67 -3.707 -10.909 -5.697 1.00 50.32 O ATOM 1049 CB LEU A 67 -3.171 -8.199 -4.029 1.00 32.21 C ATOM 1050 CG LEU A 67 -3.256 -6.713 -3.682 1.00 40.30 C ATOM 1051 CD1 LEU A 67 -3.435 -6.523 -2.185 1.00 24.14 C ATOM 1052 CD2 LEU A 67 -2.014 -5.980 -4.170 1.00 33.11 C ATOM 0 H LEU A 67 -5.319 -8.246 -5.303 1.00 2.24 H new ATOM 0 HA LEU A 67 -2.556 -7.921 -6.071 1.00 24.33 H new ATOM 0 HB2 LEU A 67 -3.975 -8.720 -3.508 1.00 32.21 H new ATOM 0 HB3 LEU A 67 -2.232 -8.590 -3.637 1.00 32.21 H new ATOM 0 HG LEU A 67 -4.125 -6.291 -4.187 1.00 40.30 H new ATOM 0 HD11 LEU A 67 -3.493 -5.459 -1.958 1.00 24.14 H new ATOM 0 HD12 LEU A 67 -4.354 -7.014 -1.863 1.00 24.14 H new ATOM 0 HD13 LEU A 67 -2.587 -6.960 -1.659 1.00 24.14 H new ATOM 0 HD21 LEU A 67 -2.091 -4.923 -3.915 1.00 33.11 H new ATOM 0 HD22 LEU A 67 -1.130 -6.405 -3.694 1.00 33.11 H new ATOM 0 HD23 LEU A 67 -1.930 -6.087 -5.252 1.00 33.11 H new ATOM 1064 N PRO A 68 -1.568 -10.251 -5.954 1.00 13.50 N ATOM 1065 CA PRO A 68 -1.041 -11.600 -6.175 1.00 31.13 C ATOM 1066 C PRO A 68 -1.084 -12.453 -4.911 1.00 62.22 C ATOM 1067 O PRO A 68 -1.689 -12.068 -3.912 1.00 42.43 O ATOM 1068 CB PRO A 68 0.407 -11.349 -6.603 1.00 22.54 C ATOM 1069 CG PRO A 68 0.757 -10.032 -6.002 1.00 42.22 C ATOM 1070 CD PRO A 68 -0.512 -9.225 -6.007 1.00 32.31 C ATOM 0 HA PRO A 68 -1.627 -12.152 -6.910 1.00 31.13 H new ATOM 0 HB2 PRO A 68 1.068 -12.137 -6.243 1.00 22.54 H new ATOM 0 HB3 PRO A 68 0.501 -11.326 -7.689 1.00 22.54 H new ATOM 0 HG2 PRO A 68 1.138 -10.154 -4.988 1.00 42.22 H new ATOM 0 HG3 PRO A 68 1.538 -9.535 -6.578 1.00 42.22 H new ATOM 0 HD2 PRO A 68 -0.563 -8.551 -5.152 1.00 32.31 H new ATOM 0 HD3 PRO A 68 -0.594 -8.610 -6.903 1.00 32.31 H new ATOM 1078 N GLU A 69 -0.437 -13.614 -4.965 1.00 12.14 N ATOM 1079 CA GLU A 69 -0.403 -14.521 -3.823 1.00 64.34 C ATOM 1080 C GLU A 69 1.034 -14.878 -3.456 1.00 20.43 C ATOM 1081 O GLU A 69 1.295 -15.426 -2.384 1.00 74.01 O ATOM 1082 CB GLU A 69 -1.194 -15.794 -4.132 1.00 32.24 C ATOM 1083 CG GLU A 69 -0.963 -16.329 -5.535 1.00 63.41 C ATOM 1084 CD GLU A 69 -2.079 -15.957 -6.492 1.00 64.02 C ATOM 1085 OE1 GLU A 69 -3.087 -16.691 -6.542 1.00 74.21 O ATOM 1086 OE2 GLU A 69 -1.942 -14.932 -7.191 1.00 63.23 O ATOM 0 H GLU A 69 0.069 -13.948 -5.785 1.00 12.14 H new ATOM 0 HA GLU A 69 -0.861 -14.014 -2.974 1.00 64.34 H new ATOM 0 HB2 GLU A 69 -0.923 -16.564 -3.410 1.00 32.24 H new ATOM 0 HB3 GLU A 69 -2.257 -15.592 -4.000 1.00 32.24 H new ATOM 0 HG2 GLU A 69 -0.018 -15.942 -5.916 1.00 63.41 H new ATOM 0 HG3 GLU A 69 -0.870 -17.414 -5.495 1.00 63.41 H new ATOM 1093 N ARG A 70 1.963 -14.566 -4.353 1.00 4.41 N ATOM 1094 CA ARG A 70 3.374 -14.855 -4.125 1.00 72.00 C ATOM 1095 C ARG A 70 4.255 -13.740 -4.681 1.00 35.45 C ATOM 1096 O ARG A 70 5.443 -13.941 -4.928 1.00 21.04 O ATOM 1097 CB ARG A 70 3.754 -16.189 -4.770 1.00 74.42 C ATOM 1098 CG ARG A 70 3.160 -17.397 -4.065 1.00 62.31 C ATOM 1099 CD ARG A 70 2.525 -18.364 -5.054 1.00 12.21 C ATOM 1100 NE ARG A 70 3.178 -19.670 -5.038 1.00 13.20 N ATOM 1101 CZ ARG A 70 2.680 -20.747 -5.635 1.00 22.02 C ATOM 1102 NH1 ARG A 70 1.531 -20.674 -6.291 1.00 14.00 N ATOM 1103 NH2 ARG A 70 3.333 -21.900 -5.576 1.00 62.35 N ATOM 0 H ARG A 70 1.764 -14.113 -5.245 1.00 4.41 H new ATOM 0 HA ARG A 70 3.536 -14.920 -3.049 1.00 72.00 H new ATOM 0 HB2 ARG A 70 3.425 -16.187 -5.809 1.00 74.42 H new ATOM 0 HB3 ARG A 70 4.840 -16.282 -4.780 1.00 74.42 H new ATOM 0 HG2 ARG A 70 3.939 -17.910 -3.502 1.00 62.31 H new ATOM 0 HG3 ARG A 70 2.411 -17.067 -3.345 1.00 62.31 H new ATOM 0 HD2 ARG A 70 1.468 -18.484 -4.816 1.00 12.21 H new ATOM 0 HD3 ARG A 70 2.580 -17.944 -6.058 1.00 12.21 H new ATOM 0 HE ARG A 70 4.064 -19.760 -4.542 1.00 13.20 H new ATOM 0 HH11 ARG A 70 1.026 -19.789 -6.339 1.00 14.00 H new ATOM 0 HH12 ARG A 70 1.151 -21.503 -6.748 1.00 14.00 H new ATOM 0 HH21 ARG A 70 4.218 -21.960 -5.072 1.00 62.35 H new ATOM 0 HH22 ARG A 70 2.950 -22.727 -6.035 1.00 62.35 H new ATOM 1117 N GLN A 71 3.662 -12.566 -4.876 1.00 31.02 N ATOM 1118 CA GLN A 71 4.393 -11.421 -5.403 1.00 51.14 C ATOM 1119 C GLN A 71 4.237 -10.207 -4.493 1.00 34.15 C ATOM 1120 O GLN A 71 3.185 -9.570 -4.442 1.00 55.24 O ATOM 1121 CB GLN A 71 3.904 -11.081 -6.813 1.00 33.33 C ATOM 1122 CG GLN A 71 4.551 -11.924 -7.901 1.00 15.53 C ATOM 1123 CD GLN A 71 4.795 -11.141 -9.176 1.00 22.14 C ATOM 1124 OE1 GLN A 71 5.924 -11.060 -9.661 1.00 32.03 O ATOM 1125 NE2 GLN A 71 3.736 -10.559 -9.726 1.00 52.34 N ATOM 0 H GLN A 71 2.678 -12.384 -4.677 1.00 31.02 H new ATOM 0 HA GLN A 71 5.449 -11.687 -5.445 1.00 51.14 H new ATOM 0 HB2 GLN A 71 2.823 -11.215 -6.856 1.00 33.33 H new ATOM 0 HB3 GLN A 71 4.103 -10.028 -7.014 1.00 33.33 H new ATOM 0 HG2 GLN A 71 5.498 -12.319 -7.534 1.00 15.53 H new ATOM 0 HG3 GLN A 71 3.912 -12.780 -8.121 1.00 15.53 H new ATOM 0 HE21 GLN A 71 2.819 -10.652 -9.290 1.00 52.34 H new ATOM 0 HE22 GLN A 71 3.840 -10.018 -10.585 1.00 52.34 H new ATOM 1134 N PRO A 72 5.306 -9.880 -3.753 1.00 41.31 N ATOM 1135 CA PRO A 72 5.312 -8.741 -2.830 1.00 32.43 C ATOM 1136 C PRO A 72 5.285 -7.403 -3.559 1.00 75.03 C ATOM 1137 O PRO A 72 5.993 -7.210 -4.547 1.00 50.35 O ATOM 1138 CB PRO A 72 6.629 -8.908 -2.069 1.00 24.14 C ATOM 1139 CG PRO A 72 7.506 -9.681 -2.993 1.00 54.54 C ATOM 1140 CD PRO A 72 6.593 -10.596 -3.761 1.00 52.02 C ATOM 0 HA PRO A 72 4.431 -8.733 -2.189 1.00 32.43 H new ATOM 0 HB2 PRO A 72 7.069 -7.942 -1.822 1.00 24.14 H new ATOM 0 HB3 PRO A 72 6.478 -9.439 -1.129 1.00 24.14 H new ATOM 0 HG2 PRO A 72 8.047 -9.015 -3.665 1.00 54.54 H new ATOM 0 HG3 PRO A 72 8.252 -10.250 -2.438 1.00 54.54 H new ATOM 0 HD2 PRO A 72 6.953 -10.764 -4.776 1.00 52.02 H new ATOM 0 HD3 PRO A 72 6.512 -11.574 -3.286 1.00 52.02 H new ATOM 1148 N ARG A 73 4.463 -6.482 -3.066 1.00 72.32 N ATOM 1149 CA ARG A 73 4.343 -5.162 -3.673 1.00 53.22 C ATOM 1150 C ARG A 73 3.661 -4.185 -2.720 1.00 14.34 C ATOM 1151 O ARG A 73 3.087 -4.587 -1.707 1.00 73.32 O ATOM 1152 CB ARG A 73 3.555 -5.247 -4.982 1.00 33.25 C ATOM 1153 CG ARG A 73 2.182 -5.881 -4.826 1.00 24.22 C ATOM 1154 CD ARG A 73 1.841 -6.771 -6.011 1.00 65.51 C ATOM 1155 NE ARG A 73 0.625 -6.336 -6.690 1.00 60.11 N ATOM 1156 CZ ARG A 73 0.323 -6.666 -7.941 1.00 71.10 C ATOM 1157 NH1 ARG A 73 1.145 -7.431 -8.645 1.00 61.53 N ATOM 1158 NH2 ARG A 73 -0.804 -6.230 -8.490 1.00 31.53 N ATOM 0 H ARG A 73 3.871 -6.626 -2.248 1.00 72.32 H new ATOM 0 HA ARG A 73 5.348 -4.796 -3.885 1.00 53.22 H new ATOM 0 HB2 ARG A 73 3.438 -4.244 -5.392 1.00 33.25 H new ATOM 0 HB3 ARG A 73 4.131 -5.822 -5.707 1.00 33.25 H new ATOM 0 HG2 ARG A 73 2.154 -6.469 -3.908 1.00 24.22 H new ATOM 0 HG3 ARG A 73 1.428 -5.100 -4.728 1.00 24.22 H new ATOM 0 HD2 ARG A 73 2.671 -6.768 -6.717 1.00 65.51 H new ATOM 0 HD3 ARG A 73 1.717 -7.798 -5.669 1.00 65.51 H new ATOM 0 HE ARG A 73 -0.029 -5.746 -6.176 1.00 60.11 H new ATOM 0 HH11 ARG A 73 2.012 -7.768 -8.227 1.00 61.53 H new ATOM 0 HH12 ARG A 73 0.911 -7.683 -9.605 1.00 61.53 H new ATOM 0 HH21 ARG A 73 -1.439 -5.641 -7.951 1.00 31.53 H new ATOM 0 HH22 ARG A 73 -1.035 -6.484 -9.451 1.00 31.53 H new ATOM 1172 N PHE A 74 3.729 -2.899 -3.049 1.00 72.14 N ATOM 1173 CA PHE A 74 3.119 -1.865 -2.222 1.00 34.33 C ATOM 1174 C PHE A 74 1.750 -1.469 -2.766 1.00 53.05 C ATOM 1175 O PHE A 74 1.497 -1.563 -3.968 1.00 14.22 O ATOM 1176 CB PHE A 74 4.028 -0.636 -2.153 1.00 13.45 C ATOM 1177 CG PHE A 74 5.391 -0.929 -1.593 1.00 41.43 C ATOM 1178 CD1 PHE A 74 5.531 -1.516 -0.346 1.00 41.34 C ATOM 1179 CD2 PHE A 74 6.532 -0.618 -2.316 1.00 3.22 C ATOM 1180 CE1 PHE A 74 6.783 -1.786 0.171 1.00 5.42 C ATOM 1181 CE2 PHE A 74 7.788 -0.886 -1.803 1.00 55.43 C ATOM 1182 CZ PHE A 74 7.914 -1.471 -0.560 1.00 35.34 C ATOM 0 H PHE A 74 4.201 -2.548 -3.883 1.00 72.14 H new ATOM 0 HA PHE A 74 2.988 -2.269 -1.218 1.00 34.33 H new ATOM 0 HB2 PHE A 74 4.137 -0.218 -3.154 1.00 13.45 H new ATOM 0 HB3 PHE A 74 3.548 0.127 -1.540 1.00 13.45 H new ATOM 0 HD1 PHE A 74 4.651 -1.765 0.228 1.00 41.34 H new ATOM 0 HD2 PHE A 74 6.439 -0.162 -3.290 1.00 3.22 H new ATOM 0 HE1 PHE A 74 6.879 -2.243 1.145 1.00 5.42 H new ATOM 0 HE2 PHE A 74 8.670 -0.637 -2.375 1.00 55.43 H new ATOM 0 HZ PHE A 74 8.894 -1.683 -0.158 1.00 35.34 H new ATOM 1192 N VAL A 75 0.869 -1.026 -1.875 1.00 5.05 N ATOM 1193 CA VAL A 75 -0.473 -0.615 -2.264 1.00 53.13 C ATOM 1194 C VAL A 75 -1.034 0.420 -1.296 1.00 1.31 C ATOM 1195 O VAL A 75 -0.966 0.249 -0.079 1.00 0.25 O ATOM 1196 CB VAL A 75 -1.434 -1.819 -2.324 1.00 4.51 C ATOM 1197 CG1 VAL A 75 -2.794 -1.390 -2.851 1.00 12.51 C ATOM 1198 CG2 VAL A 75 -0.845 -2.926 -3.184 1.00 43.34 C ATOM 0 H VAL A 75 1.062 -0.943 -0.877 1.00 5.05 H new ATOM 0 HA VAL A 75 -0.392 -0.173 -3.257 1.00 53.13 H new ATOM 0 HB VAL A 75 -1.568 -2.207 -1.314 1.00 4.51 H new ATOM 0 HG11 VAL A 75 -3.459 -2.253 -2.886 1.00 12.51 H new ATOM 0 HG12 VAL A 75 -3.217 -0.632 -2.192 1.00 12.51 H new ATOM 0 HG13 VAL A 75 -2.682 -0.977 -3.853 1.00 12.51 H new ATOM 0 HG21 VAL A 75 -1.536 -3.769 -3.216 1.00 43.34 H new ATOM 0 HG22 VAL A 75 -0.681 -2.553 -4.195 1.00 43.34 H new ATOM 0 HG23 VAL A 75 0.104 -3.251 -2.758 1.00 43.34 H new ATOM 1208 N VAL A 76 -1.590 1.497 -1.844 1.00 71.31 N ATOM 1209 CA VAL A 76 -2.165 