USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=29 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 35 ASN : amide:sc= -0.123 K(o=1.1,f=-2.2!) USER MOD Set 1.2: A 77 TYR OH : rot -10:sc= 1.18 USER MOD Set 2.1: A 34 ASN : amide:sc= -0.248 X(o=-4.2,f=-4.6) USER MOD Set 2.2: A 57 ASN :FLIP amide:sc= -3.99! C(o=-5.9!,f=-4.2!) USER MOD Single : A 14 CYS SG : rot 120:sc= -3.45! 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 152:sc= -4.97! (180deg=-9.24!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0.0866 X(o=0.087,f=0) USER MOD Single : A 48 MET CE :methyl -128:sc= -0.0615 (180deg=-0.896) USER MOD Single : A 56 GLN : amide:sc= -0.167 K(o=-0.17,f=-0.76) USER MOD Single : A 59 SER OG : rot 180:sc= -0.176 USER MOD Single : A 64 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0394) 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= -0.187 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 83 HIS :FLIP no HE2:sc= -0.0479 F(o=-0.7,f=-0.048) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot -120:sc= -3.52! USER MOD Single : A 97 SER OG : rot 147:sc= -2! USER MOD Single : A 98 SER OG : rot 117:sc= 0.542 USER MOD Single : A 102 CYS SG : rot 82:sc= -3.13 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.0829 X(o=-0.083,f=0) USER MOD Single : A 107 GLN : amide:sc= -0.0331 X(o=-0.033,f=-0.0016) USER MOD Single : A 108 MET CE :methyl -175:sc= 0 (180deg=-0.0482) USER MOD Single : A 109 MET CE :methyl -177:sc= -1.64 (180deg=-1.71!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 76:sc= 1.91 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) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 120 THR OG1 : rot 71:sc= 0.594 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= -0.0127 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -70:sc= 0.0498 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+ 174:sc= 0.789 (180deg=0.745) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.657 -1.574 -0.278 1.00 61.00 N ATOM 136 CA VAL A 13 16.794 -0.400 -0.273 1.00 11.25 C ATOM 137 C VAL A 13 16.785 0.281 -1.636 1.00 41.13 C ATOM 138 O VAL A 13 17.838 0.593 -2.193 1.00 42.33 O ATOM 139 CB VAL A 13 17.238 0.618 0.794 1.00 11.55 C ATOM 140 CG1 VAL A 13 16.312 1.825 0.798 1.00 11.24 C ATOM 141 CG2 VAL A 13 17.282 -0.034 2.167 1.00 22.34 C ATOM 0 HA VAL A 13 15.788 -0.748 -0.037 1.00 11.25 H new ATOM 0 HB VAL A 13 18.243 0.961 0.548 1.00 11.55 H new ATOM 0 HG11 VAL A 13 16.641 2.534 1.558 1.00 11.24 H new ATOM 0 HG12 VAL A 13 16.336 2.305 -0.180 1.00 11.24 H new ATOM 0 HG13 VAL A 13 15.295 1.502 1.019 1.00 11.24 H new ATOM 0 HG21 VAL A 13 17.598 0.700 2.908 1.00 22.34 H new ATOM 0 HG22 VAL A 13 16.291 -0.407 2.425 1.00 22.34 H new ATOM 0 HG23 VAL A 13 17.989 -0.863 2.153 1.00 22.34 H new ATOM 151 N CYS A 14 15.590 0.511 -2.169 1.00 32.23 N ATOM 152 CA CYS A 14 15.442 1.155 -3.469 1.00 50.51 C ATOM 153 C CYS A 14 14.947 2.589 -3.312 1.00 70.42 C ATOM 154 O CYS A 14 14.560 3.005 -2.220 1.00 43.12 O ATOM 155 CB CYS A 14 14.475 0.362 -4.349 1.00 31.25 C ATOM 156 SG CYS A 14 15.172 -1.166 -5.021 1.00 43.54 S ATOM 0 H CYS A 14 14.709 0.261 -1.720 1.00 32.23 H new ATOM 0 HA CYS A 14 16.421 1.178 -3.948 1.00 50.51 H new ATOM 0 HB2 CYS A 14 13.587 0.118 -3.766 1.00 31.25 H new ATOM 0 HB3 CYS A 14 14.150 0.995 -5.175 1.00 31.25 H new ATOM 0 HG CYS A 14 14.469 -2.180 -4.612 1.00 43.54 H new ATOM 162 N GLU A 15 14.963 3.339 -4.410 1.00 33.41 N ATOM 163 CA GLU A 15 14.517 4.727 -4.392 1.00 43.31 C ATOM 164 C GLU A 15 13.045 4.830 -4.781 1.00 40.50 C ATOM 165 O GLU A 15 12.419 3.839 -5.155 1.00 74.01 O ATOM 166 CB GLU A 15 15.367 5.571 -5.343 1.00 24.23 C ATOM 167 CG GLU A 15 16.462 6.361 -4.643 1.00 72.34 C ATOM 168 CD GLU A 15 16.169 7.848 -4.596 1.00 54.23 C ATOM 169 OE1 GLU A 15 15.014 8.216 -4.294 1.00 2.24 O ATOM 170 OE2 GLU A 15 17.095 8.643 -4.862 1.00 32.02 O ATOM 0 H GLU A 15 15.280 3.009 -5.322 1.00 33.41 H new ATOM 0 HA GLU A 15 14.635 5.107 -3.377 1.00 43.31 H new ATOM 0 HB2 GLU A 15 15.822 4.917 -6.088 1.00 24.23 H new ATOM 0 HB3 GLU A 15 14.718 6.263 -5.880 1.00 24.23 H new ATOM 0 HG2 GLU A 15 16.582 5.986 -3.627 1.00 72.34 H new ATOM 0 HG3 GLU A 15 17.409 6.197 -5.158 1.00 72.34 H new ATOM 177 N VAL A 16 12.499 6.039 -4.689 1.00 52.45 N ATOM 178 CA VAL A 16 11.101 6.274 -5.032 1.00 14.11 C ATOM 179 C VAL A 16 10.976 7.000 -6.366 1.00 10.43 C ATOM 180 O VAL A 16 11.092 8.225 -6.431 1.00 15.21 O ATOM 181 CB VAL A 16 10.387 7.097 -3.943 1.00 23.22 C ATOM 182 CG1 VAL A 16 11.081 8.436 -3.743 1.00 61.51 C ATOM 183 CG2 VAL A 16 8.922 7.295 -4.300 1.00 40.14 C ATOM 0 H VAL A 16 13.003 6.870 -4.380 1.00 52.45 H new ATOM 0 HA VAL A 16 10.626 5.296 -5.109 1.00 14.11 H new ATOM 0 HB VAL A 16 10.438 6.545 -3.004 1.00 23.22 H new ATOM 0 HG11 VAL A 16 10.562 9.003 -2.970 1.00 61.51 H new ATOM 0 HG12 VAL A 16 12.114 8.268 -3.438 1.00 61.51 H new ATOM 0 HG13 VAL A 16 11.065 8.997 -4.677 1.00 61.51 H new ATOM 0 HG21 VAL A 16 8.433 7.878 -3.520 1.00 40.14 H new ATOM 0 HG22 VAL A 16 8.847 7.825 -5.250 1.00 40.14 H new ATOM 0 HG23 VAL A 16 8.434 6.324 -4.387 1.00 40.14 H new ATOM 193 N ASP A 17 10.740 6.239 -7.428 1.00 41.10 N ATOM 194 CA ASP A 17 10.598 6.810 -8.762 1.00 44.14 C ATOM 195 C ASP A 17 9.967 8.198 -8.695 1.00 72.23 C ATOM 196 O ASP A 17 9.041 8.448 -7.923 1.00 3.35 O ATOM 197 CB ASP A 17 9.751 5.893 -9.646 1.00 42.41 C ATOM 198 CG ASP A 17 9.905 6.207 -11.121 1.00 23.40 C ATOM 199 OD1 ASP A 17 10.850 5.678 -11.744 1.00 51.50 O ATOM 200 OD2 ASP A 17 9.082 6.981 -11.652 1.00 65.44 O ATOM 0 H ASP A 17 10.643 5.224 -7.391 1.00 41.10 H new ATOM 0 HA ASP A 17 11.593 6.903 -9.198 1.00 44.14 H new ATOM 0 HB2 ASP A 17 10.035 4.856 -9.467 1.00 42.41 H new ATOM 0 HB3 ASP A 17 8.702 5.989 -9.365 1.00 42.41 H new ATOM 205 N PRO A 18 10.480 9.122 -9.523 1.00 35.23 N ATOM 206 CA PRO A 18 9.981 10.499 -9.575 1.00 1.10 C ATOM 207 C PRO A 18 8.585 10.588 -10.181 1.00 53.10 C ATOM 208 O PRO A 18 7.792 11.453 -9.810 1.00 54.35 O ATOM 209 CB PRO A 18 10.998 11.211 -10.470 1.00 64.15 C ATOM 210 CG PRO A 18 