2.560 -1.030 1.00 44.30 C ATOM 1210 C VAL A 76 -3.677 2.634 -1.210 1.00 21.22 C ATOM 1211 O VAL A 76 -4.171 3.257 -2.149 1.00 10.22 O ATOM 1212 CB VAL A 76 -1.549 3.929 -1.377 1.00 72.43 C ATOM 1213 CG1 VAL A 76 -2.307 5.047 -0.680 1.00 14.20 C ATOM 1214 CG2 VAL A 76 -0.074 3.959 -1.007 1.00 34.35 C ATOM 0 H VAL A 76 -1.654 1.655 -2.850 1.00 71.31 H new ATOM 0 HA VAL A 76 -1.938 2.321 0.009 1.00 44.30 H new ATOM 0 HB VAL A 76 -1.632 4.084 -2.453 1.00 72.43 H new ATOM 0 HG11 VAL A 76 -1.858 6.006 -0.937 1.00 14.20 H new ATOM 0 HG12 VAL A 76 -3.348 5.036 -1.002 1.00 14.20 H new ATOM 0 HG13 VAL A 76 -2.259 4.901 0.399 1.00 14.20 H new ATOM 0 HG21 VAL A 76 0.345 4.933 -1.259 1.00 34.35 H new ATOM 0 HG22 VAL A 76 0.036 3.782 0.063 1.00 34.35 H new ATOM 0 HG23 VAL A 76 0.456 3.183 -1.559 1.00 34.35 H new ATOM 1224 N TYR A 77 -4.407 1.995 -0.303 1.00 24.41 N ATOM 1225 CA TYR A 77 -5.864 1.986 -0.362 1.00 64.03 C ATOM 1226 C TYR A 77 -6.445 3.200 0.356 1.00 41.03 C ATOM 1227 O TYR A 77 -5.975 3.587 1.426 1.00 64.23 O ATOM 1228 CB TYR A 77 -6.413 0.700 0.260 1.00 2.10 C ATOM 1229 CG TYR A 77 -7.894 0.503 0.032 1.00 14.44 C ATOM 1230 CD1 TYR A 77 -8.471 0.783 -1.200 1.00 70.24 C ATOM 1231 CD2 TYR A 77 -8.717 0.038 1.050 1.00 12.34 C ATOM 1232 CE1 TYR A 77 -9.825 0.605 -1.412 1.00 61.33 C ATOM 1233 CE2 TYR A 77 -10.072 -0.145 0.847 1.00 41.41 C ATOM 1234 CZ TYR A 77 -10.620 0.140 -0.386 1.00 55.33 C ATOM 1235 OH TYR A 77 -11.969 -0.039 -0.593 1.00 63.13 O ATOM 0 H TYR A 77 -4.014 1.476 0.482 1.00 24.41 H new ATOM 0 HA TYR A 77 -6.160 2.030 -1.410 1.00 64.03 H new ATOM 0 HB2 TYR A 77 -5.874 -0.153 -0.153 1.00 2.10 H new ATOM 0 HB3 TYR A 77 -6.217 0.712 1.332 1.00 2.10 H new ATOM 0 HD1 TYR A 77 -7.851 1.146 -2.006 1.00 70.24 H new ATOM 0 HD2 TYR A 77 -8.291 -0.184 2.017 1.00 12.34 H new ATOM 0 HE1 TYR A 77 -10.258 0.829 -2.376 1.00 61.33 H new ATOM 0 HE2 TYR A 77 -10.697 -0.509 1.649 1.00 41.41 H new ATOM 0 HH TYR A 77 -12.189 0.179 -1.523 1.00 63.13 H new ATOM 1245 N SER A 78 -7.472 3.796 -0.241 1.00 54.01 N ATOM 1246 CA SER A 78 -8.117 4.969 0.338 1.00 31.45 C ATOM 1247 C SER A 78 -9.566 4.665 0.708 1.00 61.55 C ATOM 1248 O SER A 78 -10.459 4.716 -0.139 1.00 62.52 O ATOM 1249 CB SER A 78 -8.066 6.142 -0.642 1.00 4.22 C ATOM 1250 OG SER A 78 -8.882 7.212 -0.200 1.00 41.25 O ATOM 0 H SER A 78 -7.875 3.486 -1.125 1.00 54.01 H new ATOM 0 HA SER A 78 -7.576 5.239 1.245 1.00 31.45 H new ATOM 0 HB2 SER A 78 -7.037 6.486 -0.749 1.00 4.22 H new ATOM 0 HB3 SER A 78 -8.396 5.812 -1.627 1.00 4.22 H new ATOM 0 HG SER A 78 -8.831 7.950 -0.843 1.00 41.25 H new ATOM 1256 N TYR A 79 -9.792 4.347 1.978 1.00 41.40 N ATOM 1257 CA TYR A 79 -11.131 4.031 2.461 1.00 2.41 C ATOM 1258 C TYR A 79 -11.872 5.299 2.874 1.00 35.45 C ATOM 1259 O TYR A 79 -11.267 6.354 3.065 1.00 0.13 O ATOM 1260 CB TYR A 79 -11.055 3.063 3.642 1.00 70.25 C ATOM 1261 CG TYR A 79 -12.371 2.881 4.362 1.00 51.21 C ATOM 1262 CD1 TYR A 79 -13.314 1.968 3.909 1.00 22.50 C ATOM 1263 CD2 TYR A 79 -12.673 3.624 5.498 1.00 45.24 C ATOM 1264 CE1 TYR A 79 -14.518 1.799 4.564 1.00 74.31 C ATOM 1265 CE2 TYR A 79 -13.874 3.462 6.159 1.00 32.41 C ATOM 1266 CZ TYR A 79 -14.794 2.549 5.688 1.00 22.22 C ATOM 1267 OH TYR A 79 -15.993 2.383 6.344 1.00 11.44 O ATOM 0 H TYR A 79 -9.065 4.301 2.692 1.00 41.40 H new ATOM 0 HA TYR A 79 -11.682 3.557 1.648 1.00 2.41 H new ATOM 0 HB2 TYR A 79 -10.709 2.093 3.284 1.00 70.25 H new ATOM 0 HB3 TYR A 79 -10.310 3.425 4.350 1.00 70.25 H new ATOM 0 HD1 TYR A 79 -13.102 1.379 3.029 1.00 22.50 H new ATOM 0 HD2 TYR A 79 -11.955 4.340 5.870 1.00 45.24 H new ATOM 0 HE1 TYR A 79 -15.239 1.083 4.198 1.00 74.31 H new ATOM 0 HE2 TYR A 79 -14.092 4.047 7.040 1.00 32.41 H new ATOM 0 HH TYR A 79 -16.030 2.986 7.116 1.00 11.44 H new ATOM 1277 N LYS A 80 -13.190 5.186 3.013 1.00 0.31 N ATOM 1278 CA LYS A 80 -14.018 6.321 3.406 1.00 24.23 C ATOM 1279 C LYS A 80 -14.687 6.064 4.752 1.00 21.14 C ATOM 1280 O LYS A 80 -15.582 5.226 4.862 1.00 63.31 O ATOM 1281 CB LYS A 80 -15.080 6.597 2.340 1.00 2.11 C ATOM 1282 CG LYS A 80 -15.989 7.767 2.676 1.00 45.22 C ATOM 1283 CD LYS A 80 -16.958 8.062 1.544 1.00 54.23 C ATOM 1284 CE LYS A 80 -18.241 7.257 1.684 1.00 23.33 C ATOM 1285 NZ LYS A 80 -19.446 8.076 1.382 1.00 75.05 N ATOM 0 H LYS A 80 -13.707 4.320 2.859 1.00 0.31 H new ATOM 0 HA LYS A 80 -13.373 7.195 3.501 1.00 24.23 H new ATOM 0 HB2 LYS A 80 -14.585 6.793 1.389 1.00 2.11 H new ATOM 0 HB3 LYS A 80 -15.688 5.703 2.205 1.00 2.11 H new ATOM 0 HG2 LYS A 80 -16.547 7.546 3.586 1.00 45.22 H new ATOM 0 HG3 LYS A 80 -15.385 8.651 2.879 1.00 45.22 H new ATOM 0 HD2 LYS A 80 -17.194 9.126 1.534 1.00 54.23 H new ATOM 0 HD3 LYS A 80 -16.485 7.831 0.589 1.00 54.23 H new ATOM 0 HE2 LYS A 80 -18.207 6.400 1.012 1.00 23.33 H new ATOM 0 HE3 LYS A 80 -18.314 6.864 2.698 1.00 23.33 H new ATOM 0 HZ1 LYS A 80 -20.299 7.491 1.489 1.00 75.05 H new ATOM 0 HZ2 LYS A 80 -19.493 8.880 2.040 1.00 75.05 H new ATOM 0 HZ3 LYS A 80 -19.389 8.430 0.406 1.00 75.05 H new ATOM 1299 N TYR A 81 -14.249 6.792 5.773 1.00 12.15 N ATOM 1300 CA TYR A 81 -14.806 6.643 7.114 1.00 53.04 C ATOM 1301 C TYR A 81 -15.707 7.823 7.464 1.00 12.32 C ATOM 1302 O TYR A 81 -15.323 8.982 7.305 1.00 43.25 O ATOM 1303 CB TYR A 81 -13.683 6.520 8.144 1.00 74.22 C ATOM 1304 CG TYR A 81 -13.981 5.532 9.249 1.00 21.04 C ATOM 1305 CD1 TYR A 81 -15.120 5.661 10.035 1.00 12.44 C ATOM 1306 CD2 TYR A 81 -13.124 4.471 9.510 1.00 64.33 C ATOM 1307 CE1 TYR A 81 -15.396 4.763 11.046 1.00 35.24 C ATOM 1308 CE2 TYR A 81 -13.393 3.566 10.518 1.00 25.35 C ATOM 1309 CZ TYR A 81 -14.530 3.716 11.284 1.00 61.32 C ATOM 1310 OH TYR A 81 -14.801 2.817 12.290 1.00 45.11 O ATOM 0 H TYR A 81 -13.510 7.491 5.699 1.00 12.15 H new ATOM 0 HA TYR A 81 -15.407 5.734 7.132 1.00 53.04 H new ATOM 0 HB2 TYR A 81 -12.767 6.219 7.636 1.00 74.22 H new ATOM 0 HB3 TYR A 81 -13.496 7.499 8.584 1.00 74.22 H new ATOM 0 HD1 TYR A 81 -15.801 6.479 9.851 1.00 12.44 H new ATOM 0 HD2 TYR A 81 -12.231 4.351 8.914 1.00 64.33 H new ATOM 0 HE1 TYR A 81 -16.285 4.879 11.648 1.00 35.24 H new ATOM 0 HE2 TYR A 81 -12.717 2.745 10.705 1.00 25.35 H new ATOM 0 HH TYR A 81 -14.092 2.141 12.324 1.00 45.11 H new ATOM 1320 N VAL A 82 -16.909 7.520 7.944 1.00 72.44 N ATOM 1321 CA VAL A 82 -17.865 8.554 8.319 1.00 53.40 C ATOM 1322 C VAL A 82 -17.745 8.903 9.798 1.00 43.43 C ATOM 1323 O VAL A 82 -17.154 8.155 10.578 1.00 70.34 O ATOM 1324 CB VAL A 82 -19.312 8.116 8.022 1.00 70.11 C ATOM 1325 CG1 VAL A 82 -20.278 9.266 8.262 1.00 71.32 C ATOM 1326 CG2 VAL A 82 -19.429 7.598 6.597 1.00 74.31 C ATOM 0 H VAL A 82 -17.243 6.566 8.082 1.00 72.44 H new ATOM 0 HA VAL A 82 -17.630 9.434 7.720 1.00 53.40 H new ATOM 0 HB VAL A 82 -19.575 7.305 8.701 1.00 70.11 H new ATOM 0 HG11 VAL A 82 -21.295 8.938 8.047 1.00 71.32 H new ATOM 0 HG12 VAL A 82 -20.212 9.586 9.302 1.00 71.32 H new ATOM 0 HG13 VAL A 82 -20.020 10.100 7.609 1.00 71.32 H new ATOM 0 HG21 VAL A 82 -20.457 7.293 6.404 1.00 74.31 H new ATOM 0 HG22 VAL A 82 -19.147 8.386 5.899 1.00 74.31 H new ATOM 0 HG23 VAL A 82 -18.766 6.743 6.465 1.00 74.31 H new ATOM 1336 N HIS A 83 -18.310 10.045 10.179 1.00 71.21 N ATOM 1337 CA HIS A 83 -18.267 10.492 11.566 1.00 2.42 C ATOM 1338 C HIS A 83 -19.600 10.236 12.262 1.00 12.01 C ATOM 1339 O HIS A 83 -19.845 9.143 12.772 1.00 22.42 O ATOM 1340 CB HIS A 83 -17.922 11.981 11.633 1.00 22.12 C ATOM 1341 CG HIS A 83 -16.497 12.281 11.284 1.00 3.44 C ATOM 1342 ND1 HIS A 83 -15.584 12.760 12.200 1.00 45.32 N ATOM 1343 CD2 HIS A 83 -15.829 12.168 10.113 1.00 32.12 C ATOM 1344 CE1 HIS A 83 -14.415 12.929 11.606 1.00 54.45 C ATOM 1345 NE2 HIS A 83 -14.538 12.576 10.339 1.00 44.43 N ATOM 0 H HIS A 83 -18.802 10.676 9.547 1.00 71.21 H new ATOM 0 HA HIS A 83 -17.493 9.923 12.081 1.00 2.42 H new ATOM 0 HB2 HIS A 83 -18.577 12.528 10.955 1.00 22.12 H new ATOM 0 HB3 HIS A 83 -18.126 12.348 12.639 1.00 22.12 H new ATOM 0 HD2 HIS A 83 -16.236 11.821 9.175 1.00 32.12 H new ATOM 0 HE1 HIS A 83 -13.514 13.293 12.076 1.00 54.45 H new ATOM 0 HE2 HIS A 83 -13.794 12.602 9.642 1.00 44.43 H new ATOM 1354 N ASP A 84 -20.459 11.250 12.279 1.00 44.25 N ATOM 1355 CA ASP A 84 -21.767 11.133 12.911 1.00 12.31 C ATOM 1356 C ASP A 84 -22.578 12.412 12.720 1.00 74.13 C ATOM 1357 O ASP A 84 -23.717 12.372 12.254 1.00 51.25 O ATOM 1358 CB ASP A 84 -21.611 10.832 14.403 1.00 72.03 C ATOM 1359 CG ASP A 84 -22.776 10.035 14.957 1.00 71.02 C ATOM 1360 OD1 ASP A 84 -23.368 9.242 14.195 1.00 63.32 O ATOM 1361 OD2 ASP A 84 -23.097 10.205 16.151 1.00 22.14 O ATOM 0 H ASP A 84 -20.272 12.162 11.862 1.00 44.25 H new ATOM 0 HA ASP A 84 -22.301 10.310 12.436 1.00 12.31 H new ATOM 0 HB2 ASP A 84 -20.686 10.278 14.564 1.00 72.03 H new ATOM 0 HB3 ASP A 84 -21.521 11.769 14.952 1.00 72.03 H new ATOM 1366 N ASP A 85 -21.985 13.542 13.085 1.00 43.42 N ATOM 1367 CA ASP A 85 -22.652 14.833 12.953 1.00 35.10 C ATOM 1368 C ASP A 85 -23.022 15.108 11.499 1.00 25.24 C ATOM 1369 O ASP A 85 -23.866 15.957 11.212 1.00 61.42 O ATOM 1370 CB ASP A 85 -21.756 15.951 13.485 1.00 3.10 C ATOM 1371 CG ASP A 85 -20.858 16.535 12.411 1.00 22.34 C ATOM 1372 OD1 ASP A 85 -19.838 15.896 12.080 1.00 21.14 O ATOM 1373 OD2 ASP A 