11.573 10.132 -11.322 1.00 25.50 C ATOM 211 CD PRO A 18 11.582 8.892 -10.470 1.00 3.33 C ATOM 0 HA PRO A 18 9.887 10.936 -8.581 1.00 1.10 H new ATOM 0 HB2 PRO A 18 10.521 11.982 -11.075 1.00 64.15 H new ATOM 0 HB3 PRO A 18 11.770 11.702 -9.878 1.00 64.15 H new ATOM 0 HG2 PRO A 18 10.974 9.984 -12.221 1.00 25.50 H new ATOM 0 HG3 PRO A 18 12.581 10.388 -11.649 1.00 25.50 H new ATOM 0 HD2 PRO A 18 11.419 7.994 -11.066 1.00 3.33 H new ATOM 0 HD3 PRO A 18 12.534 8.765 -9.955 1.00 3.33 H new ATOM 219 N GLU A 19 8.290 9.686 -11.114 1.00 3.43 N ATOM 220 CA GLU A 19 6.989 9.665 -11.770 1.00 0.11 C ATOM 221 C GLU A 19 5.901 9.200 -10.807 1.00 32.14 C ATOM 222 O GLU A 19 4.731 9.555 -10.956 1.00 34.33 O ATOM 223 CB GLU A 19 7.026 8.748 -12.995 1.00 25.11 C ATOM 224 CG GLU A 19 6.665 7.305 -12.686 1.00 25.34 C ATOM 225 CD GLU A 19 5.258 6.949 -13.125 1.00 24.35 C ATOM 226 OE1 GLU A 19 4.299 7.471 -12.520 1.00 40.25 O ATOM 227 OE2 GLU A 19 5.117 6.147 -14.072 1.00 20.44 O ATOM 0 H GLU A 19 8.934 8.962 -11.431 1.00 3.43 H new ATOM 0 HA GLU A 19 6.756 10.680 -12.091 1.00 0.11 H new ATOM 0 HB2 GLU A 19 6.338 9.133 -13.747 1.00 25.11 H new ATOM 0 HB3 GLU A 19 8.024 8.779 -13.431 1.00 25.11 H new ATOM 0 HG2 GLU A 19 7.375 6.643 -13.182 1.00 25.34 H new ATOM 0 HG3 GLU A 19 6.762 7.132 -11.614 1.00 25.34 H new ATOM 234 N LEU A 20 6.295 8.405 -9.818 1.00 74.13 N ATOM 235 CA LEU A 20 5.353 7.891 -8.829 1.00 25.40 C ATOM 236 C LEU A 20 5.157 8.889 -7.693 1.00 44.20 C ATOM 237 O LEU A 20 4.032 9.142 -7.261 1.00 20.11 O ATOM 238 CB LEU A 20 5.850 6.556 -8.269 1.00 71.24 C ATOM 239 CG LEU A 20 4.776 5.620 -7.714 1.00 4.33 C ATOM 240 CD1 LEU A 20 5.377 4.267 -7.363 1.00 13.52 C ATOM 241 CD2 LEU A 20 4.107 6.240 -6.495 1.00 51.05 C ATOM 0 H LEU A 20 7.259 8.102 -9.679 1.00 74.13 H new ATOM 0 HA LEU A 20 4.393 7.738 -9.323 1.00 25.40 H new ATOM 0 HB2 LEU A 20 6.388 6.031 -9.058 1.00 71.24 H new ATOM 0 HB3 LEU A 20 6.569 6.762 -7.476 1.00 71.24 H new ATOM 0 HG LEU A 20 4.019 5.470 -8.483 1.00 4.33 H new ATOM 0 HD11 LEU A 20 4.598 3.614 -6.970 1.00 13.52 H new ATOM 0 HD12 LEU A 20 5.810 3.818 -8.257 1.00 13.52 H new ATOM 0 HD13 LEU A 20 6.155 4.398 -6.611 1.00 13.52 H new ATOM 0 HD21 LEU A 20 3.345 5.560 -6.113 1.00 51.05 H new ATOM 0 HD22 LEU A 20 4.854 6.419 -5.722 1.00 51.05 H new ATOM 0 HD23 LEU A 20 3.642 7.185 -6.776 1.00 51.05 H new ATOM 253 N LYS A 21 6.260 9.456 -7.214 1.00 30.11 N ATOM 254 CA LYS A 21 6.210 10.430 -6.130 1.00 43.00 C ATOM 255 C LYS A 21 5.000 11.348 -6.278 1.00 63.32 C ATOM 256 O LYS A 21 4.314 11.645 -5.302 1.00 14.34 O ATOM 257 CB LYS A 21 7.495 11.263 -6.106 1.00 35.32 C ATOM 258 CG LYS A 21 7.646 12.110 -4.854 1.00 43.15 C ATOM 259 CD LYS A 21 8.312 13.442 -5.159 1.00 72.14 C ATOM 260 CE LYS A 21 9.791 13.420 -4.809 1.00 24.22 C ATOM 261 NZ LYS A 21 10.239 14.709 -4.214 1.00 42.52 N ATOM 0 H LYS A 21 7.199 9.258 -7.560 1.00 30.11 H new ATOM 0 HA LYS A 21 6.118 9.886 -5.190 1.00 43.00 H new ATOM 0 HB2 LYS A 21 8.353 10.595 -6.189 1.00 35.32 H new ATOM 0 HB3 LYS A 21 7.512 11.914 -6.980 1.00 35.32 H new ATOM 0 HG2 LYS A 21 6.665 12.285 -4.412 1.00 43.15 H new ATOM 0 HG3 LYS A 21 8.236 11.568 -4.116 1.00 43.15 H new ATOM 0 HD2 LYS A 21 8.191 13.676 -6.217 1.00 72.14 H new ATOM 0 HD3 LYS A 21 7.816 14.234 -4.598 1.00 72.14 H new ATOM 0 HE2 LYS A 21 9.986 12.609 -4.107 1.00 24.22 H new ATOM 0 HE3 LYS A 21 10.374 13.212 -5.707 1.00 24.22 H new ATOM 0 HZ1 LYS A 21 11.253 14.654 -3.989 1.00 42.52 H new ATOM 0 HZ2 LYS A 21 10.076 15.480 -4.893 1.00 42.52 H new ATOM 0 HZ3 LYS A 21 9.701 14.895 -3.344 1.00 42.52 H new ATOM 275 N GLU A 22 4.745 11.789 -7.505 1.00 50.01 N ATOM 276 CA GLU A 22 3.617 12.672 -7.779 1.00 41.31 C ATOM 277 C GLU A 22 2.293 11.933 -7.603 1.00 5.21 C ATOM 278 O GLU A 22 1.343 12.465 -7.027 1.00 5.53 O ATOM 279 CB GLU A 22 3.714 13.235 -9.199 1.00 61.44 C ATOM 280 CG GLU A 22 5.135 13.562 -9.628 1.00 75.24 C ATOM 281 CD GLU A 22 5.187 14.622 -10.710 1.00 63.33 C ATOM 282 OE1 GLU A 22 4.536 15.675 -10.540 1.00 65.41 O ATOM 283 OE2 GLU A 22 5.878 14.400 -11.727 1.00 73.43 O ATOM 0 H GLU A 22 5.303 11.550 -8.325 1.00 50.01 H new ATOM 0 HA GLU A 22 3.652 13.496 -7.066 1.00 41.31 H new ATOM 0 HB2 GLU A 22 3.290 12.513 -9.897 1.00 61.44 H new ATOM 0 HB3 GLU A 22 3.107 14.138 -9.265 1.00 61.44 H new ATOM 0 HG2 GLU A 22 5.703 13.903 -8.762 1.00 75.24 H new ATOM 0 HG3 GLU A 22 5.619 12.655 -9.989 1.00 75.24 H new ATOM 290 N THR A 23 2.236 10.703 -8.103 1.00 24.24 N ATOM 291 CA THR A 23 1.031 9.891 -8.003 1.00 55.10 C ATOM 292 C THR A 23 0.489 9.886 -6.578 1.00 30.43 C ATOM 293 O THR A 23 -0.701 10.110 -6.354 1.00 55.12 O ATOM 294 CB THR A 23 1.291 8.440 -8.447 1.00 12.24 C ATOM 295 OG1 THR A 23 1.348 8.367 -9.876 1.00 2.52 O ATOM 296 CG2 THR A 23 0.202 7.512 -7.930 1.00 32.14 C ATOM 0 H THR A 23 3.012 10.247 -8.582 1.00 24.24 H new ATOM 0 HA THR A 23 0.293 10.338 -8.669 1.00 55.10 H new ATOM 0 HB THR A 23 2.246 8.122 -8.029 1.00 12.24 H new ATOM 0 HG1 THR A 23 1.515 7.441 -10.150 1.00 2.52 H new ATOM 0 HG21 THR A 23 0.407 6.493 -8.257 1.00 32.14 H new ATOM 0 HG22 THR A 23 0.181 7.547 -6.841 1.00 32.14 H new ATOM 0 HG23 THR A 23 -0.764 7.831 -8.322 1.00 32.14 H new ATOM 304 N LEU A 24 1.368 9.627 -5.617 1.00 22.14 N ATOM 305 CA LEU A 24 0.978 9.592 -4.211 1.00 54.33 C ATOM 306 C LEU A 24 0.526 10.970 -3.738 1.00 15.23 C ATOM 307 O LEU A 24 -0.562 11.121 -3.182 1.00 24.33 O ATOM 308 CB LEU A 24 2.142 9.101 -3.350 1.00 43.23 C ATOM 309 CG LEU A 24 2.956 7.940 -3.921 1.00 71.44 C ATOM 310 CD1 LEU A 24 4.046 7.520 -2.946 1.00 74.23 C ATOM 311 CD2 LEU A 24 2.048 6.762 -4.248 1.00 12.42 C ATOM 0 H LEU A 24 2.356 9.438 -5.785 1.00 22.14 H new ATOM 0 HA LEU A 24 0.142 8.900 -4.108 1.00 54.33 H new ATOM 0 HB2 LEU A 24 2.816 9.939 -3.174 1.00 43.23 H new ATOM 0 HB3 LEU A 24 1.748 8.799 -2.379 1.00 43.23 H new ATOM 0 HG LEU A 24 3.432 8.274 -4.843 1.00 71.44 H new ATOM 0 HD11 LEU A 24 4.615 6.692 -3.370 1.00 74.23 H new ATOM 0 HD12 LEU A 24 4.713 8.362 -2.762 1.00 74.23 H new ATOM 0 HD13 LEU A 24 3.592 7.204 -2.007 