85 -21.177 17.630 11.902 1.00 25.01 O ATOM 0 H ASP A 85 -21.044 13.591 13.475 1.00 43.42 H new ATOM 0 HA ASP A 85 -23.569 14.802 13.542 1.00 35.10 H new ATOM 0 HB2 ASP A 85 -22.378 16.742 13.904 1.00 3.10 H new ATOM 0 HB3 ASP A 85 -21.141 15.564 14.298 1.00 3.10 H new ATOM 1378 N GLY A 86 -22.382 14.386 10.584 1.00 23.31 N ATOM 1379 CA GLY A 86 -22.656 14.568 9.171 1.00 44.54 C ATOM 1380 C GLY A 86 -21.393 14.769 8.356 1.00 3.12 C ATOM 1381 O GLY A 86 -21.447 15.242 7.222 1.00 52.31 O ATOM 0 H GLY A 86 -21.679 13.678 10.796 1.00 23.31 H new ATOM 0 HA2 GLY A 86 -23.194 13.698 8.793 1.00 44.54 H new ATOM 0 HA3 GLY A 86 -23.311 15.429 9.039 1.00 44.54 H new ATOM 1385 N ARG A 87 -20.253 14.409 8.937 1.00 0.02 N ATOM 1386 CA ARG A 87 -18.970 14.556 8.260 1.00 72.52 C ATOM 1387 C ARG A 87 -18.366 13.191 7.941 1.00 50.34 C ATOM 1388 O ARG A 87 -18.477 12.252 8.728 1.00 2.01 O ATOM 1389 CB ARG A 87 -18.002 15.365 9.123 1.00 42.11 C ATOM 1390 CG ARG A 87 -18.378 16.834 9.246 1.00 30.41 C ATOM 1391 CD ARG A 87 -18.092 17.591 7.959 1.00 0.54 C ATOM 1392 NE ARG A 87 -18.628 18.949 7.994 1.00 45.12 N ATOM 1393 CZ ARG A 87 -18.632 19.764 6.945 1.00 71.04 C ATOM 1394 NH1 ARG A 87 -18.132 19.360 5.785 1.00 53.12 N ATOM 1395 NH2 ARG A 87 -19.137 20.987 7.054 1.00 30.44 N ATOM 0 H ARG A 87 -20.192 14.013 9.875 1.00 0.02 H new ATOM 0 HA ARG A 87 -19.140 15.088 7.324 1.00 72.52 H new ATOM 0 HB2 ARG A 87 -17.961 14.924 10.119 1.00 42.11 H new ATOM 0 HB3 ARG A 87 -17.000 15.289 8.700 1.00 42.11 H new ATOM 0 HG2 ARG A 87 -19.436 16.921 9.493 1.00 30.41 H new ATOM 0 HG3 ARG A 87 -17.821 17.286 10.067 1.00 30.41 H new ATOM 0 HD2 ARG A 87 -17.015 17.630 7.793 1.00 0.54 H new ATOM 0 HD3 ARG A 87 -18.525 17.052 7.117 1.00 0.54 H new ATOM 0 HE ARG A 87 -19.021 19.290 8.871 1.00 45.12 H new ATOM 0 HH11 ARG A 87 -17.743 18.421 5.697 1.00 53.12 H new ATOM 0 HH12 ARG A 87 -18.136 19.988 4.981 1.00 53.12 H new ATOM 0 HH21 ARG A 87 -19.523 21.302 7.944 1.00 30.44 H new ATOM 0 HH22 ARG A 87 -19.139 21.612 6.248 1.00 30.44 H new ATOM 1409 N VAL A 88 -17.726 13.090 6.779 1.00 5.05 N ATOM 1410 CA VAL A 88 -17.103 11.842 6.357 1.00 21.13 C ATOM 1411 C VAL A 88 -15.769 12.100 5.664 1.00 23.52 C ATOM 1412 O VAL A 88 -15.700 12.845 4.688 1.00 44.44 O ATOM 1413 CB VAL A 88 -18.019 11.052 5.404 1.00 74.42 C ATOM 1414 CG1 VAL A 88 -18.582 11.964 4.326 1.00 41.43 C ATOM 1415 CG2 VAL A 88 -17.265 9.885 4.785 1.00 63.32 C ATOM 0 H VAL A 88 -17.626 13.857 6.115 1.00 5.05 H new ATOM 0 HA VAL A 88 -16.933 11.253 7.258 1.00 21.13 H new ATOM 0 HB VAL A 88 -18.853 10.652 5.980 1.00 74.42 H new ATOM 0 HG11 VAL A 88 -19.227 11.388 3.662 1.00 41.43 H new ATOM 0 HG12 VAL A 88 -19.160 12.763 4.791 1.00 41.43 H new ATOM 0 HG13 VAL A 88 -17.763 12.396 3.751 1.00 41.43 H new ATOM 0 HG21 VAL A 88 -17.928 9.338 4.115 1.00 63.32 H new ATOM 0 HG22 VAL A 88 -16.410 10.261 4.223 1.00 63.32 H new ATOM 0 HG23 VAL A 88 -16.916 9.218 5.573 1.00 63.32 H new ATOM 1425 N SER A 89 -14.712 11.478 6.176 1.00 31.14 N ATOM 1426 CA SER A 89 -13.379 11.643 5.610 1.00 50.12 C ATOM 1427 C SER A 89 -12.843 10.314 5.086 1.00 24.11 C ATOM 1428 O SER A 89 -13.373 9.250 5.405 1.00 52.14 O ATOM 1429 CB SER A 89 -12.422 12.214 6.659 1.00 50.14 C ATOM 1430 OG SER A 89 -12.830 13.509 7.069 1.00 23.41 O ATOM 0 H SER A 89 -14.753 10.855 6.982 1.00 31.14 H new ATOM 0 HA SER A 89 -13.450 12.341 4.776 1.00 50.12 H new ATOM 0 HB2 SER A 89 -12.386 11.550 7.523 1.00 50.14 H new ATOM 0 HB3 SER A 89 -11.413 12.260 6.249 1.00 50.14 H new ATOM 0 HG SER A 89 -12.204 13.852 7.741 1.00 23.41 H new ATOM 1436 N TYR A 90 -11.788 10.384 4.282 1.00 2.54 N ATOM 1437 CA TYR A 90 -11.181 9.188 3.712 1.00 42.22 C ATOM 1438 C TYR A 90 -9.783 8.963 4.282 1.00 72.55 C ATOM 1439 O TYR A 90 -8.793 9.516 3.805 1.00 22.03 O ATOM 1440 CB TYR A 90 -11.108 9.305 2.188 1.00 34.34 C ATOM 1441 CG TYR A 90 -12.217 10.143 1.591 1.00 21.24 C ATOM 1442 CD1 TYR A 90 -13.497 9.626 1.435 1.00 54.03 C ATOM 1443 CD2 TYR A 90 -11.983 11.450 1.185 1.00 74.23 C ATOM 1444 CE1 TYR A 90 -14.513 10.388 0.890 1.00 42.30 C ATOM 1445 CE2 TYR A 90 -12.993 12.220 0.640 1.00 71.22 C ATOM 1446 CZ TYR A 90 -14.256 11.684 0.494 1.00 21.42 C ATOM 1447 OH TYR A 90 -15.264 12.447 -0.049 1.00 31.13 O ATOM 0 H TYR A 90 -11.336 11.257 4.010 1.00 2.54 H new ATOM 0 HA TYR A 90 -11.804 8.334 3.976 1.00 42.22 H new ATOM 0 HB2 TYR A 90 -10.147 9.738 1.911 1.00 34.34 H new ATOM 0 HB3 TYR A 90 -11.144 8.306 1.753 1.00 34.34 H new ATOM 0 HD1 TYR A 90 -13.701 8.612 1.745 1.00 54.03 H new ATOM 0 HD2 TYR A 90 -10.995 11.872 1.297 1.00 74.23 H new ATOM 0 HE1 TYR A 90 -15.503 9.971 0.775 1.00 42.30 H new ATOM 0 HE2 TYR A 90 -12.795 13.235 0.330 1.00 71.22 H new ATOM 0 HH TYR A 90 -14.917 13.336 -0.274 1.00 31.13 H new ATOM 1457 N PRO A 91 -9.701 8.127 5.328 1.00 11.31 N ATOM 1458 CA PRO A 91 -8.432 7.805 5.987 1.00 3.40 C ATOM 1459 C PRO A 91 -7.523 6.952 5.108 1.00 22.42 C ATOM 1460 O PRO A 91 -7.673 5.731 5.044 1.00 42.54 O ATOM 1461 CB PRO A 91 -8.864 7.022 7.229 1.00 53.53 C ATOM 1462 CG PRO A 91 -10.185 6.438 6.867 1.00 70.43 C ATOM 1463 CD PRO A 91 -10.841 7.431 5.949 1.00 42.35 C ATOM 0 HA PRO A 91 -7.852 8.700 6.212 1.00 3.40 H new ATOM 0 HB2 PRO A 91 -8.142 6.244 7.478 1.00 53.53 H new ATOM 0 HB3 PRO A 91 -8.944 7.673 8.100 1.00 53.53 H new ATOM 0 HG2 PRO A 91 -10.063 5.473 6.375 1.00 70.43 H new ATOM 0 HG3 PRO A 91 -10.793 6.268 7.756 1.00 70.43 H new ATOM 0 HD2 PRO A 91 -11.465 6.938 5.204 1.00 42.35 H new ATOM 0 HD3 PRO A 91 -11.483 8.121 6.496 1.00 42.35 H new ATOM 1471 N LEU A 92 -6.579 7.601 4.435 1.00 33.31 N ATOM 1472 CA LEU A 92 -5.645 6.900 3.560 1.00 40.24 C ATOM 1473 C LEU A 92 -4.634 6.099 4.374 1.00 44.21 C ATOM 1474 O LEU A 92 -4.100 6.586 5.372 1.00 61.54 O ATOM 1475 CB LEU A 92 -4.916 7.898 2.658 1.00 21.00 C ATOM 1476 CG LEU A 92 -5.307 7.876 1.180 1.00 62.11 C ATOM 1477 CD1 LEU A 92 -5.974 9.185 0.785 1.00 61.44 C ATOM 1478 CD2 LEU A 92 -4.087 7.614 0.309 1.00 64.42 C ATOM 0 H LEU A 92 -6.440 8.611 4.478 1.00 33.31 H new ATOM 0 HA LEU A 92 -6.214 6.207 2.940 1.00 40.24 H new ATOM 0 HB2 LEU A 92 -5.091 8.902 3.045 1.00 21.00 H new ATOM 0 HB3 LEU A 92 -3.845 7.710 2.733 1.00 21.00 H new ATOM 0 HG LEU A 92 -6.020 7.066 1.025 1.00 62.11 H new ATOM 0 HD11 LEU A 92 -6.245 9.151 -0.270 1.00 61.44 H new ATOM 0 HD12 LEU A 92 -6.871 9.332 1.386 1.00 61.44 H new ATOM 0 HD13 LEU A 92 -5.284 10.011 0.956 1.00 61.44 H new ATOM 0 HD21 LEU A 92 -4.384 7.602 -0.740 1.00 64.42 H new ATOM 0 HD22 LEU A 92 -3.350 8.402 0.468 1.00 64.42 H new ATOM 0 HD23 LEU A 92 -3.651 6.651 0.574 1.00 64.42 H new ATOM 1490 N CYS A 93 -4.374 4.871 3.940 1.00 73.30 N ATOM 1491 CA CYS A 93 -3.426 4.002 4.627 1.00 1.01 C ATOM 1492 C CYS A 93 -2.481 3.335 3.634 1.00 64.51 C ATOM 1493 O CYS A 93 -2.681 3.412 2.422 1.00 52.42 O ATOM 1494 CB CYS A 93 -4.170 2.938 5.436 1.00 61.14 C ATOM 1495 SG CYS A 93 -5.155 3.601 6.798 1.00 31.01 S ATOM 0 H CYS A 93 -4.807 4.455 3.115 1.00 73.30 H new ATOM 0 HA CYS A 93 -2.835 4.616 5.306 1.00 1.01 H new ATOM 0 HB2 CYS A 93 -4.825 2.380 4.767 1.00 61.14 H new ATOM 0 HB3 CYS A 93 -3.445 2.229 5.837 1.00 61.14 H new ATOM 0 HG CYS A 93 -6.288 4.043 6.339 1.00 31.01 H new ATOM 1501 N PHE A 94 -1.449 2.680 4.155 1.00 42.14 N ATOM 1502 CA PHE A 94 -0.471 2.001 3.313 1.00 65.22 C ATOM 1503 C PHE A 94 -0.542 0.489 3.507 1.00 61.34 C ATOM 1504 O PHE A 94 -0.062 -0.042 4.509 1.00 10.14 O ATOM 1505 CB PHE A 94 0.941 2.500 3.629 1.00 10.55 C ATOM 1506 CG PHE A 94 1.987 1.980 2.686 1.00 41.32 C ATOM 1507 CD1 PHE A 94 2.112 2.506 1.410 1.00 10.23 C ATOM 1508 CD2 PHE A 94 2.845 0.964 3.074 1.00 53.10 C ATOM 1509 CE1 PHE A 94 3.074 2.030 0.539 1.00 12.44 C ATOM 1510 CE2 PHE A 94 3.809 0.483 2.208 1.00 54.54 C ATOM 1511 CZ PHE A 94 3.923 1.016 0.938 1.00 1.43 C ATOM 0 H PHE A 94 -1.268 2.605 5.156 1.00 42.14 H new ATOM 0 HA PHE A 94 -0.705 2.228 2.273 1.00 65.22 H new ATOM 0 HB2 PHE A 94 0.947 3.590 3.600 1.00 10.55 H new ATOM 0 HB3 PHE A 94 1.202 2.206 4.646 1.00 10.55 H new ATOM 0 HD1 PHE A 94 1.450 3.298 1.092 1.00 10.23 H new ATOM 0 HD2 PHE A 94 2.760 0.543 4.065 1.00 53.10 H new ATOM 0 HE1 PHE A 94 3.162 2.450 -0.452 1.00 12.44 H new ATOM 0 HE2 PHE A 94 4.472 -0.309 2.524 1.00 54.54 H new ATOM 0 HZ PHE A 94 4.674 0.641 0.259 1.00 1.43 H new ATOM 1521 N ILE A 95 -1.144 -0.197 2.542 1.00 73.42 N ATOM 1522 CA ILE A 95 -1.279 -1.648 2.606 1.00 41.22 C ATOM 1523 C ILE A 95 -0.131 -2.338 1.877 1.00 71.54 C ATOM 1524 O ILE A 95 0.072 -2.132 0.680 1.00 33.13 O ATOM 1525 CB ILE A 95 -2.614 -2.117 2.000 1.00 62.14 C ATOM 1526 CG1 ILE A 95 -3.789 -1.539 2.791 1.00 31.33 C ATOM 1527 CG2 ILE A 95 -2.680 -3.636 1.977 1.00 70.01 C ATOM 1528 CD1 ILE A 95 -5.137 -1.827 2.167 1.00 34.04 C ATOM 0 H ILE A 95 -1.546 0.228 1.706 1.00 73.42 H new ATOM 0 HA ILE A 95 -1.254 -1.922 3.661 1.00 41.22 H new ATOM 0 HB ILE A 95 -2.678 -1.755 0.974 1.00 62.14 H new ATOM 0 HG12 ILE A 95 -3.771 -1.946 3.802 1.00 31.33 H new ATOM 0 HG13 ILE A 95 -3.661 -0.460 2.879 1.00 31.33 H new ATOM 0 HG21 ILE A 95 -3.630 -3.952 1.546 1.00 70.01 H new ATOM 0 HG22 ILE A 95 -1.860 -4.027 1.375 1.00 70.01 H new ATOM 0 HG23 ILE A 95 -2.598 -4.019 2.994 1.00 70.01 H