1.00 74.23 H new ATOM 0 HD21 LEU A 24 2.644 5.945 -4.653 1.00 12.42 H new ATOM 0 HD22 LEU A 24 1.544 6.428 -3.341 1.00 12.42 H new ATOM 0 HD23 LEU A 24 1.305 7.069 -4.984 1.00 12.42 H new ATOM 323 N ARG A 25 1.369 11.974 -3.964 1.00 23.13 N ATOM 324 CA ARG A 25 1.056 13.339 -3.560 1.00 42.51 C ATOM 325 C ARG A 25 -0.328 13.749 -4.058 1.00 5.30 C ATOM 326 O ARG A 25 -1.044 14.493 -3.388 1.00 43.25 O ATOM 327 CB ARG A 25 2.111 14.307 -4.099 1.00 55.32 C ATOM 328 CG ARG A 25 1.756 15.771 -3.892 1.00 65.54 C ATOM 329 CD ARG A 25 2.331 16.644 -4.998 1.00 1.04 C ATOM 330 NE ARG A 25 2.960 17.851 -4.469 1.00 64.03 N ATOM 331 CZ ARG A 25 2.286 18.840 -3.894 1.00 52.52 C ATOM 332 NH1 ARG A 25 0.968 18.766 -3.774 1.00 11.41 N ATOM 333 NH2 ARG A 25 2.931 19.907 -3.439 1.00 34.24 N ATOM 0 H ARG A 25 2.273 11.867 -4.424 1.00 23.13 H new ATOM 0 HA ARG A 25 1.058 13.379 -2.471 1.00 42.51 H new ATOM 0 HB2 ARG A 25 3.064 14.101 -3.612 1.00 55.32 H new ATOM 0 HB3 ARG A 25 2.251 14.123 -5.164 1.00 55.32 H new ATOM 0 HG2 ARG A 25 0.672 15.884 -3.864 1.00 65.54 H new ATOM 0 HG3 ARG A 25 2.136 16.106 -2.927 1.00 65.54 H new ATOM 0 HD2 ARG A 25 3.064 16.072 -5.567 1.00 1.04 H new ATOM 0 HD3 ARG A 25 1.537 16.922 -5.690 1.00 1.04 H new ATOM 0 HE ARG A 25 3.973 17.939 -4.545 1.00 64.03 H new ATOM 0 HH11 ARG A 25 0.469 17.948 -4.124 1.00 11.41 H new ATOM 0 HH12 ARG A 25 0.453 19.527 -3.332 1.00 11.41 H new ATOM 0 HH21 ARG A 25 3.945 19.968 -3.531 1.00 34.24 H new ATOM 0 HH22 ARG A 25 2.413 20.666 -2.997 1.00 34.24 H new ATOM 347 N LYS A 26 -0.696 13.259 -5.236 1.00 42.24 N ATOM 348 CA LYS A 26 -1.993 13.572 -5.824 1.00 5.32 C ATOM 349 C LYS A 26 -3.097 12.737 -5.184 1.00 63.45 C ATOM 350 O LYS A 26 -4.194 13.231 -4.930 1.00 34.43 O ATOM 351 CB LYS A 26 -1.964 13.328 -7.335 1.00 61.12 C ATOM 352 CG LYS A 26 -0.680 13.795 -8.002 1.00 33.41 C ATOM 353 CD LYS A 26 -0.949 14.883 -9.026 1.00 52.42 C ATOM 354 CE LYS A 26 0.031 14.809 -10.187 1.00 43.33 C ATOM 355 NZ LYS A 26 -0.667 14.803 -11.503 1.00 65.21 N ATOM 0 H LYS A 26 -0.114 12.643 -5.803 1.00 42.24 H new ATOM 0 HA LYS A 26 -2.204 14.625 -5.637 1.00 5.32 H new ATOM 0 HB2 LYS A 26 -2.096 12.263 -7.525 1.00 61.12 H new ATOM 0 HB3 LYS A 26 -2.809 13.841 -7.794 1.00 61.12 H new ATOM 0 HG2 LYS A 26 0.009 14.169 -7.245 1.00 33.41 H new ATOM 0 HG3 LYS A 26 -0.193 12.950 -8.487 1.00 33.41 H new ATOM 0 HD2 LYS A 26 -1.968 14.787 -9.402 1.00 52.42 H new ATOM 0 HD3 LYS A 26 -0.876 15.860 -8.548 1.00 52.42 H new ATOM 0 HE2 LYS A 26 0.713 15.658 -10.141 1.00 43.33 H new ATOM 0 HE3 LYS A 26 0.637 13.908 -10.093 1.00 43.33 H new ATOM 0 HZ1 LYS A 26 0.035 14.752 -12.268 1.00 65.21 H new ATOM 0 HZ2 LYS A 26 -1.299 13.979 -11.557 1.00 65.21 H new ATOM 0 HZ3 LYS A 26 -1.226 15.674 -11.604 1.00 65.21 H new ATOM 369 N PHE A 27 -2.797 11.467 -4.926 1.00 50.25 N ATOM 370 CA PHE A 27 -3.766 10.563 -4.317 1.00 2.35 C ATOM 371 C PHE A 27 -4.195 11.072 -2.944 1.00 10.10 C ATOM 372 O PHE A 27 -5.352 10.924 -2.549 1.00 11.23 O ATOM 373 CB PHE A 27 -3.172 9.159 -4.189 1.00 71.31 C ATOM 374 CG PHE A 27 -4.199 8.097 -3.912 1.00 22.03 C ATOM 375 CD1 PHE A 27 -5.306 7.954 -4.732 1.00 44.41 C ATOM 376 CD2 PHE A 27 -4.056 7.242 -2.831 1.00 5.54 C ATOM 377 CE1 PHE A 27 -6.252 6.979 -4.481 1.00 70.40 C ATOM 378 CE2 PHE A 27 -4.999 6.265 -2.575 1.00 24.33 C ATOM 379 CZ PHE A 27 -6.098 6.133 -3.400 1.00 3.43 C ATOM 0 H PHE A 27 -1.892 11.042 -5.129 1.00 50.25 H new ATOM 0 HA PHE A 27 -4.644 10.522 -4.961 1.00 2.35 H new ATOM 0 HB2 PHE A 27 -2.644 8.911 -5.110 1.00 71.31 H new ATOM 0 HB3 PHE A 27 -2.433 9.157 -3.387 1.00 71.31 H new ATOM 0 HD1 PHE A 27 -5.431 8.613 -5.578 1.00 44.41 H new ATOM 0 HD2 PHE A 27 -3.199 7.340 -2.182 1.00 5.54 H new ATOM 0 HE1 PHE A 27 -7.110 6.878 -5.129 1.00 70.40 H new ATOM 0 HE2 PHE A 27 -4.876 5.605 -1.729 1.00 24.33 H new ATOM 0 HZ PHE A 27 -6.836 5.370 -3.201 1.00 3.43 H new ATOM 389 N ARG A 28 -3.255 11.672 -2.221 1.00 14.53 N ATOM 390 CA ARG A 28 -3.535 12.202 -0.892 1.00 33.32 C ATOM 391 C ARG A 28 -4.346 13.491 -0.980 1.00 44.32 C ATOM 392 O ARG A 28 -5.041 13.866 -0.035 1.00 60.51 O ATOM 393 CB ARG A 28 -2.230 12.459 -0.136 1.00 40.21 C ATOM 394 CG ARG A 28 -1.159 11.413 -0.399 1.00 21.11 C ATOM 395 CD ARG A 28 -0.444 11.013 0.883 1.00 50.52 C ATOM 396 NE ARG A 28 0.145 12.164 1.563 1.00 71.43 N ATOM 397 CZ ARG A 28 -0.436 12.796 2.576 1.00 5.45 C ATOM 398 NH1 ARG A 28 -1.616 12.392 3.026 1.00 64.02 N ATOM 399 NH2 ARG A 28 0.164 13.836 3.142 1.00 32.14 N ATOM 0 H ARG A 28 -2.293 11.803 -2.533 1.00 14.53 H new ATOM 0 HA ARG A 28 -4.121 11.460 -0.349 1.00 33.32 H new ATOM 0 HB2 ARG A 28 -1.845 13.440 -0.416 1.00 40.21 H new ATOM 0 HB3 ARG A 28 -2.439 12.492 0.933 1.00 40.21 H new ATOM 0 HG2 ARG A 28 -1.613 10.532 -0.854 1.00 21.11 H new ATOM 0 HG3 ARG A 28 -0.435 11.804 -1.114 1.00 21.11 H new ATOM 0 HD2 ARG A 28 -1.148 10.518 1.552 1.00 50.52 H new ATOM 0 HD3 ARG A 28 0.338 10.290 0.652 1.00 50.52 H new ATOM 0 HE ARG A 28 1.053 12.501 1.242 1.00 71.43 H new ATOM 0 HH11 ARG A 28 -2.080 11.593 2.594 1.00 64.02 H new ATOM 0 HH12 ARG A 28 -2.059 12.880 3.804 1.00 64.02 H new ATOM 0 HH21 ARG A 28 1.072 14.150 2.799 1.00 32.14 H new ATOM 0 HH22 ARG A 28 -0.283 14.321 3.920 1.00 32.14 H new ATOM 413 N PHE A 29 -4.250 14.167 -2.120 1.00 54.02 N ATOM 414 CA PHE A 29 -4.974 15.415 -2.332 1.00 60.31 C ATOM 415 C PHE A 29 -5.682 15.411 -3.684 1.00 10.12 C ATOM 416 O PHE A 29 -5.702 16.420 -4.389 1.00 4.24 O ATOM 417 CB PHE A 29 -4.016 16.605 -2.248 1.00 34.20 C ATOM 418 CG PHE A 29 -2.808 16.343 -1.396 1.00 32.15 C ATOM 419 CD1 PHE A 29 -2.948 15.924 -0.082 1.00 13.02 C ATOM 420 CD2 PHE A 29 -1.532 16.516 -1.907 1.00 24.34 C ATOM 421 CE1 PHE A 29 -1.838 15.681 0.706 1.00 52.24 C ATOM 422 CE2 PHE A 29 -0.419 16.275 -1.124 1.00 61.10 C ATOM 423 CZ PHE A 29 -0.572 15.858 0.184 1.00 42.40 C ATOM 0 H PHE A 29 -3.678 13.872 -2.911 1.00 54.02 H new ATOM 0 HA PHE A 29 -5.726 15.507 -1.549 1.00 60.31 H new ATOM 0 HB2 PHE A 29 -3.691 16.871 -3.254 1.00 34.20 H new ATOM 0 HB3 PHE A 29 -4.553 17.466 -1.849 