new ATOM 0 HD11 ILE A 95 -5.923 -1.388 2.781 1.00 34.04 H new ATOM 0 HD12 ILE A 95 -5.174 -1.396 1.166 1.00 34.04 H new ATOM 0 HD13 ILE A 95 -5.286 -2.905 2.104 1.00 34.04 H new ATOM 1540 N PHE A 96 0.615 -3.161 2.605 1.00 22.34 N ATOM 1541 CA PHE A 96 1.743 -3.885 2.028 1.00 13.50 C ATOM 1542 C PHE A 96 1.379 -5.344 1.774 1.00 62.44 C ATOM 1543 O PHE A 96 1.252 -6.135 2.709 1.00 73.34 O ATOM 1544 CB PHE A 96 2.958 -3.803 2.955 1.00 54.01 C ATOM 1545 CG PHE A 96 4.177 -4.484 2.406 1.00 24.23 C ATOM 1546 CD1 PHE A 96 4.187 -4.979 1.111 1.00 23.11 C ATOM 1547 CD2 PHE A 96 5.314 -4.632 3.184 1.00 21.10 C ATOM 1548 CE1 PHE A 96 5.309 -5.607 0.602 1.00 10.30 C ATOM 1549 CE2 PHE A 96 6.439 -5.257 2.680 1.00 34.54 C ATOM 1550 CZ PHE A 96 6.436 -5.746 1.389 1.00 62.43 C ATOM 0 H PHE A 96 0.459 -3.344 3.596 1.00 22.34 H new ATOM 0 HA PHE A 96 1.992 -3.420 1.074 1.00 13.50 H new ATOM 0 HB2 PHE A 96 3.191 -2.755 3.144 1.00 54.01 H new ATOM 0 HB3 PHE A 96 2.703 -4.251 3.916 1.00 54.01 H new ATOM 0 HD1 PHE A 96 3.308 -4.873 0.492 1.00 23.11 H new ATOM 0 HD2 PHE A 96 5.321 -4.255 4.196 1.00 21.10 H new ATOM 0 HE1 PHE A 96 5.304 -5.988 -0.409 1.00 10.30 H new ATOM 0 HE2 PHE A 96 7.320 -5.363 3.296 1.00 34.54 H new ATOM 0 HZ PHE A 96 7.314 -6.237 0.995 1.00 62.43 H new ATOM 1560 N SER A 97 1.213 -5.694 0.502 1.00 24.12 N ATOM 1561 CA SER A 97 0.860 -7.057 0.124 1.00 21.12 C ATOM 1562 C SER A 97 2.084 -7.967 0.168 1.00 61.24 C ATOM 1563 O SER A 97 2.818 -8.085 -0.812 1.00 62.13 O ATOM 1564 CB SER A 97 0.245 -7.078 -1.277 1.00 3.35 C ATOM 1565 OG SER A 97 -0.484 -8.273 -1.495 1.00 53.24 O ATOM 0 H SER A 97 1.317 -5.052 -0.284 1.00 24.12 H new ATOM 0 HA SER A 97 0.127 -7.428 0.840 1.00 21.12 H new ATOM 0 HB2 SER A 97 -0.414 -6.218 -1.402 1.00 3.35 H new ATOM 0 HB3 SER A 97 1.033 -6.987 -2.025 1.00 3.35 H new ATOM 0 HG SER A 97 0.118 -9.042 -1.419 1.00 53.24 H new ATOM 1571 N SER A 98 2.296 -8.609 1.312 1.00 3.13 N ATOM 1572 CA SER A 98 3.433 -9.506 1.487 1.00 40.21 C ATOM 1573 C SER A 98 2.968 -10.898 1.901 1.00 50.23 C ATOM 1574 O SER A 98 2.764 -11.187 3.080 1.00 32.22 O ATOM 1575 CB SER A 98 4.396 -8.945 2.534 1.00 2.15 C ATOM 1576 OG SER A 98 5.685 -9.519 2.402 1.00 1.22 O ATOM 0 H SER A 98 1.695 -8.525 2.132 1.00 3.13 H new ATOM 0 HA SER A 98 3.952 -9.585 0.532 1.00 40.21 H new ATOM 0 HB2 SER A 98 4.464 -7.862 2.427 1.00 2.15 H new ATOM 0 HB3 SER A 98 4.007 -9.143 3.533 1.00 2.15 H new ATOM 0 HG SER A 98 6.364 -8.859 2.652 1.00 1.22 H new ATOM 1582 N PRO A 99 2.794 -11.783 0.908 1.00 1.13 N ATOM 1583 CA PRO A 99 2.352 -13.160 1.143 1.00 35.14 C ATOM 1584 C PRO A 99 3.417 -14.001 1.839 1.00 62.20 C ATOM 1585 O PRO A 99 4.395 -13.471 2.365 1.00 12.42 O ATOM 1586 CB PRO A 99 2.085 -13.693 -0.266 1.00 64.01 C ATOM 1587 CG PRO A 99 2.954 -12.870 -1.153 1.00 25.22 C ATOM 1588 CD PRO A 99 3.018 -11.507 -0.521 1.00 23.22 C ATOM 0 HA PRO A 99 1.484 -13.202 1.800 1.00 35.14 H new ATOM 0 HB2 PRO A 99 2.332 -14.752 -0.342 1.00 64.01 H new ATOM 0 HB3 PRO A 99 1.034 -13.590 -0.536 1.00 64.01 H new ATOM 0 HG2 PRO A 99 3.949 -13.307 -1.239 1.00 25.22 H new ATOM 0 HG3 PRO A 99 2.542 -12.814 -2.160 1.00 25.22 H new ATOM 0 HD2 PRO A 99 3.983 -11.030 -0.692 1.00 23.22 H new ATOM 0 HD3 PRO A 99 2.257 -10.840 -0.926 1.00 23.22 H new ATOM 1596 N VAL A 100 3.222 -15.316 1.836 1.00 72.24 N ATOM 1597 CA VAL A 100 4.167 -16.230 2.466 1.00 64.15 C ATOM 1598 C VAL A 100 4.856 -17.108 1.426 1.00 1.15 C ATOM 1599 O VAL A 100 5.866 -17.751 1.713 1.00 54.11 O ATOM 1600 CB VAL A 100 3.471 -17.132 3.502 1.00 13.33 C ATOM 1601 CG1 VAL A 100 2.700 -18.246 2.809 1.00 1.35 C ATOM 1602 CG2 VAL A 100 4.487 -17.702 4.479 1.00 71.33 C ATOM 0 H VAL A 100 2.418 -15.772 1.404 1.00 72.24 H new ATOM 0 HA VAL A 100 4.912 -15.616 2.973 1.00 64.15 H new ATOM 0 HB VAL A 100 2.760 -16.528 4.065 1.00 13.33 H new ATOM 0 HG11 VAL A 100 2.215 -18.873 3.557 1.00 1.35 H new ATOM 0 HG12 VAL A 100 1.944 -17.812 2.154 1.00 1.35 H new ATOM 0 HG13 VAL A 100 3.388 -18.852 2.219 1.00 1.35 H new ATOM 0 HG21 VAL A 100 3.978 -18.337 5.204 1.00 71.33 H new ATOM 0 HG22 VAL A 100 5.224 -18.292 3.934 1.00 71.33 H new ATOM 0 HG23 VAL A 100 4.988 -16.886 5.000 1.00 71.33 H new ATOM 1612 N GLY A 101 4.304 -17.130 0.217 1.00 44.01 N ATOM 1613 CA GLY A 101 4.880 -17.932 -0.847 1.00 51.30 C ATOM 1614 C GLY A 101 5.907 -17.167 -1.658 1.00 52.54 C ATOM 1615 O GLY A 101 6.529 -17.722 -2.566 1.00 1.54 O ATOM 0 H GLY A 101 3.468 -16.607 -0.045 1.00 44.01 H new ATOM 0 HA2 GLY A 101 5.347 -18.818 -0.418 1.00 51.30 H new ATOM 0 HA3 GLY A 101 4.085 -18.279 -1.507 1.00 51.30 H new ATOM 1619 N CYS A 102 6.082 -15.891 -1.336 1.00 0.52 N ATOM 1620 CA CYS A 102 7.039 -15.048 -2.044 1.00 3.33 C ATOM 1621 C CYS A 102 8.472 -15.446 -1.704 1.00 12.42 C ATOM 1622 O CYS A 102 8.713 -16.166 -0.734 1.00 44.53 O ATOM 1623 CB CYS A 102 6.810 -13.576 -1.695 1.00 1.14 C ATOM 1624 SG CYS A 102 6.596 -13.261 0.072 1.00 20.22 S ATOM 0 H CYS A 102 5.574 -15.417 -0.589 1.00 0.52 H new ATOM 0 HA CYS A 102 6.886 -15.189 -3.114 1.00 3.33 H new ATOM 0 HB2 CYS A 102 7.656 -12.992 -2.057 1.00 1.14 H new ATOM 0 HB3 CYS A 102 5.927 -13.221 -2.226 1.00 1.14 H new ATOM 0 HG CYS A 102 6.411 -11.989 0.267 1.00 20.22 H new ATOM 1630 N LYS A 103 9.418 -14.974 -2.507 1.00 64.21 N ATOM 1631 CA LYS A 103 10.828 -15.281 -2.293 1.00 30.22 C ATOM 1632 C LYS A 103 11.507 -14.180 -1.485 1.00 3.12 C ATOM 1633 O LYS A 103 11.095 -13.020 -1.502 1.00 65.04 O ATOM 1634 CB LYS A 103 11.542 -15.459 -3.634 1.00 55.52 C ATOM 1635 CG LYS A 103 10.671 -16.086 -4.709 1.00 71.22 C ATOM 1636 CD LYS A 103 10.420 -15.122 -5.856 1.00 62.21 C ATOM 1637 CE LYS A 103 11.682 -14.886 -6.673 1.00 73.21 C ATOM 1638 NZ LYS A 103 11.701 -15.709 -7.913 1.00 24.42 N ATOM 0 H LYS A 103 9.235 -14.377 -3.313 1.00 64.21 H new ATOM 0 HA LYS A 103 10.890 -16.212 -1.730 1.00 30.22 H new ATOM 0 HB2 LYS A 103 11.891 -14.487 -3.982 1.00 55.52 H new ATOM 0 HB3 LYS A 103 12.425 -16.080 -3.486 1.00 55.52 H new ATOM 0 HG2 LYS A 103 11.152 -16.987 -5.089 1.00 71.22 H new ATOM 0 HG3 LYS A 103 9.719 -16.392 -4.275 1.00 71.22 H new ATOM 0 HD2 LYS A 103 9.637 -15.519 -6.501 1.00 62.21 H new ATOM 0 HD3 LYS A 103 10.058 -14.173 -5.462 1.00 62.21 H new ATOM 0 HE2 LYS A 103 11.752 -13.831 -6.936 1.00 73.21 H new ATOM 0 HE3 LYS A 103 12.557 -15.122 -6.067 1.00 73.21 H new ATOM 0 HZ1 LYS A 103 12.576 -15.520 -8.442 1.00 24.42 H new ATOM 0 HZ2 LYS A 103 11.660 -16.717 -7.661 1.00 24.42 H new ATOM 0 HZ3 LYS A 103 10.880 -15.466 -8.504 1.00 24.42 H new ATOM 1652 N PRO A 104 12.574 -14.549 -0.760 1.00 54.12 N ATOM 1653 CA PRO A 104 13.333 -13.607 0.066 1.00 24.13 C ATOM 1654 C PRO A 104 14.125 -12.609 -0.772 1.00 5.43 C ATOM 1655 O PRO A 104 14.558 -11.571 -0.272 1.00 55.21 O ATOM 1656 CB PRO A 104 14.282 -14.513 0.857 1.00 50.15 C ATOM 1657 CG PRO A 104 14.437 -15.729 0.011 1.00 54.14 C ATOM 1658 CD PRO A 104 13.120 -15.915 -0.693 1.00 33.35 C ATOM 0 HA PRO A 104 12.681 -12.998 0.693 1.00 24.13 H new ATOM 0 HB2 PRO A 104 15.242 -14.026 1.030 1.00 50.15 H new ATOM 0 HB3 PRO A 104 13.869 -14.761 1.835 1.00 50.15 H new ATOM 0 HG2 PRO A 104 15.249 -15.605 -0.706 1.00 54.14 H new ATOM 0 HG3 PRO A 104 14.680 -16.600 0.620 1.00 54.14 H new ATOM 0 HD2 PRO A 104 13.252 -16.344 -1.686 1.00 33.35 H new ATOM 0 HD3 PRO A 104 12.460 -16.585 -0.141 1.00 33.35 H new ATOM 1666 N GLU A 105 14.312 -12.931 -2.049 1.00 34.13 N ATOM 1667 CA GLU A 105 15.053 -12.061 -2.954 1.00 61.35 C ATOM 1668 C GLU A 105 14.240 -10.818 -3.301 1.00 11.43 C ATOM 1669 O GLU A 105 14.788 -9.724 -3.435 1.00 41.45 O ATOM 1670 CB GLU A 105 15.420 -12.816 -4.234 1.00 70.25 C ATOM 1671 CG GLU A 105 16.549 -13.815 -4.049 1.00 5.20 C ATOM 1672 CD GLU A 105 17.782 -13.459 -4.857 1.00 32.14 C ATOM 1673 OE1 GLU A 105 18.477 -12.490 -4.484 1.00 52.31 O ATOM 1674 OE2 GLU A 105 18.053 -14.149 -5.862 1.00 74.40 O ATOM 0 H GLU A 105 13.961 -13.787 -2.479 1.00 34.13 H new ATOM 0 HA GLU A 105 15.967 -11.747 -2.449 1.00 61.35 H new ATOM 0 HB2 GLU A 105 14.538 -13.341 -4.602 1.00 70.25 H new ATOM 0 HB3 GLU A 105 15.705 -12.096 -5.001 1.00 70.25 H new ATOM 0 HG2 GLU A 105 16.814 -13.867 -2.993 1.00 5.20 H new ATOM 0 HG3 GLU A 105 16.203 -14.807 -4.340 1.00 5.20 H new ATOM 1681 N GLN A 106 12.930 -10.994 -3.442 1.00 42.50 N ATOM 1682 CA GLN A 106 12.042 -9.885 -3.773 1.00 74.32 C ATOM 1683 C GLN A 106 11.548 -9.188 -2.511 1.00 73.10 C ATOM 1684 O GLN A 106 11.749 -7.987 -2.336 1.00 41.51 O ATOM 1685 CB GLN A 106 10.852 -10.386 -4.593 1.00 74.13 C ATOM 1686 CG GLN A 106 11.218 -11.455 -5.610 1.00 4.21 C ATOM 1687 CD GLN A 106 12.060 -10.912 -6.749 1.00 72.41 C ATOM 1688 OE1 GLN A 106 13.209 -11.313 -6.933 1.00 23.23 O ATOM 1689 NE2 GLN A 106 11.489 -9.995 -7.520 1.00 44.33 N ATOM 0 H GLN A 106 12.460 -11.893 -3.332 1.00 42.50 H new ATOM 0 HA GLN A 106 12.606 -9.165 -4.366 1.00 74.32 H new ATOM 0 HB2 GLN A 106 10.097 -10.785 -3.915 1.00 74.13 H new ATOM 0 HB3 GLN A 106 10.399 -9.542 -5.113 1.00 74.13 H new ATOM 0 HG2 GLN A 106 11.763 -12.256 -5.110 1.00 4.21 H new ATOM 0 HG3 GLN A 106 10.306 -11.894 -6.014 1.00 4.21 H new ATOM 0 HE21 GLN A 106 10.534 -9.692 -7.330 1.00 44.33 H new ATOM 0 HE22 GLN A 106 12.006 -9.593 -8.302 1.00 44.33 H new ATOM 1698 N GLN A 107 10.900 -9.949 -1.635 1.00 4.01 N ATOM 1699 CA GLN A 107 10.377 -9.402 -0.388 1.00 74.33 C ATOM 1700 C GLN A 107 11.359 -8.412 0.227 1.00 3.15 C ATOM 1701 O GLN A 107 10.957 -7.421 0.835 1.00 45.53 O ATOM 1702 CB GLN A 107 10.082 -10.529 0.603 1.00 21.40 C ATOM 1703 CG GLN A 107 8.660 -10.510 1.140 1.00 24.32 C ATOM 1704 CD GLN A 107 8.590 -10.081 2.593 1.00 52.21 C ATOM 1705 OE1 GLN A 107 8.245 -8.819 2.821 1.00 73.22 O flip ATOM 1706 NE2 GLN A 107 8.844 -10.874 3.500 1.00 23.25 N flip ATOM 0 H GLN A 107 10.725 -10.945 -1.765 1.00 4.01 H new ATOM 0 HA GLN A 107 9.451 -8.873 -0.613 1.00 74.33 H new ATOM 0 HB2 GLN A 107 10.265 -11.487 0.116 1.00 21.40 H new ATOM 0 HB3 GLN A 107 10.778 -10.458 1.439 1.00 21.40 H new ATOM 0 HG2 GLN A 107 8.057 -9.833 0.536 1.00 24.32 H new ATOM 0 HG3 GLN A 107 8.224 -11.503 1.037 1.00 24.32 H new ATOM 0 HE21 GLN A 107 9.105 -11.835 3.279 1.00 23.25 H new ATOM 0 HE22 GLN A 107 8.793 -10.570 4.472 1.00 23.25 H new ATOM 1715 N MET A 108 12.650 -8.687 0.065 1.00 32.24 N ATOM 1716 CA MET A 108 13.690 -7.820 0.604 1.00 15.55 C ATOM 1717 C MET A 108 13.686 -6.465 -0.098 1.00 33.42 C ATOM 1718 O MET A 108 13.859 -5.426 0.538 1.00 21.21 O ATOM 1719 CB MET A 108 15.062 -8.480 0.456 1.00 2.34 C ATOM 1720 CG MET A 108 15.524 -9.209 1.707 1.00 34.34 C ATOM 1721 SD MET A 108 17.311 -9.139 1.932 1.00 22.34 S ATOM 1722 CE MET A 108 17.877 -9.592 0.295 1.00 55.20 C ATOM 0 H MET A 108 13.000 -9.504 -0.436 1.00 32.24 H new ATOM 0 HA MET A 108 13.484 -7.662 1.663 1.00 15.55 H new ATOM 0 HB2 MET A 108 15.029 -9.185 -0.374 1.00 2.34 H new ATOM 0 HB3 MET A 108 15.797 -7.718 0.197 1.00 2.34 H new ATOM 0 HG2 MET A 108 15.035 -8.773 2.578 1.00 34.34 H new ATOM 0 HG3 MET A 108 15.209 -10.251 1.653 1.00 34.34 H new ATOM 0 HE1 MET A 108 18.897 -9.971 0.355 1.00 55.20 H new ATOM 0 HE2 MET A 108 17.226 -10.365 -0.114 1.00 55.20 H new ATOM 0 HE3 MET A 108 17.852 -8.716 -0.354 1.00 55.20 H new ATOM 1732 N MET A 109 13.485 -6.485 -1.411 1.00 65.34 N ATOM 1733 CA MET A 109 13.458 -5.258 -2.199 1.00 3.44 C ATOM 1734 C MET A 109 12.427 -4.280 -1.644 1.00 40.02 C ATOM 1735 O MET A 109 12.637 -3.067 -1.659 1.00 45.24 O ATOM 1736 CB MET A 109 13.145 -5.573 -3.662 1.00 44.41 C ATOM 1737 CG MET A 109 14.295 -6.238 -4.401 1.00 22.31 C ATOM 1738 SD MET A 109 13.741 -7.231 -5.800 1.00 64.13 S ATOM 1739 CE MET A 109 13.506 -5.962 -7.043 1.00 33.23 C ATOM 0 H MET A 109 13.338 -7.337 -1.952 1.00 65.34 H new ATOM 0 HA MET A 109 14.442 -4.794 -2.139 1.00 3.44 H new ATOM 0 HB2 MET A 109 12.271 -6.223 -3.706 1.00 44.41 H new ATOM 0 HB3 MET A 109 12.880 -4.649 -4.175 1.00 44.41 H new ATOM 0 HG2 MET A 109 14.985 -5.472 -4.755 1.00 22.31 H new ATOM 0 HG3 MET A 109 14.849 -6.871 -3.708 1.00 22.31 H new ATOM 0 HE1 MET A 109 12.502 -6.042 -7.459 1.00 33.23 H new ATOM 0 HE2 MET A 109 13.633 -4.979 -6.588 1.00 33.23 H new ATOM 0 HE3 MET A 109 14.240 -6.091 -7.838 1.00 33.23 H new ATOM 1749 N TYR A 110 11.313 -4.815 -1.157 1.00 41.24 N ATOM 1750 CA TYR A 110 10.248 -3.988 -0.601 1.00 23.21 C ATOM 1751 C TYR A 110 10.466 -3.750 0.890 1.00 1.42 C ATOM 1752 O TYR A 110 10.273 -2.640 1.387 1.00 23.40 O ATOM 1753 CB TYR A 110 8.888 -4.650 -0.829 1.00 24.21 C ATOM 1754 CG TYR A 110 8.662 -5.092 -2.258 1.00 4.41 C ATOM 1755 CD1 TYR A 110 9.271 -6.236 -2.757 1.00 65.54 C ATOM 1756 CD2 TYR A 110 7.838 -4.365 -3.107 1.00 74.23 C ATOM 1757 CE1 TYR A 110 9.068 -6.643 -4.062 1.00 3.21 C ATOM 1758 CE2 TYR A 110 7.626 -4.765 -4.413 1.00 5.13 C ATOM 1759 CZ TYR A 110 8.244 -5.904 -4.886 1.00 3.41 C ATOM 1760 OH TYR A 110 8.038 -6.306 -6.185 1.00 61.14 O ATOM 0 H TYR A 110 11.124 -5.817 -1.136 1.00 41.24 H new ATOM 0 HA TYR A 110 10.266 -3.025 -1.111 1.00 23.21 H new ATOM 0 HB2 TYR A 110 8.799 -5.515 -0.172 1.00 24.21 H new ATOM 0 HB3 TYR A 110 8.101 -3.952 -0.545 1.00 24.21 H new ATOM 0 HD1 TYR A 110 9.915 -6.818 -2.114 1.00 65.54 H new ATOM 0 HD2 TYR A 110 7.354 -3.472 -2.741 1.00 74.23 H new ATOM 0 HE1 TYR A 110 9.551 -7.534 -4.435 1.00 3.21 H new ATOM 0 HE2 TYR A 110 6.980 -4.189 -5.059 1.00 5.13 H new ATOM 0 HH TYR A 110 7.209 -6.826 -6.239 1.00 61.14 H new ATOM 1770 N ALA A 111 10.870 -4.799 1.598 1.00 11.21 N ATOM 1771 CA ALA A 111 11.118 -4.704 3.031 1.00 14.13 C ATOM 1772 C ALA A 111 12.146 -3.621 3.340 1.00 33.32 C ATOM 1773 O ALA A 111 12.171 -3.072 4.440 1.00 11.55 O ATOM 1774 CB ALA A 111 11.582 -6.046 3.576 1.00 35.40 C ATOM 0 H ALA A 111 11.033 -5.725 1.202 1.00 11.21 H new ATOM 0 HA ALA A 111 10.183 -4.430 3.519 1.00 14.13 H new ATOM 0 HB1 ALA A 111 11.764 -5.960 4.647 1.00 35.40 H new ATOM 0 HB2 ALA A 111 10.813 -6.797 3.397 1.00 35.40 H new ATOM 0 HB3 ALA A 111 12.503 -6.344 3.075 1.00 35.40 H new ATOM 1780 N GLY A 112 12.994 -3.320 2.362 1.00 30.52 N ATOM 1781 CA GLY A 112 14.014 -2.304 2.550 1.00 34.22 C ATOM 1782 C GLY A 112 13.622 -0.972 1.945 1.00 11.40 C ATOM 1783 O GLY A 112 14.034 0.082 2.429 1.00 15.33 O ATOM 0 H GLY A 112 12.993 -3.761 1.442 1.00 30.52 H new ATOM 0 HA2 GLY A 112 14.202 -2.174 3.616 1.00 34.22 H new ATOM 0 HA3 GLY A 112 14.948 -2.643 2.101 1.00 34.22 H new ATOM 1787 N SER A 113 12.827 -1.017 0.881 1.00 55.54 N ATOM 1788 CA SER A 113 12.384 0.197 0.205 1.00 43.24 C ATOM 1789 C SER A 113 10.946 0.537 0.583 1.00 31.33 C ATOM 1790 O SER A 113 10.323 1.412 -0.018 1.00 61.31 O ATOM 1791 CB SER A 113 12.499 0.033 -1.312 1.00 23.44 C ATOM 1792 OG SER A 113 13.638 -0.736 -1.656 1.00 23.11 O ATOM 0 H SER A 113 12.476 -1.881 0.468 1.00 55.54 H new ATOM 0 HA SER A 113 13.028 1.016 0.525 1.00 43.24 H new ATOM 0 HB2 SER A 113 11.601 -0.449 -1.698 1.00 23.44 H new ATOM 0 HB3 SER A 113 12.562 1.014 -1.783 1.00 23.44 H new ATOM 0 HG SER A 113 13.352 -1.588 -2.047 1.00 23.11 H new ATOM 1798 N LYS A 114 10.423 -0.163 1.585 1.00 5.10 N ATOM 1799 CA LYS A 114 9.059 0.062 2.047 1.00 43.20 C ATOM 1800 C LYS A 114 8.925 1.436 2.696 1.00 31.45 C ATOM 1801 O LYS A 114 8.124 2.262 2.262 1.00 53.33 O ATOM 1802 CB LYS A 114 8.649 -1.027 3.041 1.00 2.41 C ATOM 1803 CG LYS A 114 7.366 -0.714 3.790 1.00 15.43 C ATOM 1804 CD LYS A 114 6.822 -1.940 4.504 1.00 64.11 C ATOM 1805 CE LYS A 114 7.436 -2.099 5.886 1.00 5.55 C ATOM 1806 NZ LYS A 114 6.828 -3.232 6.638 1.00 44.53 N ATOM 0 H LYS A 114 10.925 -0.892 2.093 1.00 5.10 H new ATOM 0 HA LYS A 114 8.397 0.022 1.182 1.00 43.20 H new ATOM 0 HB2 LYS A 114 8.527 -1.969 2.506 1.00 2.41 H new ATOM 0 HB3 LYS A 114 9.454 -1.172 3.761 1.00 2.41 H new ATOM 0 HG2 LYS A 114 7.552 0.078 4.516 1.00 15.43 H new ATOM 0 HG3 LYS A 114 6.619 -0.338 3.091 1.00 15.43 H new ATOM 0 HD2 LYS A 114 5.739 -1.859 4.593 1.00 64.11 H new ATOM 0 HD3 LYS A 114 7.027 -2.830 3.909 1.00 64.11 H new ATOM 0 HE2 LYS A 114 8.509 -2.262 5.790 1.00 5.55 H new ATOM 0 HE3 LYS A 114 7.303 -1.176 6.450 1.00 5.55 H new ATOM 0 HZ1 LYS A 114 7.274 -3.306 7.574 1.00 44.53 H new ATOM 0 HZ2 LYS A 114 5.808 -3.065 6.753 1.00 44.53 H new ATOM 0 HZ3 LYS A 114 6.977 -4.117 6.112 1.00 44.53 H new ATOM 1820 N ASN A 115 9.715 1.673 3.739 1.00 61.13 N ATOM 1821 CA ASN A 115 9.684 2.948 4.446 1.00 21.44 C ATOM 1822 C ASN A 115 9.984 4.104 3.499 1.00 42.12 C ATOM 1823 O ASN A 115 9.392 5.178 3.607 1.00 51.22 O ATOM 1824 CB ASN A 115 10.695 2.940 5.596 1.00 55.23 C ATOM 1825 CG ASN A 115 10.112 2.372 6.875 1.00 73.52 C ATOM 1826 OD1 ASN A 115 9.209 2.958 7.474 1.00 44.40 O ATOM 1827 ND2 ASN A 115 10.625 1.223 7.300 1.00 1.10 N ATOM 0 H ASN A 115 10.384 0.999 4.113 1.00 61.13 H new ATOM 0 HA ASN A 115 8.682 3.086 4.851 1.00 21.44 H new ATOM 0 HB2 ASN A 115 11.567 2.354 5.306 1.00 55.23 H new ATOM 0 HB3 ASN A 115 11.042 3.957 5.778 1.00 55.23 H new ATOM 0 HD21 ASN A 115 10.272 0.792 8.154 1.00 1.10 H new ATOM 0 HD22 ASN A 115 11.372 0.772 6.772 1.00 1.10 H new ATOM 1834 N ARG A 116 10.906 3.877 2.569 1.00 2.11 N ATOM 1835 CA ARG A 116 11.286 4.900 1.602 1.00 50.30 C ATOM 1836 C ARG A 116 10.067 5.392 0.826 1.00 5.25 C ATOM 1837 O ARG A 116 9.819 6.595 0.737 1.00 13.24 O ATOM 1838 CB ARG A 116 12.335 4.352 0.632 1.00 35.24 C ATOM 1839 CG ARG A 116 12.612 5.270 -0.546 1.00 2.11 C ATOM 1840 CD ARG A 116 13.439 6.477 -0.129 1.00 73.22 C ATOM 1841 NE ARG A 116 14.847 6.139 0.053 1.00 41.21 N ATOM 1842 CZ ARG A 116 15.739 6.969 0.585 1.00 75.32 C ATOM 1843 NH1 ARG A 116 15.369 8.177 0.985 1.00 32.14 N ATOM 1844 NH2 ARG A 116 17.003 6.589 0.719 1.00 72.25 N ATOM 0 H ARG A 116 11.404 2.993 2.465 1.00 2.11 H new ATOM 0 HA ARG A 116 11.712 5.741 2.149 1.00 50.30 H new ATOM 0 HB2 ARG A 116 13.265 4.180 1.174 1.00 35.24 H new ATOM 0 HB3 ARG A 116 12.001 3.384 0.257 1.00 35.24 H new ATOM 0 HG2 ARG A 116 13.139 4.717 -1.323 1.00 2.11 H new ATOM 0 HG3 ARG A 116 11.669 5.605 -0.977 1.00 2.11 H new ATOM 0 HD2 ARG A 116 13.348 7.257 -0.885 1.00 73.22 H new ATOM 0 HD3 ARG A 116 13.041 6.885 0.800 1.00 73.22 H new ATOM 0 HE ARG A 116 15.164 5.216 -0.244 1.00 41.21 H new ATOM 0 HH11 ARG A 116 14.398 8.472 0.885 1.00 32.14 H new ATOM 0 HH12 ARG A 116 16.055 8.812 1.393 1.00 32.14 H new ATOM 0 HH21 ARG A 116 17.291 5.659 0.414 1.00 72.25 H new ATOM 0 HH22 ARG A 116 17.687 7.226 1.127 1.00 72.25 H new ATOM 1858 N LEU A 117 9.312 4.454 0.265 1.00 4.40 N ATOM 1859 CA LEU A 