1.00 34.20 H new ATOM 0 HD1 PHE A 29 -3.936 15.786 0.331 1.00 13.02 H new ATOM 0 HD2 PHE A 29 -1.406 16.843 -2.929 1.00 24.34 H new ATOM 0 HE1 PHE A 29 -1.961 15.353 1.728 1.00 52.24 H new ATOM 0 HE2 PHE A 29 0.570 16.413 -1.535 1.00 61.10 H new ATOM 0 HZ PHE A 29 0.297 15.671 0.797 1.00 42.40 H new ATOM 433 N ARG A 30 -6.261 14.269 -4.039 1.00 44.23 N ATOM 434 CA ARG A 30 -6.968 14.133 -5.307 1.00 24.10 C ATOM 435 C ARG A 30 -8.331 14.815 -5.245 1.00 42.44 C ATOM 436 O ARG A 30 -8.756 15.284 -4.190 1.00 13.23 O ATOM 437 CB ARG A 30 -7.141 12.655 -5.662 1.00 44.13 C ATOM 438 CG ARG A 30 -7.941 11.871 -4.634 1.00 23.22 C ATOM 439 CD ARG A 30 -7.520 10.411 -4.596 1.00 63.40 C ATOM 440 NE ARG A 30 -8.630 9.512 -4.901 1.00 20.13 N ATOM 441 CZ ARG A 30 -9.562 9.169 -4.017 1.00 65.14 C ATOM 442 NH1 ARG A 30 -9.517 9.648 -2.782 1.00 24.41 N ATOM 443 NH2 ARG A 30 -10.541 8.347 -4.371 1.00 31.23 N ATOM 0 H ARG A 30 -6.255 13.425 -3.467 1.00 44.23 H new ATOM 0 HA ARG A 30 -6.373 14.619 -6.080 1.00 24.10 H new ATOM 0 HB2 ARG A 30 -7.636 12.578 -6.630 1.00 44.13 H new ATOM 0 HB3 ARG A 30 -6.157 12.198 -5.769 1.00 44.13 H new ATOM 0 HG2 ARG A 30 -7.804 12.316 -3.648 1.00 23.22 H new ATOM 0 HG3 ARG A 30 -9.003 11.938 -4.869 1.00 23.22 H new ATOM 0 HD2 ARG A 30 -6.714 10.248 -5.312 1.00 63.40 H new ATOM 0 HD3 ARG A 30 -7.123 10.174 -3.609 1.00 63.40 H new ATOM 0 HE ARG A 30 -8.694 9.126 -5.843 1.00 20.13 H new ATOM 0 HH11 ARG A 30 -8.766 10.281 -2.508 1.00 24.41 H new ATOM 0 HH12 ARG A 30 -10.233 9.383 -2.106 1.00 24.41 H new ATOM 0 HH21 ARG A 30 -10.579 7.978 -5.321 1.00 31.23 H new ATOM 0 HH22 ARG A 30 -11.256 8.084 -3.693 1.00 31.23 H new ATOM 508 N ASN A 34 -14.544 8.920 -3.464 1.00 60.44 N ATOM 509 CA ASN A 34 -14.842 7.501 -3.309 1.00 30.54 C ATOM 510 C ASN A 34 -13.597 6.727 -2.886 1.00 43.24 C ATOM 511 O ASN A 34 -12.533 7.308 -2.680 1.00 5.23 O ATOM 512 CB ASN A 34 -15.395 6.927 -4.615 1.00 51.31 C ATOM 513 CG ASN A 34 -14.573 7.341 -5.821 1.00 30.31 C ATOM 514 OD1 ASN A 34 -14.551 8.512 -6.199 1.00 74.02 O ATOM 515 ND2 ASN A 34 -13.893 6.378 -6.431 1.00 24.22 N ATOM 0 HA ASN A 34 -15.596 7.397 -2.528 1.00 30.54 H new ATOM 0 HB2 ASN A 34 -15.418 5.839 -4.550 1.00 51.31 H new ATOM 0 HB3 ASN A 34 -16.424 7.260 -4.748 1.00 51.31 H new ATOM 0 HD21 ASN A 34 -13.323 6.595 -7.248 1.00 24.22 H new ATOM 0 HD22 ASN A 34 -13.941 5.421 -6.083 1.00 24.22 H new ATOM 522 N ASN A 35 -13.738 5.412 -2.763 1.00 20.42 N ATOM 523 CA ASN A 35 -12.625 4.557 -2.366 1.00 61.10 C ATOM 524 C ASN A 35 -11.774 4.176 -3.574 1.00 14.12 C ATOM 525 O ASN A 35 -12.300 3.830 -4.632 1.00 11.21 O ATOM 526 CB ASN A 35 -13.145 3.295 -1.675 1.00 64.21 C ATOM 527 CG ASN A 35 -13.654 3.570 -0.273 1.00 65.53 C ATOM 528 OD1 ASN A 35 -13.597 4.702 0.207 1.00 14.15 O ATOM 529 ND2 ASN A 35 -14.153 2.533 0.389 1.00 31.54 N ATOM 0 H ASN A 35 -14.612 4.915 -2.932 1.00 20.42 H new ATOM 0 HA ASN A 35 -12.002 5.115 -1.667 1.00 61.10 H new ATOM 0 HB2 ASN A 35 -13.948 2.862 -2.272 1.00 64.21 H new ATOM 0 HB3 ASN A 35 -12.347 2.554 -1.630 1.00 64.21 H new ATOM 0 HD21 ASN A 35 -14.510 2.657 1.337 1.00 31.54 H new ATOM 0 HD22 ASN A 35 -14.180 1.613 -0.050 1.00 31.54 H new ATOM 536 N ALA A 36 -10.458 4.241 -3.407 1.00 2.03 N ATOM 537 CA ALA A 36 -9.534 3.900 -4.482 1.00 2.13 C ATOM 538 C ALA A 36 -8.252 3.286 -3.930 1.00 44.33 C ATOM 539 O ALA A 36 -7.947 3.421 -2.745 1.00 74.24 O ATOM 540 CB ALA A 36 -9.215 5.133 -5.315 1.00 72.40 C ATOM 0 H ALA A 36 -10.007 4.527 -2.538 1.00 2.03 H new ATOM 0 HA ALA A 36 -10.015 3.159 -5.120 1.00 2.13 H new ATOM 0 HB1 ALA A 36 -8.524 4.864 -6.114 1.00 72.40 H new ATOM 0 HB2 ALA A 36 -10.134 5.527 -5.748 1.00 72.40 H new ATOM 0 HB3 ALA A 36 -8.758 5.892 -4.681 1.00 72.40 H new ATOM 546 N ALA A 37 -7.503 2.611 -4.797 1.00 53.41 N ATOM 547 CA ALA A 37 -6.254 1.977 -4.396 1.00 50.24 C ATOM 548 C ALA A 37 -5.162 2.213 -5.435 1.00 21.22 C ATOM 549 O ALA A 37 -5.449 2.490 -6.599 1.00 42.32 O ATOM 550 CB ALA A 37 -6.464 0.487 -4.177 1.00 31.20 C ATOM 0 H ALA A 37 -7.740 2.490 -5.782 1.00 53.41 H new ATOM 0 HA ALA A 37 -5.931 2.428 -3.458 1.00 50.24 H new ATOM 0 HB1 ALA A 37 -5.522 0.027 -3.878 1.00 31.20 H new ATOM 0 HB2 ALA A 37 -7.207 0.335 -3.394 1.00 31.20 H new ATOM 0 HB3 ALA A 37 -6.814 0.029 -5.102 1.00 31.20 H new ATOM 556 N ILE A 38 -3.910 2.101 -5.004 1.00 64.44 N ATOM 557 CA ILE A 38 -2.775 2.301 -5.897 1.00 53.11 C ATOM 558 C ILE A 38 -1.687 1.263 -5.646 1.00 33.34 C ATOM 559 O ILE A 38 -1.068 1.242 -4.581 1.00 15.32 O ATOM 560 CB ILE A 38 -2.172 3.709 -5.736 1.00 1.31 C ATOM 561 CG1 ILE A 38 -3.280 4.765 -5.738 1.00 10.20 C ATOM 562 CG2 ILE A 38 -1.167 3.986 -6.843 1.00 62.25 C ATOM 563 CD1 ILE A 38 -2.761 6.185 -5.788 1.00 22.12 C ATOM 0 H ILE A 38 -3.656 1.873 -4.043 1.00 64.44 H new ATOM 0 HA ILE A 38 -3.152 2.190 -6.914 1.00 53.11 H new ATOM 0 HB ILE A 38 -1.651 3.757 -4.780 1.00 1.31 H new ATOM 0 HG12 ILE A 38 -3.932 4.595 -6.595 1.00 10.20 H new ATOM 0 HG13 ILE A 38 -3.891 4.641 -4.844 1.00 10.20 H new ATOM 0 HG21 ILE A 38 -0.750 4.985 -6.715 1.00 62.25 H new ATOM 0 HG22 ILE A 38 -0.365 3.250 -6.799 1.00 62.25 H new ATOM 0 HG23 ILE A 38 -1.665 3.922 -7.811 1.00 62.25 H new ATOM 0 HD11 ILE A 38 -3.601 6.880 -5.787 1.00 22.12 H new ATOM 0 HD12 ILE A 38 -2.133 6.374 -4.917 1.00 22.12 H new ATOM 0 HD13 ILE A 38 -2.175 6.326 -6.696 1.00 22.12 H new ATOM 575 N ILE A 39 -1.457 0.403 -6.632 1.00 55.10 N ATOM 576 CA ILE A 39 -0.442 -0.637 -6.518 1.00 41.31 C ATOM 577 C ILE A 39 0.870 -0.196 -7.160 1.00 64.32 C ATOM 578 O ILE A 39 0.926 0.073 -8.359 1.00 62.34 O ATOM 579 CB ILE A 39 -0.905 -1.951 -7.174 1.00 42.41 C ATOM 580 CG1 ILE A 39 -2.243 -2.397 -6.582 1.00 71.11 C ATOM 581 CG2 ILE A 39 0.149 -3.033 -6.993 1.00 42.11 C ATOM 582 CD1 ILE A 39 -3.220 -2.909 -7.616 1.00 54.34 C ATOM 0 H ILE A 39 -1.960 0.406 -7.519 1.00 55.10 H new ATOM 0 HA ILE A 39 -0.284 -0.809 -5.453 1.00 41.31 H new ATOM 0 HB ILE A 39 -1.041 -1.780 -8.242 1.00 42.41 H new ATOM 0 HG12 ILE A 39 -2.062 -3.180 -5.846 1.00 71.11 H new ATOM 0 HG13 ILE A 39 -2.694 -1.558 -6.052 1.00 71.11 H new ATOM 0 HG21 ILE A 39 -0.193 -3.956 -7.462 1.00 42.11 H new ATOM 0 HG22 ILE A 39 1.082 -2.714 -7.458 1.00 42.11 H new ATOM 0 HG23 ILE A 39 0.314 -3.206 -5.930 1.00 42.11 H new ATOM 0 HD11 ILE A 39 -4.146 -3.207 -7.125 1.00 54.34 H new ATOM 0 HD12 ILE A 39 -3.430 -2.121 -8.339 1.00 54.34 H new ATOM 0 HD13 ILE A 39 -2.789 -3.768 -8.130 1.00 54.34 H new ATOM 594 N MET A 40 1.923 -0.126 -6.352 1.00 41.24 N ATOM 595 CA MET A 40 3.235 0.280 -6.841 1.00 62.15 C ATOM 596 C MET A 40 4.233 -0.870 -6.738 1.00 63.44 C ATOM 597 O MET A 40 4.248 -1.605 -5.751 1.00 62.30 O ATOM 598 CB MET A 40 3.748 1.486 -6.054 1.00 51.20 C ATOM 599 CG MET A 40 2.705 2.577 -5.866 1.00 30.52 C ATOM 600 SD MET A 40 2.738 3.291 -4.211 1.00 21.13 S ATOM 601 CE MET A 40 1.341 2.461 -3.455 1.00 43.25 C ATOM 0 H MET A 40 1.893 -0.345 -5.356 1.00 41.24 H new ATOM 0 HA MET A 40 3.133 0.558 -7.890 1.00 62.15 H new ATOM 0 HB2 MET A 40 4.092 1.151 -5.075 1.00 51.20 H new ATOM 0 HB3 MET A 40 4.612 1.905 -6.570 1.00 51.20 H new ATOM 0 HG2 MET A 40 2.872 3.365 -6.601 1.00 30.52 H new ATOM 0 HG3 MET A 40 1.715 2.165 -6.060 1.00 30.52 H new ATOM 0 HE1 MET A 40 1.502 2.384 -2.380 1.00 43.25 H new ATOM 0 HE2 MET A 40 0.432 3.031 -3.646 1.00 43.25 H new ATOM 0 HE3 MET A 40 1.238 1.462 -3.879 1.00 43.25 H new ATOM 611 N LYS A 41 5.064 -1.020 -7.765 1.00 1.23 N ATOM 612 CA LYS A 41 6.065 -2.079 -7.790 1.00 22.52 C ATOM 613 C LYS A 41 7.475 -1.497 -7.748 1.00 41.14 C ATOM 614 O LYS A 41 7.655 -0.280 -7.746 1.00 54.45 O ATOM 615 CB LYS A 41 5.895 -2.942 -9.042 1.00 52.30 C ATOM 616 CG LYS A 41 6.301 -2.237 -10.326 1.00 2.03 C ATOM 617 CD LYS A 41 6.315 -3.194 -11.506 1.00 63.13 C ATOM 618 CE LYS A 41 5.479 -2.666 -12.661 1.00 12.40 C ATOM 619 NZ LYS A 41 6.003 -3.118 -13.979 1.00 74.52 N ATOM 0 H LYS A 41 5.063 -0.421 -8.591 1.00 1.23 H new ATOM 0 HA LYS A 41 5.921 -2.701 -6.906 1.00 22.52 H new ATOM 0 HB2 LYS A 41 6.489 -3.849 -8.932 1.00 52.30 H new ATOM 0 HB3 LYS A 41 4.853 -3.252 -9.121 1.00 52.30 H new ATOM 0 HG2 LYS A 41 5.609 -1.419 -10.528 1.00 2.03 H new ATOM 0 HG3 LYS A 41 7.290 -1.795 -10.203 1.00 2.03 H new ATOM 0 HD2 LYS A 41 7.341 -3.348 -11.839 1.00 63.13 H new ATOM 0 HD3 LYS A 41 5.932 -4.165 -11.193 1.00 63.13 H new ATOM 0 HE2 LYS A 41 4.448 -3.001 -12.546 1.00 12.40 H new ATOM 0 HE3 LYS A 41 5.465 -1.577 -12.630 1.00 12.40 H new ATOM 0 HZ1 LYS A 41 5.405 -2.736 -14.740 1.00 74.52 H new ATOM 0 HZ2 LYS A 41 6.978 -2.777 -14.101 1.00 74.52 H new ATOM 0 HZ3 LYS A 41 5.993 -4.157 -14.019 1.00 74.52 H new ATOM 633 N VAL A 42 8.472 -2.375 -7.718 1.00 21.44 N ATOM 634 CA VAL A 42 9.866 -1.948 -7.680 1.00 11.24 C ATOM 635 C VAL A 42 10.702 -2.709 -8.702 1.00 64.20 C ATOM 636 O VAL A 42 10.998 -3.890 -8.522 1.00 34.12 O ATOM 637 CB VAL A 42 10.477 -2.150 -6.280 1.00 24.24 C ATOM 638 CG1 VAL A 42 10.037 -3.482 -5.692 1.00 35.51 C ATOM 639 CG2 VAL A 42 11.994 -2.062 -6.344 1.00 23.01 C ATOM 0 H VAL A 42 8.341 -3.387 -7.719 1.00 21.44 H new ATOM 0 HA VAL A 42 9.878 -0.886 -7.924 1.00 11.24 H new ATOM 0 HB VAL A 42 10.116 -1.355 -5.627 1.00 24.24 H new ATOM 0 HG11 VAL A 42 10.478 -3.607 -4.703 1.00 35.51 H new ATOM 0 HG12 VAL A 42 8.950 -3.502 -5.609 1.00 35.51 H new ATOM 0 HG13 VAL A 42 10.366 -4.293 -6.341 1.00 35.51 H new ATOM 0 HG21 VAL A 42 12.409 -2.207 -5.347 1.00 23.01 H new ATOM 0 HG22 VAL A 42 12.375 -2.835 -7.012 1.00 23.01 H new ATOM 0 HG23 VAL A 42 12.286 -1.081 -6.720 1.00 23.01 H new ATOM 649 N ASP A 43 11.081 -2.024 -9.775 1.00 64.22 N ATOM 650 CA ASP A 43 11.886 -2.635 -10.827 1.00 14.40 C ATOM 651 C ASP A 43 13.294 -2.941 -10.326 1.00 14.31 C ATOM 652 O ASP A 43 14.066 -2.032 -10.020 1.00 11.31 O ATOM 653 CB ASP A 43 11.952 -1.715 -12.047 1.00 2.42 C ATOM 654 CG ASP A 43 10.686 -1.763 -12.879 1.00 5.41 C ATOM 655 OD1 ASP A 43 9.638 -2.177 -12.342 1.00 24.55 O ATOM 656 OD2 ASP A 43 10.744 -1.387 -14.069 1.00 12.55 O ATOM 0 H ASP A 43 10.844 -1.046 -9.940 1.00 64.22 H new ATOM 0 HA ASP A 43 11.412 -3.573 -11.115 1.00 14.40 H new ATOM 0 HB2 ASP A 43 12.127 -0.691 -11.717 1.00 2.42 H new ATOM 0 HB3 ASP A 43 12.802 -2.000 -12.667 1.00 2.42 H new ATOM 661 N LYS A 44 13.621 -4.226 -10.245 1.00 41.42 N ATOM 662 CA LYS A 44 14.937 -4.652 -9.781 1.00 72.44 C ATOM 663 C LYS A 44 16.038 -4.075 -10.665 1.00 4.21 C ATOM 664 O LYS A 44 17.126 -3.753 -10.186 1.00 30.51 O ATOM 665 CB LYS A 44 15.025 -6.180 -9.771 1.00 74.21 C ATOM 666 CG LYS A 44 16.349 -6.708 -9.247 1.00 71.31 C ATOM 667 CD LYS A 44 16.314 -8.217 -9.066 1.00 23.11 C ATOM 668 CE LYS A 44 17.137 -8.653 -7.863 1.00 32.43 C ATOM 669 NZ LYS A 44 18.463 -9.198 -8.265 1.00 45.41 N ATOM 0 H LYS A 44 12.994 -4.991 -10.494 1.00 41.42 H new ATOM 0 HA LYS A 44 15.077 -4.279 -8.767 1.00 72.44 H new ATOM 0 HB2 LYS A 44 14.216 -6.578 -9.158 1.00 74.21 H new ATOM 0 HB3 LYS A 44 14.870 -6.551 -10.784 1.00 74.21 H new ATOM 0 HG2 LYS A 44 17.148 -6.442 -9.939 1.00 71.31 H new ATOM 0 HG3 LYS A 44 16.581 -6.231 -8.295 1.00 71.31 H new ATOM 0 HD2 LYS A 44 15.282 -8.546 -8.941 1.00 23.11 H new ATOM 0 HD3 LYS A 44 16.696 -8.701 -9.965 1.00 23.11 H new ATOM 0 HE2 LYS A 44 17.281 -7.804 -7.195 1.00 32.43 H new ATOM 0 HE3 LYS A 44 16.588 -9.410 -7.303 1.00 32.43 H new ATOM 0 HZ1 LYS A 44 18.993 -9.484 -7.417 1.00 45.41 H new ATOM 0 HZ2 LYS A 44 18.326 -10.024 -8.882 1.00 45.41 H new ATOM 0 HZ3 LYS A 44 18.998 -8.468 -8.777 1.00 45.41 H new ATOM 683 N ASP A 45 15.749 -3.946 -11.955 1.00 3.53 N ATOM 684 CA ASP A 45 16.714 -3.404 -12.904 1.00 30.31 C ATOM 685 C ASP A 45 17.032 -1.947 -12.586 1.00 11.43 C ATOM 686 O ASP A 45 18.162 -1.493 -12.766 1.00 24.11 O ATOM 687 CB ASP A 45 16.179 -3.522 -14.332 1.00 12.32 C ATOM 688 CG ASP A 45 16.801 -4.678 -15.090 1.00 72.32 C ATOM 689 OD1 ASP A 45 17.224 -5.656 -14.438 1.00 70.11 O ATOM 690 OD2 ASP A 45 16.864 -4.606 -16.335 1.00 51.40 O ATOM 0 H ASP A 45 14.854 -4.209 -12.368 1.00 3.53 H new ATOM 0 HA ASP A 45 17.633 -3.984 -12.819 1.00 30.31 H new ATOM 0 HB2 ASP A 45 15.097 -3.651 -14.302 1.00 12.32 H new ATOM 0 HB3 ASP A 45 16.374 -2.593 -14.868 1.00 