117 8.120 4.792 -0.505 1.00 34.13 C ATOM 1860 C LEU A 117 7.055 5.420 0.389 1.00 52.24 C ATOM 1861 O LEU A 117 6.585 6.528 0.128 1.00 25.32 O ATOM 1862 CB LEU A 117 7.558 3.543 -1.187 1.00 52.42 C ATOM 1863 CG LEU A 117 6.191 3.699 -1.854 1.00 14.44 C ATOM 1864 CD1 LEU A 117 6.338 4.327 -3.231 1.00 73.54 C ATOM 1865 CD2 LEU A 117 5.488 2.354 -1.951 1.00 72.51 C ATOM 0 H LEU A 117 9.504 3.454 0.329 1.00 4.40 H new ATOM 0 HA LEU A 117 8.403 5.518 -1.267 1.00 34.13 H new ATOM 0 HB2 LEU A 117 8.272 3.213 -1.941 1.00 52.42 H new ATOM 0 HB3 LEU A 117 7.489 2.748 -0.444 1.00 52.42 H new ATOM 0 HG LEU A 117 5.581 4.361 -1.239 1.00 14.44 H new ATOM 0 HD11 LEU A 117 5.355 4.430 -3.691 1.00 73.54 H new ATOM 0 HD12 LEU A 117 6.799 5.310 -3.135 1.00 73.54 H new ATOM 0 HD13 LEU A 117 6.966 3.691 -3.856 1.00 73.54 H new ATOM 0 HD21 LEU A 117 4.517 2.485 -2.428 1.00 72.51 H new ATOM 0 HD22 LEU A 117 6.094 1.669 -2.543 1.00 72.51 H new ATOM 0 HD23 LEU A 117 5.348 1.943 -0.951 1.00 72.51 H new ATOM 1877 N VAL A 118 6.678 4.704 1.444 1.00 50.21 N ATOM 1878 CA VAL A 118 5.671 5.193 2.379 1.00 63.23 C ATOM 1879 C VAL A 118 5.985 6.614 2.832 1.00 32.12 C ATOM 1880 O VAL A 118 5.147 7.508 2.726 1.00 3.51 O ATOM 1881 CB VAL A 118 5.565 4.281 3.616 1.00 41.34 C ATOM 1882 CG1 VAL A 118 4.589 4.865 4.626 1.00 21.20 C ATOM 1883 CG2 VAL A 118 5.147 2.877 3.208 1.00 64.41 C ATOM 0 H VAL A 118 7.054 3.784 1.672 1.00 50.21 H new ATOM 0 HA VAL A 118 4.718 5.187 1.850 1.00 63.23 H new ATOM 0 HB VAL A 118 6.546 4.220 4.087 1.00 41.34 H new ATOM 0 HG11 VAL A 118 4.526 4.208 5.493 1.00 21.20 H new ATOM 0 HG12 VAL A 118 4.936 5.849 4.941 1.00 21.20 H new ATOM 0 HG13 VAL A 118 3.604 4.957 4.169 1.00 21.20 H new ATOM 0 HG21 VAL A 118 5.077 2.246 4.094 1.00 64.41 H new ATOM 0 HG22 VAL A 118 4.177 2.916 2.713 1.00 64.41 H new ATOM 0 HG23 VAL A 118 5.887 2.461 2.524 1.00 64.41 H new ATOM 1893 N GLN A 119 7.198 6.812 3.338 1.00 4.51 N ATOM 1894 CA GLN A 119 7.623 8.126 3.809 1.00 31.12 C ATOM 1895 C GLN A 119 7.378 9.190 2.745 1.00 14.53 C ATOM 1896 O GLN A 119 7.011 10.324 3.059 1.00 53.02 O ATOM 1897 CB GLN A 119 9.105 8.100 4.190 1.00 74.24 C ATOM 1898 CG GLN A 119 9.364 7.571 5.592 1.00 54.34 C ATOM 1899 CD GLN A 119 10.469 8.324 6.304 1.00 40.43 C ATOM 1900 OE1 GLN A 119 10.709 9.501 6.033 1.00 44.21 O ATOM 1901 NE2 GLN A 119 11.150 7.648 7.222 1.00 34.33 N ATOM 0 H GLN A 119 7.903 6.081 3.432 1.00 4.51 H new ATOM 0 HA GLN A 119 7.033 8.377 4.691 1.00 31.12 H new ATOM 0 HB2 GLN A 119 9.645 7.483 3.472 1.00 74.24 H new ATOM 0 HB3 GLN A 119 9.510 9.109 4.111 1.00 74.24 H new ATOM 0 HG2 GLN A 119 8.447 7.640 6.177 1.00 54.34 H new ATOM 0 HG3 GLN A 119 9.627 6.515 5.535 1.00 54.34 H new ATOM 0 HE21 GLN A 119 10.917 6.674 7.415 1.00 34.33 H new ATOM 0 HE22 GLN A 119 11.906 8.103 7.734 1.00 34.33 H new ATOM 1910 N THR A 120 7.583 8.820 1.486 1.00 54.02 N ATOM 1911 CA THR A 120 7.386 9.743 0.376 1.00 55.42 C ATOM 1912 C THR A 120 5.927 10.173 0.270 1.00 32.20 C ATOM 1913 O THR A 120 5.628 11.351 0.081 1.00 4.54 O ATOM 1914 CB THR A 120 7.822 9.116 -0.962 1.00 43.40 C ATOM 1915 OG1 THR A 120 9.074 8.438 -0.800 1.00 13.44 O ATOM 1916 CG2 THR A 120 7.953 10.180 -2.042 1.00 32.23 C ATOM 0 H THR A 120 7.886 7.886 1.209 1.00 54.02 H new ATOM 0 HA THR A 120 8.006 10.616 0.579 1.00 55.42 H new ATOM 0 HB THR A 120 7.058 8.402 -1.269 1.00 43.40 H new ATOM 0 HG1 THR A 120 8.918 7.552 -0.411 1.00 13.44 H new ATOM 0 HG21 THR A 120 8.262 9.713 -2.977 1.00 32.23 H new ATOM 0 HG22 THR A 120 6.992 10.675 -2.183 1.00 32.23 H new ATOM 0 HG23 THR A 120 8.699 10.915 -1.740 1.00 32.23 H new ATOM 1924 N ALA A 121 5.020 9.208 0.392 1.00 3.42 N ATOM 1925 CA ALA A 121 3.593 9.487 0.314 1.00 53.15 C ATOM 1926 C ALA A 121 3.110 10.238 1.550 1.00 21.43 C ATOM 1927 O ALA A 121 2.057 10.872 1.530 1.00 75.31 O ATOM 1928 CB ALA A 121 2.811 8.194 0.140 1.00 33.14 C ATOM 0 H ALA A 121 5.250 8.226 0.545 1.00 3.42 H new ATOM 0 HA ALA A 121 3.420 10.123 -0.554 1.00 53.15 H new ATOM 0 HB1 ALA A 121 1.746 8.418 0.083 1.00 33.14 H new ATOM 0 HB2 ALA A 121 3.127 7.698 -0.778 1.00 33.14 H new ATOM 0 HB3 ALA A 121 2.999 7.538 0.990 1.00 33.14 H new ATOM 1934 N GLU A 122 3.889 10.159 2.625 1.00 0.43 N ATOM 1935 CA GLU A 122 3.539 10.830 3.871 1.00 12.41 C ATOM 1936 C GLU A 122 2.326 10.171 4.523 1.00 74.22 C ATOM 1937 O GLU A 122 1.534 10.830 5.196 1.00 31.13 O ATOM 1938 CB GLU A 122 3.251 12.312 3.616 1.00 64.32 C ATOM 1939 CG GLU A 122 4.332 13.240 4.144 1.00 70.02 C ATOM 1940 CD GLU A 122 4.661 14.361 3.177 1.00 42.32 C ATOM 1941 OE1 GLU A 122 4.725 14.093 1.958 1.00 22.54 O ATOM 1942 OE2 GLU A 122 4.853 15.506 3.638 1.00 63.03 O ATOM 0 H GLU A 122 4.765 9.638 2.658 1.00 0.43 H new ATOM 0 HA GLU A 122 4.387 10.743 4.550 1.00 12.41 H new ATOM 0 HB2 GLU A 122 3.138 12.472 2.544 1.00 64.32 H new ATOM 0 HB3 GLU A 122 2.300 12.574 4.080 1.00 64.32 H new ATOM 0 HG2 GLU A 122 4.007 13.667 5.093 1.00 70.02 H new ATOM 0 HG3 GLU A 122 5.234 12.663 4.346 1.00 70.02 H new ATOM 1949 N LEU A 123 2.188 8.866 4.315 1.00 32.43 N ATOM 1950 CA LEU A 123 1.072 8.115 4.881 1.00 12.32 C ATOM 1951 C LEU A 123 1.229 7.961 6.391 1.00 13.40 C ATOM 1952 O LEU A 123 0.371 8.389 7.163 1.00 73.03 O ATOM 1953 CB LEU A 123 0.972 6.738 4.224 1.00 22.42 C ATOM 1954 CG LEU A 123 0.613 6.728 2.738 1.00 21.21 C ATOM 1955 CD1 LEU A 123 1.153 5.474 2.067 1.00 40.41 C ATOM 1956 CD2 LEU A 123 -0.894 6.828 2.552 1.00 34.44 C ATOM 0 H LEU A 123 2.834 8.306 3.759 1.00 32.43 H new ATOM 0 HA LEU A 123 0.155 8.671 4.684 1.00 12.32 H new ATOM 0 HB2 LEU A 123 1.927 6.227 4.350 1.00 22.42 H new ATOM 0 HB3 LEU A 123 0.225 6.154 4.762 1.00 22.42 H new ATOM 0 HG LEU A 123 1.075 7.595 2.267 1.00 21.21 H new ATOM 0 HD11 LEU A 123 0.888 5.484 1.010 1.00 40.41 H new ATOM 0 HD12 LEU A 123 2.238 5.445 2.169 1.00 40.41 H new ATOM 0 HD13 LEU A 123 0.721 4.593 2.541 1.00 40.41 H new ATOM 0 HD21 LEU A 123 -1.131 6.819 1.488 1.00 34.44 H new ATOM 0 HD22 LEU A 123 -1.378 5.981 3.038 1.00 34.44 H new ATOM 0 HD23 LEU A 123 -1.255 7.756 2.996 1.00 34.44 H new ATOM 1968 N THR A 124 2.333 7.347 6.806 1.00 3.53 N ATOM 1969 CA THR A 124 2.604 7.138 8.223 1.00 63.33 C ATOM 1970 C THR A 124 1.845 5.927 8.754 1.00 35.32 C ATOM 1971 O THR A 124 2.055 5.499 9.889 1.00 73.22 O ATOM 1972 CB THR A 124 2.223 8.375 9.057 1.00 73.43 C ATOM 1973 OG1 THR A 124 3.273 8.685 9.980 1.00 1.23 O ATOM 1974 CG2 THR A 124 0.927 8.137 9.817 1.00 52.05 C ATOM 0 H THR A 124 3.054 6.986 6.181 1.00 3.53 H new ATOM 0 HA THR A 124 3.676 6.963 8.318 1.00 63.33 H new ATOM 0 HB THR A 124 2.078 9.214 8.377 1.00 73.43 H new ATOM 0 HG1 THR A 124 3.024 9.474 10.506 1.00 1.23 H new ATOM 0 HG21 THR A 124 0.678 9.024 10.399 1.00 52.05 H new ATOM 0 HG22 THR A 124 0.124 7.929 9.110 1.00 52.05 H new ATOM 0 HG23 THR A 124 1.049 7.286 10.487 1.00 52.05 H new ATOM 1982 N LYS A 125 0.961 5.379 7.926 1.00 25.41 N ATOM 1983 CA LYS A 125 0.172 4.216 8.312 1.00 74.52 C ATOM 1984 C LYS A 125 0.545 3.001 7.467 1.00 34.33 C ATOM 1985 O LYS A 125 0.010 2.801 6.377 1.00 11.43 O ATOM 1986 CB LYS A 125 -1.321 4.515 8.161 1.00 33.01 C ATOM 1987 CG LYS A 125 -1.822 5.601 9.097 1.00 20.31 C ATOM 1988 CD LYS A 125 -3.248 5.336 9.548 1.00 72.52 C ATOM 1989 CE LYS A 125 -4.010 6.632 9.781 1.00 3.25 C ATOM 1990 NZ LYS A 125 -4.502 6.741 11.183 1.00 61.24 N ATOM 0 H LYS A 125 0.774 5.722 6.984 1.00 25.41 H new ATOM 0 HA LYS A 125 0.388 3.991 9.356 1.00 74.52 H new ATOM 0 HB2 LYS A 125 -1.521 4.814 7.132 1.00 33.01 H new ATOM 0 HB3 LYS A 125 -1.886 3.601 8.343 1.00 33.01 H new ATOM 0 HG2 LYS A 125 -1.169 5.661 9.968 1.00 20.31 H new ATOM 0 HG3 LYS A 125 -1.772 6.567 8.594 1.00 20.31 H new ATOM 0 HD2 LYS A 125 -3.764 4.740 8.795 1.00 72.52 H new ATOM 0 HD3 LYS A 125 -3.237 4.749 10.467 1.00 72.52 H new ATOM 0 HE2 LYS A 125 -3.363 7.480 9.556 1.00 3.25 H new ATOM 0 HE3 LYS A 125 -4.855 6.685 9.094 1.00 3.25 H new ATOM 0 HZ1 LYS A 125 -5.016 7.637 11.302 1.00 61.24 H new ATOM 0 HZ2 LYS A 125 -5.140 5.946 11.390 1.00 61.24 H new ATOM 0 HZ3 LYS A 125 -3.694 6.716 11.837 1.00 61.24 H new ATOM 2004 N VAL A 126 1.465 2.190 7.981 1.00 72.03 N ATOM 2005 CA VAL A 126 1.908 0.993 7.276 1.00 71.32 C ATOM 2006 C VAL A 126 1.284 -0.261 7.876 1.00 22.24 C ATOM 2007 O VAL A 126 1.625 -0.666 8.988 1.00 51.11 O ATOM 2008 CB VAL A 126 3.442 0.857 7.309 1.00 33.52 C ATOM 2009 CG1 VAL A 126 3.930 0.029 6.130 1.00 3.33 C ATOM 2010 CG2 VAL A 126 4.097 2.229 7.316 1.00 42.21 C ATOM 0 H VAL A 126 1.918 2.340 8.883 1.00 72.03 H new ATOM 0 HA VAL A 126 1.583 1.097 6.241 1.00 71.32 H new ATOM 0 HB VAL A 126 3.725 0.340 8.226 1.00 33.52 H new ATOM 0 HG11 VAL A 126 5.016 -0.056 6.170 1.00 3.33 H new ATOM 0 HG12 VAL A 126 3.486 -0.965 6.175 1.00 3.33 H new ATOM 0 HG13 VAL A 126 3.638 0.515 5.199 1.00 3.33 H new ATOM 0 HG21 VAL A 126 5.181 2.115 7.339 1.00 42.21 H new ATOM 0 HG22 VAL A 126 3.809 2.774 6.417 1.00 42.21 H new ATOM 0 HG23 VAL A 126 3.772 2.783 8.196 1.00 42.21 H new ATOM 2020 N PHE A 127 0.368 -0.874 7.134 1.00 71.23 N ATOM 2021 CA PHE A 127 -0.305 -2.083 7.594 1.00 61.52 C ATOM 2022 C PHE A 127 0.176 -3.303 6.814 1.00 63.42 C ATOM 2023 O PHE A 127 -0.085 -3.430 5.618 1.00 4.01 O ATOM 2024 CB PHE A 127 -1.821 -1.936 7.448 1.00 34.12 C ATOM 2025 CG PHE A 127 -2.417 -0.922 8.382 1.00 14.41 C ATOM 2026 CD1 PHE A 127 -2.032 -0.873 9.711 1.00 2.12 C ATOM 2027 CD2 PHE A 127 -3.364 -0.016 7.929 1.00 21.23 C ATOM 2028 CE1 PHE A 127 -2.578 0.059 10.573 1.00 3.21 C ATOM 2029 CE2 PHE A 127 -3.913 0.918 8.786 1.00 2.44 C ATOM 2030 CZ PHE A 127 -3.520 0.956 10.110 1.00 12.31 C ATOM 0 H PHE A 127 0.075 -0.553 6.211 1.00 71.23 H new ATOM 0 HA PHE A 127 -0.061 -2.226 8.647 1.00 61.52 H new ATOM 0 HB2 PHE A 127 -2.053 -1.653 6.421 1.00 34.12 H new ATOM 0 HB3 PHE A 127 -2.291 -2.903 7.627 1.00 34.12 H new ATOM 0 HD1 PHE A 127 -1.296 -1.572 10.079 1.00 2.12 H new ATOM 0 HD2 PHE A 127 -3.676 -0.041 6.895 1.00 21.23 H new ATOM 0 HE1 PHE A 127 -2.268 0.086 11.607 1.00 3.21 H new ATOM 0 HE2 PHE A 127 -4.649 1.619 8.421 1.00 2.44 H new ATOM 0 HZ PHE A 127 -3.949 1.686 10.781 1.00 12.31 H new ATOM 2040 N GLU A 128 0.880 -4.199 7.501 1.00 41.44 N ATOM 2041 CA GLU A 128 1.399 -5.408 6.871 1.00 15.40 C ATOM 2042 C GLU A 128 0.367 -6.531 6.921 1.00 62.33 C ATOM 2043 O GLU A 128 -0.166 -6.852 7.984 1.00 42.02 O ATOM 2044 CB GLU A 128 2.690 -5.854 7.560 1.00 13.20 C ATOM 2045 CG GLU A 128 3.659 -6.568 6.633 1.00 1.43 C ATOM 2046 CD GLU A 128 4.258 -7.811 7.261 1.00 2.25 C ATOM 2047 OE1 GLU A 128 5.106 -7.668 8.167 1.00 63.23 O ATOM 2048 OE2 GLU A 128 3.879 -8.927 6.848 1.00 55.12 O ATOM 0 H GLU A 128 1.103 -4.110 8.492 1.00 41.44 H new ATOM 0 HA GLU A 128 1.614 -5.181 5.827 1.00 15.40 H new ATOM 0 HB2 GLU A 128 3.185 -4.981 7.986 1.00 13.20 H new ATOM 0 HB3 GLU A 128 2.440 -6.515 8.389 1.00 13.20 H new ATOM 0 HG2 GLU A 128 3.141 -6.843 5.714 1.00 1.43 H new ATOM 0 HG3 GLU A 128 4.461 -5.884 6.354 1.00 1.43 H new ATOM 2055 N ILE A 129 0.092 -7.124 5.765 1.00 63.03 N ATOM 2056 CA ILE A 129 -0.873 -8.212 5.675 1.00 34.42 C ATOM 2057 C ILE A 129 -0.189 -9.529 5.324 1.00 43.20 C ATOM 2058 O ILE A 129 0.364 -9.681 4.234 1.00 53.45 O ATOM 2059 CB ILE A 129 -1.961 -7.916 4.625 1.00 11.51 C ATOM 2060 CG1 ILE A 129 -1.342 -7.262 3.389 1.00 44.10 C ATOM 2061 CG2 ILE A 129 -3.040 -7.023 5.218 1.00 34.51 C ATOM 2062 CD1 ILE A 129 -2.228 -7.323 2.164 1.00 22.24 C ATOM 0 H ILE A 129 0.524 -6.869 4.877 1.00 63.03 H new ATOM 0 HA ILE A 129 -1.340 -8.299 6.656 1.00 34.42 H new ATOM 0 HB ILE A 129 -2.420 -8.857 4.324 1.00 11.51 H new ATOM 0 HG12 ILE A 129 -1.118 -6.219 3.614 1.00 44.10 H new ATOM 0 HG13 ILE A 129 -0.394 -7.751 3.166 1.00 44.10 H new ATOM 0 HG21 ILE A 129 -3.801 -6.823 4.464 1.00 34.51 H new ATOM 0 HG22 ILE A 129 -3.497 -7.523 6.072 1.00 34.51 H new ATOM 0 HG23 ILE A 129 -2.596 -6.082 5.544 1.00 34.51 H new ATOM 0 HD11 ILE A 129 -1.725 -6.840 1.326 1.00 22.24 H new ATOM 0 HD12 ILE A 129 -2.432 -8.364 1.914 1.00 22.24 H new ATOM 0 HD13 ILE A 129 -3.167 -6.809 2.368 1.00 22.24 H new ATOM 2074 N ARG A 130 -0.230 -10.478 6.253 1.00 4.22 N ATOM 2075 CA ARG A 130 0.387 -11.781 6.042 1.00 60.54 C ATOM 2076 C ARG A 130 -0.189 -12.460 4.801 1.00 0.11 C ATOM 2077 O ARG A 130 0.349 -13.459 4.320 1.00 13.44 O ATOM 2078 CB ARG A 130 0.177 -12.674 7.267 1.00 4.31 C ATOM 2079 CG ARG A 130 0.676 -14.096 7.076 1.00 31.30 C ATOM 2080 CD ARG A 130 2.138 -14.125 6.658 1.00 12.01 C ATOM 2081 NE ARG A 130 2.715 -15.460 6.777 1.00 60.45 N ATOM 2082 CZ ARG A 130 3.038 -16.021 7.937 1.00 63.44 C ATOM 2083 NH1 ARG A 130 2.839 -15.365 9.072 1.00 63.51 N ATOM 2084 NH2 ARG A 130 3.559 -17.241 7.963 1.00 25.34 N ATOM 0 H ARG A 130 -0.684 -10.369 7.160 1.00 4.22 H new ATOM 0 HA ARG A 130 1.456 -11.629 5.891 1.00 60.54 H new ATOM 0 HB2 ARG A 130 0.688 -12.230 8.121 1.00 4.31 H new ATOM 0 HB3 ARG A 130 -0.885 -12.700 7.509 1.00 4.31 H new ATOM 0 HG2 ARG A 130 0.551 -14.654 8.004 1.00 31.30 H new ATOM 0 HG3 ARG A 130 0.071 -14.596 6.320 1.00 31.30 H new ATOM 0 HD2 ARG A 130 2.227 -13.782 5.627 1.00 12.01 H new ATOM 0 HD3 ARG A 130 2.705 -13.429 7.275 1.00 12.01 H new ATOM 0 HE ARG A 130 2.879 -15.992 5.922 1.00 60.45 H new ATOM 0 HH11 ARG A 130 2.437 -14.428 9.056 1.00 63.51 H new ATOM 0 HH12 ARG A 130 3.088 -15.798 9.962 1.00 63.51 H new ATOM 0 HH21 ARG A 130 3.712 -17.749 7.092 1.00 25.34 H new ATOM 0 HH22 ARG A 130 3.807 -17.671 8.854 1.00 25.34 H new ATOM 2098 N THR A 131 -1.286 -11.911 4.288 1.00 25.32 N ATOM 2099 CA THR A 131 -1.935 -12.464 3.106 1.00 41.31 C ATOM 2100 C THR A 131 -3.071 -11.564 2.633 1.00 72.43 C ATOM 2101 O THR A 131 -3.647 -10.808 3.416 1.00 4.13 O ATOM 2102 CB THR A 131 -2.491 -13.875 3.377 1.00 5.43 C ATOM 2103 OG1 THR A 131 -3.354 -14.275 2.308 1.00 41.11 O ATOM 2104 CG2 THR A 131 -3.253 -13.912 4.693 1.00 61.23 C ATOM 0 H THR A 131 -1.743 -11.084 4.673 1.00 25.32 H new ATOM 0 HA THR A 131 -1.175 -12.526 2.327 1.00 41.31 H new ATOM 0 HB THR A 131 -1.651 -14.567 3.442 1.00 5.43 H new ATOM 0 HG1 THR A 131 -3.702 -15.174 2.487 1.00 41.11 H new ATOM 0 HG21 THR A 131 -3.636 -14.918 4.863 1.00 61.23 H new ATOM 0 HG22 THR A 131 -2.585 -13.636 5.508 1.00 61.23 H new ATOM 0 HG23 THR A 131 -4.085 -13.209 4.652 1.00 61.23 H new ATOM 2112 N THR A 132 -3.393 -11.653 1.345 1.00 21.11 N ATOM 2113 CA THR A 132 -4.461 -10.847 0.768 1.00 4.11 C ATOM 2114 C THR A 132 -5.753 -10.997 1.561 1.00 34.44 C ATOM 2115 O THR A 132 -6.459 -10.018 1.808 1.00 73.30 O ATOM 2116 CB THR A 132 -4.725 -11.233 -0.700 1.00 4.12 C ATOM 2117 OG1 THR A 132 -4.838 -12.656 -0.819 1.00 71.04 O ATOM 2118 CG2 THR A 132 -3.607 -10.731 -1.601 1.00 74.21 C ATOM 0 H THR A 132 -2.929 -12.275 0.683 1.00 21.11 H new ATOM 0 HA THR A 132 -4.131 -9.809 0.810 1.00 4.11 H new ATOM 0 HB THR A 132 -5.659 -10.767 -1.013 1.00 4.12 H new ATOM 0 HG1 THR A 132 -5.007 -12.894 -1.755 1.00 71.04 H new ATOM 0 HG21 THR A 132 -3.815 -11.015 -2.632 1.00 74.21 H new ATOM 0 HG22 THR A 132 -3.542 -9.645 -1.530 1.00 74.21 H new ATOM 0 HG23 THR A 132 -2.661 -11.172 -1.287 1.00 74.21 H new ATOM 2126 N ASP A 133 -6.059 -12.227 1.959 1.00 23.24 N ATOM 2127 CA ASP A 133 -7.266 -12.506 2.728 1.00 52.41 C ATOM 2128 C ASP A 133 -7.434 -11.498 3.861 1.00 3.40 C ATOM 2129 O ASP A 133 -8.553 -11.135 4.222 1.00 1.24 O ATOM 2130 CB ASP A 133 -7.221 -13.926 3.293 1.00 11.22 C ATOM 2131 CG ASP A 133 -8.292 -14.819 2.699 1.00 14.13 C ATOM 2132 OD1 ASP A 133 -9.474 -14.658 3.073 1.00 61.13 O ATOM 2133 OD2 ASP A 133 -7.950 -15.679 1.862 1.00 51.25 O ATOM 0 H ASP A 133 -5.487 -13.048 1.761 1.00 23.24 H new ATOM 0 HA ASP A 133 -8.122 -12.418 2.058 1.00 52.41 H new ATOM 0 HB2 ASP A 133 -6.241 -14.361 3.098 1.00 11.22 H new ATOM 0 HB3 ASP A 133 -7.343 -13.887 4.375 1.00 11.22 H new ATOM 2138 N ASP A 134 -6.313 -11.052 4.419 1.00 40.32 N ATOM 2139 CA ASP A 134 -6.335 -10.087 5.512 1.00 51.21 C ATOM 2140 C ASP A 134 -7.042 -8.803 5.088 1.00 13.25 C ATOM 2141 O ASP A 134 -7.773 -8.196 5.873 1.00 41.40 O ATOM 2142 CB ASP A 134 -4.911 -9.771 5.971 1.00 62.55 C ATOM 2143 CG ASP A 134 -4.764 -9.823 7.479 1.00 2.20 C ATOM 2144 OD1 ASP A 134 -5.495 -10.606 8.120 1.00 71.22 O ATOM 2145 OD2 ASP A 134 -3.916 -9.081 8.017 1.00 4.30 O ATOM 0 H ASP A 134 -5.379 -11.343 4.132 1.00 40.32 H new ATOM 0 HA ASP A 134 -6.886 -10.528 6.342 1.00 51.21 H new ATOM 0 HB2 ASP A 134 -4.220 -10.481 5.517 1.00 62.55 H new ATOM 0 HB3 ASP A 134 -4.629 -8.780 5.615 1.00 62.55 H new ATOM 2150 N LEU A 135 -6.820 -8.394 3.845 1.00 41.43 N ATOM 2151 CA LEU A 135 -7.435 -7.180 3.317 1.00 72.32 C ATOM 2152 C LEU A 135 -8.948 -7.343 3.200 1.00 61.31 C ATOM 2153 O LEU A 135 -9.463 -7.723 2.148 1.00 64.22 O ATOM 2154 CB LEU A 135 -6.841 -6.837 1.950 1.00 10.42 C ATOM 2155 CG LEU A 135 -7.640 -5.848 1.100 1.00 51.33 C ATOM 2156 CD1 LEU A 135 -8.273 -4.780 1.977 1.00 13.31 C ATOM 2157 CD2 LEU A 135 -6.749 -5.212 0.042 1.00 72.32 C ATOM 0 H LEU A 135 -6.219 -8.884 3.183 1.00 41.43 H new ATOM 0 HA LEU A 135 -7.228 -6.366 4.011 1.00 72.32 H new ATOM 0 HB2 LEU A 135 -5.842 -6.430 2.102 1.00 10.42 H new ATOM 0 HB3 LEU A 135 -6.726 -7.761 1.384 1.00 10.42 H new ATOM 0 HG LEU A 135 -8.437 -6.394 0.595 1.00 51.33 H new ATOM 0 HD11 LEU A 135 -8.837 -4.086 1.355 1.00 13.31 H new ATOM 0 HD12 LEU A 135 -8.944 -5.250 2.696 1.00 13.31 H new ATOM 0 HD13 LEU A 135 -7.492 -4.237 2.510 1.00 13.31 H new ATOM 0 HD21 LEU A 135 -7.334 -4.511 -0.553 1.00 72.32 H new ATOM 0 HD22 LEU A 135 -5.930 -4.680 0.527 1.00 72.32 H new ATOM 0 HD23 LEU A 135 -6.343 -5.988 -0.607 1.00 72.32 H new ATOM 2169 N THR A 136 -9.655 -7.051 4.287 1.00 41.32 N ATOM 2170 CA THR A 136 -11.108 -7.164 4.306 1.00 42.13 C ATOM 2171 C THR A 136 -11.751 -5.896 4.854 1.00 11.34 C ATOM 2172 O THR A 136 -11.158 -5.191 5.671 1.00 62.33 O ATOM 2173 CB THR A 136 -11.567 -8.366 5.153 1.00 65.21 C ATOM 2174 OG1 THR A 136 -10.699 -8.530 6.281 1.00 53.30 O ATOM 2175 CG2 THR A 136 -11.575 -9.641 4.323 1.00 10.33 C ATOM 0 H THR A 136 -9.245 -6.734 5.166 1.00 41.32 H new ATOM 0 HA THR A 136 -11.427 -7.313 3.274 1.00 42.13 H new ATOM 0 HB THR A 136 -12.582 -8.172 5.501 1.00 65.21 H new ATOM 0 HG1 THR A 136 -10.998 -9.295 6.815 1.00 53.30 H new ATOM 0 HG21 THR A 136 -11.902 -10.476 4.942 1.00 10.33 H new ATOM 0 HG22 THR A 136 -12.258 -9.523 3.482 1.00 10.33 H new ATOM 0 HG23 THR A 136 -10.570 -9.838 3.950 1.00 10.33 H new ATOM 2183 N GLU A 137 -12.967 -5.609 4.400 1.00 34.43 N ATOM 