12.32 H new ATOM 695 N ARG A 46 16.026 -1.217 -12.113 1.00 63.40 N ATOM 696 CA ARG A 46 16.197 0.190 -11.772 1.00 4.34 C ATOM 697 C ARG A 46 16.235 0.382 -10.258 1.00 62.23 C ATOM 698 O ARG A 46 16.301 1.508 -9.768 1.00 41.40 O ATOM 699 CB ARG A 46 15.066 1.024 -12.374 1.00 51.33 C ATOM 700 CG ARG A 46 14.892 0.825 -13.871 1.00 20.03 C ATOM 701 CD ARG A 46 13.662 1.553 -14.391 1.00 64.42 C ATOM 702 NE ARG A 46 13.957 2.937 -14.751 1.00 40.43 N ATOM 703 CZ ARG A 46 13.147 3.695 -15.481 1.00 54.42 C ATOM 704 NH1 ARG A 46 11.997 3.206 -15.925 1.00 71.41 N ATOM 705 NH2 ARG A 46 13.484 4.946 -15.767 1.00 65.41 N ATOM 0 H ARG A 46 15.084 -1.577 -11.957 1.00 63.40 H new ATOM 0 HA ARG A 46 17.147 0.525 -12.188 1.00 4.34 H new ATOM 0 HB2 ARG A 46 14.132 0.771 -11.872 1.00 51.33 H new ATOM 0 HB3 ARG A 46 15.259 2.078 -12.176 1.00 51.33 H new ATOM 0 HG2 ARG A 46 15.778 1.187 -14.393 1.00 20.03 H new ATOM 0 HG3 ARG A 46 14.806 -0.239 -14.090 1.00 20.03 H new ATOM 0 HD2 ARG A 46 13.271 1.027 -15.262 1.00 64.42 H new ATOM 0 HD3 ARG A 46 12.881 1.535 -13.631 1.00 64.42 H new ATOM 0 HE ARG A 46 14.833 3.344 -14.424 1.00 40.43 H new ATOM 0 HH11 ARG A 46 11.733 2.245 -15.706 1.00 71.41 H new ATOM 0 HH12 ARG A 46 11.377 3.790 -16.485 1.00 71.41 H new ATOM 0 HH21 ARG A 46 14.367 5.327 -15.426 1.00 65.41 H new ATOM 0 HH22 ARG A 46 12.861 5.527 -16.328 1.00 65.41 H new ATOM 719 N GLN A 47 16.192 -0.727 -9.526 1.00 0.33 N ATOM 720 CA GLN A 47 16.220 -0.680 -8.068 1.00 54.52 C ATOM 721 C GLN A 47 15.440 0.522 -7.548 1.00 14.54 C ATOM 722 O GLN A 47 15.894 1.227 -6.646 1.00 62.42 O ATOM 723 CB GLN A 47 17.663 -0.622 -7.566 1.00 44.53 C ATOM 724 CG GLN A 47 18.581 -1.633 -8.235 1.00 41.50 C ATOM 725 CD GLN A 47 18.982 -2.761 -7.305 1.00 73.42 C ATOM 726 OE1 GLN A 47 19.960 -2.653 -6.565 1.00 32.13 O ATOM 727 NE2 GLN A 47 18.226 -3.853 -7.339 1.00 63.13 N ATOM 0 H GLN A 47 16.138 -1.667 -9.917 1.00 0.33 H new ATOM 0 HA GLN A 47 15.748 -1.587 -7.691 1.00 54.52 H new ATOM 0 HB2 GLN A 47 18.057 0.380 -7.733 1.00 44.53 H new ATOM 0 HB3 GLN A 47 17.672 -0.793 -6.489 1.00 44.53 H new ATOM 0 HG2 GLN A 47 18.081 -2.049 -9.110 1.00 41.50 H new ATOM 0 HG3 GLN A 47 19.477 -1.125 -8.591 1.00 41.50 H new ATOM 0 HE21 GLN A 47 17.424 -3.899 -7.968 1.00 63.13 H new ATOM 0 HE22 GLN A 47 18.447 -4.645 -6.736 1.00 63.13 H new ATOM 736 N MET A 48 14.262 0.752 -8.120 1.00 61.44 N ATOM 737 CA MET A 48 13.418 1.868 -7.713 1.00 43.31 C ATOM 738 C MET A 48 11.948 1.462 -7.698 1.00 41.52 C ATOM 739 O MET A 48 11.550 0.510 -8.370 1.00 4.11 O ATOM 740 CB MET A 48 13.622 3.059 -8.653 1.00 74.43 C ATOM 741 CG MET A 48 12.591 3.134 -9.769 1.00 2.33 C ATOM 742 SD MET A 48 13.294 3.714 -11.325 1.00 25.24 S ATOM 743 CE MET A 48 13.758 5.387 -10.885 1.00 35.12 C ATOM 0 H MET A 48 13.871 0.179 -8.868 1.00 61.44 H new ATOM 0 HA MET A 48 13.706 2.159 -6.703 1.00 43.31 H new ATOM 0 HB2 MET A 48 13.585 3.981 -8.072 1.00 74.43 H new ATOM 0 HB3 MET A 48 14.618 2.999 -9.092 1.00 74.43 H new ATOM 0 HG2 MET A 48 12.151 2.148 -9.919 1.00 2.33 H new ATOM 0 HG3 MET A 48 11.783 3.801 -9.468 1.00 2.33 H new ATOM 0 HE1 MET A 48 13.342 6.083 -11.613 1.00 35.12 H new ATOM 0 HE2 MET A 48 13.370 5.623 -9.894 1.00 35.12 H new ATOM 0 HE3 MET A 48 14.845 5.474 -10.880 1.00 35.12 H new ATOM 753 N VAL A 49 11.145 2.190 -6.929 1.00 5.23 N ATOM 754 CA VAL A 49 9.718 1.905 -6.827 1.00 45.23 C ATOM 755 C VAL A 49 8.928 2.682 -7.873 1.00 72.24 C ATOM 756 O VAL A 49 8.867 3.910 -7.836 1.00 52.41 O ATOM 757 CB VAL A 49 9.175 2.251 -5.428 1.00 42.33 C ATOM 758 CG1 VAL A 49 7.712 1.855 -5.311 1.00 13.51 C ATOM 759 CG2 VAL A 49 10.007 1.573 -4.351 1.00 25.54 C ATOM 0 H VAL A 49 11.458 2.982 -6.367 1.00 5.23 H new ATOM 0 HA VAL A 49 9.595 0.836 -7.002 1.00 45.23 H new ATOM 0 HB VAL A 49 9.248 3.329 -5.285 1.00 42.33 H new ATOM 0 HG11 VAL A 49 7.345 2.107 -4.316 1.00 13.51 H new ATOM 0 HG12 VAL A 49 7.129 2.392 -6.059 1.00 13.51 H new ATOM 0 HG13 VAL A 49 7.611 0.782 -5.474 1.00 13.51 H new ATOM 0 HG21 VAL A 49 9.609 1.829 -3.369 1.00 25.54 H new ATOM 0 HG22 VAL A 49 9.969 0.492 -4.488 1.00 25.54 H new ATOM 0 HG23 VAL A 49 11.041 1.911 -4.423 1.00 25.54 H new ATOM 769 N VAL A 50 8.322 1.956 -8.808 1.00 42.23 N ATOM 770 CA VAL A 50 7.533 2.576 -9.866 1.00 10.51 C ATOM 771 C VAL A 50 6.094 2.070 -9.846 1.00 44.22 C ATOM 772 O VAL A 50 5.844 0.888 -9.609 1.00 75.44 O ATOM 773 CB VAL A 50 8.142 2.305 -11.254 1.00 2.03 C ATOM 774 CG1 VAL A 50 9.526 2.928 -11.360 1.00 51.12 C ATOM 775 CG2 VAL A 50 8.198 0.810 -11.528 1.00 2.25 C ATOM 0 H VAL A 50 8.363 0.938 -8.854 1.00 42.23 H new ATOM 0 HA VAL A 50 7.541 3.650 -9.679 1.00 10.51 H new ATOM 0 HB VAL A 50 7.504 2.765 -12.009 1.00 2.03 H new ATOM 0 HG11 VAL A 50 9.941 2.726 -12.348 1.00 51.12 H new ATOM 0 HG12 VAL A 50 9.453 4.005 -11.210 1.00 51.12 H new ATOM 0 HG13 VAL A 50 10.177 2.499 -10.598 1.00 51.12 H new ATOM 0 HG21 VAL A 50 8.631 0.637 -12.513 1.00 2.25 H new ATOM 0 HG22 VAL A 50 8.813 0.324 -10.771 1.00 2.25 H new ATOM 0 HG23 VAL A 50 7.190 0.396 -11.497 1.00 2.25 H new ATOM 785 N LEU A 51 5.153 2.973 -10.097 1.00 52.13 N ATOM 786 CA LEU A 51 3.738 2.619 -10.110 1.00 72.14 C ATOM 787 C LEU A 51 3.502 1.344 -10.915 1.00 2.23 C ATOM 788 O LEU A 51 4.234 1.053 -11.861 1.00 34.20 O ATOM 789 CB LEU A 51 2.910 3.765 -10.695 1.00 33.25 C ATOM 790 CG LEU A 51 1.394 3.563 -10.699 1.00 2.13 C ATOM 791 CD1 LEU A 51 0.762 4.241 -9.493 1.00 25.11 C ATOM 792 CD2 LEU A 51 0.789 4.096 -11.990 1.00 61.23 C ATOM 0 H LEU A 51 5.344 3.955 -10.294 1.00 52.13 H new ATOM 0 HA LEU A 51 3.425 2.441 -9.081 1.00 72.14 H new ATOM 0 HB2 LEU A 51 3.134 4.672 -10.134 1.00 33.25 H new ATOM 0 HB3 LEU A 51 3.237 3.936 -11.721 1.00 33.25 H new ATOM 0 HG LEU A 51 1.189 2.494 -10.638 1.00 2.13 H new ATOM 0 HD11 LEU A 51 -0.317 4.087 -9.513 1.00 25.11 H new ATOM 0 HD12 LEU A 51 1.173 3.814 -8.578 1.00 25.11 H new ATOM 0 HD13 LEU A 51 0.976 5.309 -9.522 1.00 25.11 H new ATOM 0 HD21 LEU A 51 -0.290 3.944 -11.976 1.00 61.23 H new ATOM 0 HD22 LEU A 51 1.004 5.161 -12.080 1.00 61.23 H new ATOM 0 