2184 CA GLU A 137 -13.689 -4.424 4.847 1.00 13.10 C ATOM 2185 C GLU A 137 -13.538 -4.230 6.353 1.00 45.23 C ATOM 2186 O GLU A 137 -13.324 -3.114 6.828 1.00 75.23 O ATOM 2187 CB GLU A 137 -15.172 -4.536 4.482 1.00 21.14 C ATOM 2188 CG GLU A 137 -15.943 -3.240 4.667 1.00 1.42 C ATOM 2189 CD GLU A 137 -17.444 -3.451 4.679 1.00 75.21 C ATOM 2190 OE1 GLU A 137 -17.978 -3.965 3.673 1.00 33.34 O ATOM 2191 OE2 GLU A 137 -18.086 -3.102 5.692 1.00 61.52 O ATOM 0 H GLU A 137 -13.472 -6.181 3.723 1.00 34.43 H new ATOM 0 HA GLU A 137 -13.262 -3.558 4.342 1.00 13.10 H new ATOM 0 HB2 GLU A 137 -15.259 -4.856 3.444 1.00 21.14 H new ATOM 0 HB3 GLU A 137 -15.631 -5.313 5.094 1.00 21.14 H new ATOM 0 HG2 GLU A 137 -15.638 -2.771 5.602 1.00 1.42 H new ATOM 0 HG3 GLU A 137 -15.683 -2.549 3.865 1.00 1.42 H new ATOM 2198 N THR A 138 -13.650 -5.324 7.099 1.00 63.13 N ATOM 2199 CA THR A 138 -13.527 -5.275 8.550 1.00 25.43 C ATOM 2200 C THR A 138 -12.077 -5.060 8.973 1.00 71.35 C ATOM 2201 O THR A 138 -11.734 -4.025 9.543 1.00 40.24 O ATOM 2202 CB THR A 138 -14.054 -6.567 9.203 1.00 65.03 C ATOM 2203 OG1 THR A 138 -15.317 -6.924 8.631 1.00 21.45 O ATOM 2204 CG2 THR A 138 -14.203 -6.392 10.707 1.00 43.44 C ATOM 0 H THR A 138 -13.826 -6.255 6.722 1.00 63.13 H new ATOM 0 HA THR A 138 -14.130 -4.433 8.889 1.00 25.43 H new ATOM 0 HB THR A 138 -13.333 -7.363 9.016 1.00 65.03 H new ATOM 0 HG1 THR A 138 -15.645 -7.747 9.050 1.00 21.45 H new ATOM 0 HG21 THR A 138 -14.576 -7.317 11.146 1.00 43.44 H new ATOM 0 HG22 THR A 138 -13.234 -6.149 11.143 1.00 43.44 H new ATOM 0 HG23 THR A 138 -14.906 -5.584 10.911 1.00 43.44 H new ATOM 2212 N TRP A 139 -11.233 -6.045 8.688 1.00 4.54 N ATOM 2213 CA TRP A 139 -9.819 -5.963 9.040 1.00 41.33 C ATOM 2214 C TRP A 139 -9.280 -4.555 8.804 1.00 31.31 C ATOM 2215 O TRP A 139 -8.377 -4.100 9.507 1.00 32.11 O ATOM 2216 CB TRP A 139 -9.011 -6.974 8.224 1.00 23.53 C ATOM 2217 CG TRP A 139 -7.540 -6.685 8.208 1.00 4.15 C ATOM 2218 CD1 TRP A 139 -6.606 -7.135 9.098 1.00 73.20 C ATOM 2219 CD2 TRP A 139 -6.836 -5.879 7.258 1.00 1.22 C ATOM 2220 NE1 TRP A 139 -5.363 -6.658 8.757 1.00 15.35 N ATOM 2221 CE2 TRP A 139 -5.477 -5.885 7.632 1.00 54.22 C ATOM 2222 CE3 TRP A 139 -7.219 -5.153 6.126 1.00 34.53 C ATOM 2223 CZ2 TRP A 139 -4.505 -5.193 6.915 1.00 70.15 C ATOM 2224 CZ3 TRP A 139 -6.253 -4.468 5.415 1.00 13.43 C ATOM 2225 CH2 TRP A 139 -4.909 -4.492 5.810 1.00 30.42 C ATOM 0 H TRP A 139 -11.502 -6.908 8.215 1.00 4.54 H new ATOM 0 HA TRP A 139 -9.719 -6.198 10.100 1.00 41.33 H new ATOM 0 HB2 TRP A 139 -9.173 -7.972 8.632 1.00 23.53 H new ATOM 0 HB3 TRP A 139 -9.383 -6.984 7.200 1.00 23.53 H new ATOM 0 HD1 TRP A 139 -6.814 -7.772 9.945 1.00 73.20 H new ATOM 0 HE1 TRP A 139 -4.496 -6.849 9.260 1.00 15.35 H new ATOM 0 HE3 TRP A 139 -8.252 -5.128 5.813 1.00 34.53 H new ATOM 0 HZ2 TRP A 139 -3.469 -5.208 7.219 1.00 70.15 H new ATOM 0 HZ3 TRP A 139 -6.539 -3.904 4.539 1.00 13.43 H new ATOM 0 HH2 TRP A 139 -4.177 -3.947 5.232 1.00 30.42 H new ATOM 2236 N LEU A 140 -9.840 -3.871 7.813 1.00 72.13 N ATOM 2237 CA LEU A 140 -9.416 -2.514 7.485 1.00 1.33 C ATOM 2238 C LEU A 140 -10.030 -1.504 8.449 1.00 50.03 C ATOM 2239 O LEU A 140 -9.320 -0.828 9.194 1.00 70.45 O ATOM 2240 CB LEU A 140 -9.808 -2.169 6.048 1.00 53.03 C ATOM 2241 CG LEU A 140 -9.837 -0.681 5.699 1.00 15.54 C ATOM 2242 CD1 LEU A 140 -8.501 -0.030 6.020 1.00 24.53 C ATOM 2243 CD2 LEU A 140 -10.190 -0.483 4.232 1.00 64.10 C ATOM 0 H LEU A 140 -10.589 -4.233 7.222 1.00 72.13 H new ATOM 0 HA LEU A 140 -8.331 -2.466 7.580 1.00 1.33 H new ATOM 0 HB2 LEU A 140 -9.111 -2.666 5.373 1.00 53.03 H new ATOM 0 HB3 LEU A 140 -10.795 -2.587 5.852 1.00 53.03 H new ATOM 0 HG LEU A 140 -10.606 -0.202 6.305 1.00 15.54 H new ATOM 0 HD11 LEU A 140 -8.542 1.029 5.765 1.00 24.53 H new ATOM 0 HD12 LEU A 140 -8.289 -0.139 7.084 1.00 24.53 H new ATOM 0 HD13 LEU A 140 -7.713 -0.513 5.442 1.00 24.53 H new ATOM 0 HD21 LEU A 140 -10.206 0.582 4.002 1.00 64.10 H new ATOM 0 HD22 LEU A 140 -9.445 -0.978 3.609 1.00 64.10 H new ATOM 0 HD23 LEU A 140 -11.172 -0.912 4.033 1.00 64.10 H new ATOM 2255 N LYS A 141 -11.355 -1.408 8.431 1.00 11.40 N ATOM 2256 CA LYS A 141 -12.067 -0.483 9.305 1.00 31.33 C ATOM 2257 C LYS A 141 -11.652 -0.680 10.759 1.00 34.24 C ATOM 2258 O LYS A 141 -11.906 0.174 11.608 1.00 4.20 O ATOM 2259 CB LYS A 141 -13.578 -0.677 9.164 1.00 74.21 C ATOM 2260 CG LYS A 141 -14.222 0.267 8.163 1.00 12.43 C ATOM 2261 CD LYS A 141 -15.377 -0.396 7.432 1.00 24.22 C ATOM 2262 CE LYS A 141 -16.718 -0.001 8.031 1.00 44.30 C ATOM 2263 NZ LYS A 141 -17.123 -0.915 9.135 1.00 53.01 N ATOM 0 H LYS A 141 -11.958 -1.960 7.820 1.00 11.40 H new ATOM 0 HA LYS A 141 -11.808 0.533 9.006 1.00 31.33 H new ATOM 0 HB2 LYS A 141 -13.777 -1.705 8.861 1.00 74.21 H new ATOM 0 HB3 LYS A 141 -14.046 -0.535 10.138 1.00 74.21 H new ATOM 0 HG2 LYS A 141 -14.581 1.157 8.680 1.00 12.43 H new ATOM 0 HG3 LYS A 141 -13.475 0.597 7.441 1.00 12.43 H new ATOM 0 HD2 LYS A 141 -15.351 -0.115 6.379 1.00 24.22 H new ATOM 0 HD3 LYS A 141 -15.263 -1.479 7.476 1.00 24.22 H new ATOM 0 HE2 LYS A 141 -16.661 1.020 8.408 1.00 44.30 H new ATOM 0 HE3 LYS A 141 -17.481 -0.012 7.252 1.00 44.30 H new ATOM 0 HZ1 LYS A 141 -18.042 -0.612 9.517 1.00 53.01 H new ATOM 0 HZ2 LYS A 141 -17.202 -1.886 8.771 1.00 53.01 H new ATOM 0 HZ3 LYS A 141 -16.408 -0.886 9.890 1.00 53.01 H new ATOM 2277 N GLU A 142 -11.014 -1.812 11.040 1.00 70.11 N ATOM 2278 CA GLU A 142 -10.565 -2.121 12.392 1.00 0.33 C ATOM 2279 C GLU A 142 -9.387 -1.234 12.789 1.00 15.11 C ATOM 2280 O GLU A 142 -9.454 -0.498 13.775 1.00 24.41 O ATOM 2281 CB GLU A 142 -10.166 -3.594 12.498 1.00 64.32 C ATOM 2282 CG GLU A 142 -11.337 -4.524 12.766 1.00 1.15 C ATOM 2283 CD GLU A 142 -10.916 -5.810 13.451 1.00 75.55 C ATOM 2284 OE1 GLU A 142 -9.935 -6.432 12.993 1.00 0.51 O ATOM 2285 OE2 GLU A 142 -11.569 -6.195 14.444 1.00 42.31 O ATOM 0 H GLU A 142 -10.797 -2.530 10.349 1.00 70.11 H new ATOM 0 HA GLU A 142 -11.392 -1.927 13.075 1.00 0.33 H new ATOM 0 HB2 GLU A 142 -9.677 -3.897 11.572 1.00 64.32 H new ATOM 0 HB3 GLU A 142 -9.433 -3.707 13.297 1.00 64.32 H new ATOM 0 HG2 GLU A 142 -12.070 -4.009 13.387 1.00 1.15 H new ATOM 0 HG3 GLU A 142 -11.829 -4.763 11.823 1.00 1.15 H new ATOM 2292 N LYS A 143 -8.310 -1.310 12.015 1.00 14.35 N ATOM 2293 CA LYS A 143 -7.118 -0.515 12.284 1.00 24.23 C ATOM 2294 C LYS A 143 -7.449 0.974 12.307 1.00 31.22 C ATOM 2295 O LYS A 143 -6.924 1.725 13.130 1.00 35.22 O ATOM 2296 CB LYS A 143 -6.045 -0.794 11.228 1.00 54.53 C ATOM 2297 CG LYS A 143 -5.793 -2.273 10.993 1.00 5.24 C ATOM 2298 CD LYS A 143 -4.388 -2.671 11.416 1.00 63.33 C ATOM 2299 CE LYS A 143 -3.797 -3.709 10.473 1.00 12.25 C ATOM 2300 NZ LYS A 143 -2.385 -4.033 10.820 1.00 20.14 N ATOM 0 H LYS A 143 -8.238 -1.914 11.196 1.00 14.35 H new ATOM 0 HA LYS A 143 -6.737 -0.799 13.265 1.00 24.23 H new ATOM 0 HB2 LYS A 143 -6.344 -0.331 10.288 1.00 54.53 H new ATOM 0 HB3 LYS A 143 -5.113 -0.319 11.535 1.00 54.53 H new ATOM 0 HG2 LYS A 143 -6.522 -2.861 11.550 1.00 5.24 H new ATOM 0 HG3 LYS A 143 -5.936 -2.505 9.938 1.00 5.24 H new ATOM 0 HD2 LYS A 143 -3.748 -1.789 11.435 1.00 63.33 H new ATOM 0 HD3 LYS A 143 -4.411 -3.070 12.430 1.00 63.33 H new ATOM 0 HE2 LYS A 143 -4.398 -4.618 10.510 1.00 12.25 H new ATOM 0 HE3 LYS A 143 -3.844 -3.338 9.449 1.00 12.25 H new ATOM 0 HZ1 LYS A 143 -2.217 -5.050 10.678 1.00 20.14 H new ATOM 0 HZ2 LYS A 143 -1.744 -3.488 10.209 1.00 20.14 H new ATOM 0 HZ3 LYS A 143 -2.207 -3.788 11.815 1.00 20.14 H new ATOM 2314 N LEU A 144 -8.324 1.394 11.400 1.00 32.00 N ATOM 2315 CA LEU A 144 -8.728 2.793 11.317 1.00 72.30 C ATOM 2316 C LEU A 144 -9.509 3.209 12.560 1.00 44.22 C ATOM 2317 O LEU A 144 -9.172 4.196 13.215 1.00 31.33 O ATOM 2318 CB LEU A 144 -9.577 3.027 10.067 1.00 64.43 C ATOM 2319 CG LEU A 144 -9.046 2.411 8.771 1.00 25.15 C ATOM 2320 CD1 LEU A 144 -10.089 2.505 7.669 1.00 72.31 C ATOM 2321 CD2 LEU A 144 -7.755 3.094 8.345 1.00 20.13 C ATOM 0 H LEU A 144 -8.767 0.786 10.712 1.00 32.00 H new ATOM 0 HA LEU A 144 -7.826 3.402 11.255 1.00 72.30 H new ATOM 0 HB2 LEU A 144 -10.576 2.632 10.251 1.00 64.43 H new ATOM 0 HB3 LEU A 144 -9.682 4.102 9.919 1.00 64.43 H new ATOM 0 HG LEU A 144 -8.833 1.358 8.953 1.00 25.15 H new ATOM 0 HD11 LEU A 144 -9.694 2.062 6.755 1.00 72.31 H new ATOM 0 HD12 LEU A 144 -10.988 1.969 7.972 1.00 72.31 H new ATOM 0 HD13 LEU A 144 -10.334 3.552 7.488 1.00 72.31 H new ATOM 0 HD21 LEU A 144 -7.392 2.643 7.422 1.00 20.13 H new ATOM 0 HD22 LEU A 144 -7.942 4.155 8.181 1.00 20.13 H new ATOM 0 HD23 LEU A 144 -7.005 2.974 9.127 1.00 20.13 H new ATOM 2333 N ALA A 145 -10.551 2.449 12.879 1.00 4.22 N ATOM 2334 CA ALA A 145 -11.376 2.737 14.046 1.00 73.25 C ATOM 2335 C ALA A 145 -10.538 3.308 15.185 1.00 73.33 C ATOM 2336 O ALA A 145 -10.811 4.399 15.683 1.00 54.43 O ATOM 2337 CB ALA A 145 -12.103 1.480 14.501 1.00 71.42 C ATOM 0 H ALA A 145 -10.844 1.630 12.346 1.00 4.22 H new ATOM 0 HA ALA A 145 -12.113 3.488 13.762 1.00 73.25 H new ATOM 0 HB1 ALA A 145 -12.715 1.709 15.373 1.00 71.42 H new ATOM 0 HB2 ALA A 145 -12.741 1.117 13.695 1.00 71.42 H new ATOM 0 HB3 ALA A 145 -11.374 0.712 14.761 1.00 71.42 H new