HD23 LEU A 51 1.219 3.565 -12.840 1.00 61.23 H new ATOM 804 N GLU A 52 2.476 0.590 -10.533 1.00 51.13 N ATOM 805 CA GLU A 52 2.144 -0.652 -11.220 1.00 50.24 C ATOM 806 C GLU A 52 0.730 -0.599 -11.789 1.00 55.11 C ATOM 807 O GLU A 52 0.506 -0.912 -12.959 1.00 10.35 O ATOM 808 CB GLU A 52 2.278 -1.840 -10.266 1.00 71.50 C ATOM 809 CG GLU A 52 2.015 -3.184 -10.926 1.00 32.11 C ATOM 810 CD GLU A 52 2.777 -4.317 -10.266 1.00 52.13 C ATOM 811 OE1 GLU A 52 2.757 -4.401 -9.021 1.00 53.12 O ATOM 812 OE2 GLU A 52 3.394 -5.120 -10.997 1.00 21.20 O ATOM 0 H GLU A 52 1.861 0.818 -9.752 1.00 51.13 H new ATOM 0 HA GLU A 52 2.844 -0.778 -12.046 1.00 50.24 H new ATOM 0 HB2 GLU A 52 3.282 -1.843 -9.842 1.00 71.50 H new ATOM 0 HB3 GLU A 52 1.582 -1.710 -9.437 1.00 71.50 H new ATOM 0 HG2 GLU A 52 0.947 -3.400 -10.890 1.00 32.11 H new ATOM 0 HG3 GLU A 52 2.293 -3.128 -11.978 1.00 32.11 H new ATOM 819 N ASP A 53 -0.222 -0.199 -10.954 1.00 35.44 N ATOM 820 CA ASP A 53 -1.617 -0.104 -11.371 1.00 3.32 C ATOM 821 C ASP A 53 -2.385 0.870 -10.482 1.00 60.41 C ATOM 822 O ASP A 53 -1.877 1.320 -9.456 1.00 34.53 O ATOM 823 CB ASP A 53 -2.279 -1.481 -11.332 1.00 63.23 C ATOM 824 CG ASP A 53 -2.169 -2.214 -12.654 1.00 51.11 C ATOM 825 OD1 ASP A 53 -2.141 -1.541 -13.706 1.00 53.43 O ATOM 826 OD2 ASP A 53 -2.112 -3.462 -12.638 1.00 44.13 O ATOM 0 H ASP A 53 -0.054 0.065 -9.983 1.00 35.44 H new ATOM 0 HA ASP A 53 -1.640 0.271 -12.394 1.00 3.32 H new ATOM 0 HB2 ASP A 53 -1.817 -2.081 -10.548 1.00 63.23 H new ATOM 0 HB3 ASP A 53 -3.331 -1.368 -11.069 1.00 63.23 H new ATOM 831 N GLU A 54 -3.611 1.189 -10.885 1.00 32.22 N ATOM 832 CA GLU A 54 -4.448 2.110 -10.125 1.00 23.02 C ATOM 833 C GLU A 54 -5.928 1.820 -10.358 1.00 45.42 C ATOM 834 O GLU A 54 -6.445 2.022 -11.458 1.00 53.11 O ATOM 835 CB GLU A 54 -4.133 3.557 -10.511 1.00 20.21 C ATOM 836 CG GLU A 54 -3.225 4.267 -9.521 1.00 71.14 C ATOM 837 CD GLU A 54 -3.066 5.743 -9.831 1.00 14.22 C ATOM 838 OE1 GLU A 54 -2.347 6.071 -10.797 1.00 3.41 O ATOM 839 OE2 GLU A 54 -3.660 6.569 -9.108 1.00 15.15 O ATOM 0 H GLU A 54 -4.046 0.824 -11.732 1.00 32.22 H new ATOM 0 HA GLU A 54 -4.231 1.968 -9.066 1.00 23.02 H new ATOM 0 HB2 GLU A 54 -3.663 3.568 -11.494 1.00 20.21 H new ATOM 0 HB3 GLU A 54 -5.067 4.113 -10.598 1.00 20.21 H new ATOM 0 HG2 GLU A 54 -3.630 4.152 -8.515 1.00 71.14 H new ATOM 0 HG3 GLU A 54 -2.245 3.791 -9.526 1.00 71.14 H new ATOM 846 N LEU A 55 -6.603 1.344 -9.318 1.00 1.23 N ATOM 847 CA LEU A 55 -8.024 1.025 -9.409 1.00 4.34 C ATOM 848 C LEU A 55 -8.851 1.971 -8.543 1.00 25.12 C ATOM 849 O LEU A 55 -8.546 2.176 -7.368 1.00 33.22 O ATOM 850 CB LEU A 55 -8.269 -0.422 -8.981 1.00 31.42 C ATOM 851 CG LEU A 55 -7.348 -1.471 -9.603 1.00 61.35 C ATOM 852 CD1 LEU A 55 -7.266 -2.704 -8.715 1.00 53.44 C ATOM 853 CD2 LEU A 55 -7.830 -1.846 -10.997 1.00 74.41 C ATOM 0 H LEU A 55 -6.190 1.170 -8.402 1.00 1.23 H new ATOM 0 HA LEU A 55 -8.334 1.148 -10.447 1.00 4.34 H new ATOM 0 HB2 LEU A 55 -8.173 -0.480 -7.897 1.00 31.42 H new ATOM 0 HB3 LEU A 55 -9.299 -0.682 -9.224 1.00 31.42 H new ATOM 0 HG LEU A 55 -6.349 -1.044 -9.689 1.00 61.35 H new ATOM 0 HD11 LEU A 55 -6.606 -3.440 -9.174 1.00 53.44 H new ATOM 0 HD12 LEU A 55 -6.873 -2.423 -7.738 1.00 53.44 H new ATOM 0 HD13 LEU A 55 -8.261 -3.133 -8.596 1.00 53.44 H new ATOM 0 HD21 LEU A 55 -7.162 -2.594 -11.424 1.00 74.41 H new ATOM 0 HD22 LEU A 55 -8.839 -2.254 -10.936 1.00 74.41 H new ATOM 0 HD23 LEU A 55 -7.835 -0.959 -11.631 1.00 74.41 H new ATOM 865 N GLN A 56 -9.896 2.541 -9.131 1.00 42.24 N ATOM 866 CA GLN A 56 -10.767 3.464 -8.413 1.00 31.02 C ATOM 867 C GLN A 56 -12.132 2.833 -8.153 1.00 23.13 C ATOM 868 O GLN A 56 -12.502 1.848 -8.790 1.00 32.14 O ATOM 869 CB GLN A 56 -10.934 4.762 -9.204 1.00 35.25 C ATOM 870 CG GLN A 56 -9.727 5.682 -9.125 1.00 55.44 C ATOM 871 CD GLN A 56 -8.758 5.473 -10.272 1.00 52.35 C ATOM 872 OE1 GLN A 56 -9.167 5.289 -11.418 1.00 71.43 O ATOM 873 NE2 GLN A 56 -7.466 5.503 -9.969 1.00 20.43 N ATOM 0 H GLN A 56 -10.161 2.380 -10.103 1.00 42.24 H new ATOM 0 HA GLN A 56 -10.302 3.690 -7.453 1.00 31.02 H new ATOM 0 HB2 GLN A 56 -11.127 4.519 -10.249 1.00 35.25 H new ATOM 0 HB3 GLN A 56 -11.810 5.293 -8.833 1.00 35.25 H new ATOM 0 HG2 GLN A 56 -10.064 6.718 -9.124 1.00 55.44 H new ATOM 0 HG3 GLN A 56 -9.208 5.514 -8.181 1.00 55.44 H new ATOM 0 HE21 GLN A 56 -7.172 5.659 -9.005 1.00 20.43 H new ATOM 0 HE22 GLN A 56 -6.767 5.370 -10.700 1.00 20.43 H new ATOM 882 N ASN A 57 -12.875 3.408 -7.213 1.00 43.12 N ATOM 883 CA ASN A 57 -14.198 2.902 -6.868 1.00 70.13 C ATOM 884 C ASN A 57 -14.170 1.388 -6.685 1.00 63.24 C ATOM 885 O ASN A 57 -14.927 0.660 -7.329 1.00 60.23 O ATOM 886 CB ASN A 57 -15.210 3.277 -7.954 1.00 3.34 C ATOM 887 CG ASN A 57 -14.546 3.564 -9.287 1.00 31.50 C ATOM 888 OD1 ASN A 57 -13.962 4.749 -9.416 1.00 73.43 O flip ATOM 889 ND2 ASN A 57 -14.559 2.728 -10.191 1.00 32.14 N flip ATOM 0 H ASN A 57 -12.583 4.225 -6.677 1.00 43.12 H new ATOM 0 HA ASN A 57 -14.500 3.359 -5.926 1.00 70.13 H new ATOM 0 HB2 ASN A 57 -15.927 2.465 -8.075 1.00 3.34 H new ATOM 0 HB3 ASN A 57 -15.773 4.154 -7.635 1.00 3.34 H new ATOM 0 HD21 ASN A 57 -15.020 1.829 -10.048 1.00 32.14 H new ATOM 0 HD22 ASN A 57 -14.109 2.934 -11.083 1.00 32.14 H new ATOM 896 N ILE A 58 -13.294 0.920 -5.802 1.00 60.23 N ATOM 897 CA ILE A 58 -13.169 -0.507 -5.533 1.00 72.23 C ATOM 898 C ILE A 58 -13.228 -0.792 -4.037 1.00 4.52 C ATOM 899 O ILE A 58 -12.708 -0.023 -3.228 1.00 25.52 O ATOM 900 CB ILE A 58 -11.854 -1.074 -6.101 1.00 24.01 C ATOM 901 CG1 ILE A 58 -11.189 -1.999 -5.079 1.00 51.45 C ATOM 902 CG2 ILE A 58 -10.914 0.057 -6.491 1.00 51.22 C ATOM 903 CD1 ILE A 58 -10.513 -1.259 -3.947 1.00 21.33 C ATOM 0 H ILE A 58 -12.660 1.508 -5.261 1.00 60.23 H new ATOM 0 HA ILE A 58 -14.009 -0.996 -6.027 1.00 72.23 H new ATOM 0 HB ILE A 58 -12.082 -1.655 -6.995 1.00 24.01 H new ATOM 0 HG12 ILE A 58 -11.941 -2.671 -4.666 1.00 51.45 H new ATOM 0 HG13 ILE A 58 -10.452 -2.620 -5.588 1.00 51.45 H new ATOM 0 HG21 ILE A 58 -9.989 -0.360 -6.891 1.00 51.22 H new ATOM 0 HG22 ILE A 58 -11.389 0.680 -7.249 1.00 51.22 H new ATOM 0 HG23 ILE A 58 -10.689 0.663 -5.613 1.00 51.22 H new ATOM 0 HD11 ILE A 58 -10.063 -1.976 -3.261 1.00 21.33 H new ATOM 0 HD12 ILE A 58 -9.738 -0.607 -4.350 1.00 21.33 H new ATOM 0 HD13 ILE A 58 -11.250 -0.659 -3.413 1.00 21.33 H new ATOM 915 N SER A 59 -13.863 -1.902 -3.676 1.00 25.33 N ATOM 916 CA SER A 59 -13.991 -2.288 -2.275 1.00 3.01 C ATOM 917 C SER A 59 -12.742 -3.023 -1.797 1.00 41.20 C ATOM 918 O SER A 59 -11.880 -3.412 -2.585 1.00 11.12 O ATOM 919 CB SER A 59 -15.224 -3.172 -2.078 1.00 64.24 C ATOM 920 OG SER A 59 -16.256 -2.468 -1.412 1.00 13.43 O ATOM 0 H SER A 59 -14.297 -2.550 -4.333 1.00 25.33 H new ATOM 0 HA SER A 59 -14.106 -1.380 -1.683 1.00 3.01 H new ATOM 0 HB2 SER A 59 -15.584 -3.520 -3.046 1.00 64.24 H new ATOM 0 HB3 SER A 59 -14.953 -4.056 -1.502 1.00 64.24 H new ATOM 0 HG SER A 59 -17.033 -3.055 -1.300 1.00 13.43 H new ATOM 926 N PRO A 60 -12.642 -3.219 -0.474 1.00 30.21 N ATOM 927 CA PRO A 60 -11.504 -3.909 0.140 1.00 41.42 C ATOM 928 C PRO A 60 -11.488 -5.399 -0.181 1.00 23.24 C ATOM 929 O PRO A 60 -10.612 -6.132 0.278 1.00 44.43 O ATOM 930 CB PRO A 60 -11.721 -3.687 1.639 1.00 10.04 C ATOM 931 CG PRO A 60 -13.188 -3.477 1.782 1.00 73.30 C ATOM 932 CD PRO A 60 -13.633 -2.782 0.524 1.00 21.21 C ATOM 0 HA PRO A 60 -10.551 -3.529 -0.227 1.00 41.42 H new ATOM 0 HB2 PRO A 60 -11.386 -4.547 2.219 1.00 10.04 H new ATOM 0 HB3 PRO A 60 -11.161 -2.823 1.996 1.00 10.04 H new ATOM 0 HG2 PRO A 60 -13.708 -4.427 1.907 1.00 73.30 H new ATOM 0 HG3 PRO A 60 -13.412 -2.873 2.661 1.00 73.30 H new ATOM 0 HD2 PRO A 60 -14.644 -3.073 0.240 1.00 21.21 H new ATOM 0 HD3 PRO A 60 -13.634 -1.698 0.642 1.00 21.21 H new ATOM 940 N GLU A 61 -12.461 -5.841 -0.971 1.00 53.30 N ATOM 941 CA GLU A 61 -12.557 -7.245 -1.352 1.00 32.35 C ATOM 942 C GLU A 61 -12.071 -7.455 -2.782 1.00 54.12 C ATOM 943 O GLU A 61 -11.604 -8.536 -3.137 1.00 21.32 O ATOM 944 CB GLU A 61 -14.001 -7.736 -1.214 1.00 65.02 C ATOM 945 CG GLU A 61 -14.263 -8.503 0.071 1.00 42.14 C ATOM 946 CD GLU A 61 -15.720 -8.456 0.491 1.00 4.14 C ATOM 947 OE1 GLU A 61 -16.586 -8.812 -0.333 1.00 54.44 O ATOM 948 OE2 GLU A 61 -15.991 -8.065 1.646 1.00 65.31 O ATOM 0 H GLU A 61 -13.194 -5.247 -1.360 1.00 53.30 H new ATOM 0 HA GLU A 61 -11.919 -7.822 -0.682 1.00 32.35 H new ATOM 0 HB2 GLU A 61 -14.673 -6.879 -1.259 1.00 65.02 H new ATOM 0 HB3 GLU A 61 -14.241 -8.375 -2.064 1.00 65.02 H new ATOM 0 HG2 GLU A 61 -13.960 -9.542 -0.062 1.00 42.14 H new ATOM 0 HG3 GLU A 61 -13.645 -8.090 0.869 1.00 42.14 H new ATOM 955 N GLU A 62 -12.186 -6.412 -3.599 1.00 71.35 N ATOM 956 CA GLU A 62 -11.759 -6.483 -4.992 1.00 61.24 C ATOM 957 C GLU A 62 -10.247 -6.318 -5.107 1.00 4.52 C ATOM 958 O GLU A 62 -9.591 -7.014 -5.884 1.00 34.20 O ATOM 959 CB GLU A 62 -12.465 -5.408 -5.820 1.00 73.21 C ATOM 960 CG GLU A 62 -13.224 -5.961 -7.015 1.00 52.55 C ATOM 961 CD GLU A 62 -12.515 -5.698 -8.329 1.00 44.44 C ATOM 962 OE1 GLU A 62 -12.072 -4.551 -8.546 1.00 44.31 O ATOM 963 OE2 GLU A 62 -12.402 -6.641 -9.141 1.00 12.14 O ATOM 0 H GLU A 62 -12.571 -5.509 -3.321 1.00 71.35 H new ATOM 0 HA GLU A 62 -12.030 -7.465 -5.379 1.00 61.24 H new ATOM 0 HB2 GLU A 62 -13.159 -4.865 -5.179 1.00 73.21 H new ATOM 0 HB3 GLU A 62 -11.726 -4.688 -6.171 1.00 73.21 H new ATOM 0 HG2 GLU A 62 -13.360 -7.035 -6.889 1.00 52.55 H new ATOM 0 HG3 GLU A 62 -14.218 -5.515 -7.047 1.00 52.55 H new ATOM 970 N LEU A 63 -9.698 -5.391 -4.329 1.00 34.04 N ATOM 971 CA LEU A 63 -8.263 -5.133 -4.342 1.00 12.33 C ATOM 972 C LEU A 63 -7.475 -6.417 -4.101 1.00 14.01 C ATOM 973 O LEU A 63 -6.624 -6.797 -4.905 1.00 35.15 O ATOM 974 CB LEU A 63 -7.902 -4.092 -3.280 1.00 61.30 C ATOM 975 CG LEU A 63 -7.101 -2.885 -3.768 1.00 40.41 C ATOM 976 CD1 LEU A 63 -6.648 -2.034 -2.592 1.00 33.14 C ATOM 977 CD2 LEU A 63 -5.905 -3.337 -4.594 1.00 3.43 C ATOM 0 H LEU A 63 -10.226 -4.806 -3.681 1.00 34.04 H new ATOM 0 HA LEU A 63 -7.998 -4.746 -5.326 1.00 12.33 H new ATOM 0 HB2 LEU A 63 -8.825 -3.731 -2.826 1.00 61.30 H new ATOM 0 HB3 LEU A 63 -7.332 -4.587 -2.494 1.00 61.30 H new ATOM 0 HG LEU A 63 -7.746 -2.277 -4.402 1.00 40.41 H new ATOM 0 HD11 LEU A 63 -6.079 -1.180 -2.959 1.00 33.14 H new ATOM 0 HD12 LEU A 63 -7.520 -1.680 -2.042 1.00 33.14 H new ATOM 0 HD13 LEU A 63 -6.020 -2.631 -1.931 1.00 33.14 H new ATOM 0 HD21 LEU A 63 -5.346 -2.465 -4.933 1.00 3.43 H new ATOM 0 HD22 LEU A 63 -5.258 -3.967 -3.983 1.00 3.43 H new ATOM 0 HD23 LEU A 63 -6.253 -3.903 -5.458 1.00 3.43 H new ATOM 989 N LYS A 64 -7.767 -7.083 -2.988 1.00 51.20 N ATOM 990 CA LYS A 64 -7.090 -8.326 -2.641 1.00 22.10 C ATOM 991 C LYS A 64 -7.149 -9.319 -3.797 1.00 73.32 C ATOM 992 O LYS A 64 -6.259 -10.155 -3.957 1.00 45.42 O ATOM 993 CB LYS A 64 -7.722 -8.944 -1.392 1.00 14.22 C ATOM 994 CG LYS A 64 -7.917 -10.447 -1.488 1.00 42.42 C ATOM 995 CD LYS A 64 -8.000 -11.088 -0.113 1.00 25.12 C ATOM 996 CE LYS A 64 -9.393 -11.628 0.169 1.00 54.51 C ATOM 997 NZ LYS A 64 -9.492 -13.086 -0.116 1.00 51.02 N ATOM 0 H LYS A 64 -8.468 -6.782 -2.311 1.00 51.20 H new ATOM 0 HA LYS A 64 -6.045 -8.095 -2.436 1.00 22.10 H new ATOM 0 HB2 LYS A 64 -7.093 -8.722 -0.530 1.00 14.22 H new ATOM 0 HB3 LYS A 64 -8.688 -8.472 -1.212 1.00 14.22 H new ATOM 0 HG2 LYS A 64 -8.828 -10.662 -2.046 1.00 42.42 H new ATOM 0 HG3 LYS A 64 -7.091 -10.887 -2.046 1.00 42.42 H new ATOM 0 HD2 LYS A 64 -7.274 -11.898 -0.044 1.00 25.12 H new ATOM 0 HD3 LYS A 64 -7.732 -10.355 0.648 1.00 25.12 H new ATOM 0 HE2 LYS A 64 -9.649 -11.444 1.212 1.00 54.51 H new ATOM 0 HE3 LYS A 64 -10.121 -11.089 -0.438 1.00 54.51 H new ATOM 0 HZ1 LYS A 64 -10.492 -13.354 -0.210 1.00 51.02 H new ATOM 0 HZ2 LYS A 64 -8.991 -13.301 -1.002 1.00 51.02 H new ATOM 0 HZ3 LYS A 64 -9.061 -13.622 0.664 1.00 51.02 H new ATOM 1011 N LEU A 65 -8.202 -9.222 -4.601 1.00 45.14 N ATOM 1012 CA LEU A 65 -8.376 -10.111 -5.745 1.00 13.30 C ATOM 1013 C LEU A 65 -7.501 -9.671 -6.914 1.00 53.42 C ATOM 1014 O LEU A 65 -7.083 -10.491 -7.731 1.00 20.33 O ATOM 1015 CB LEU A 65 -9.845 -10.140 -6.173 1.00 23.20 C ATOM 1016 CG LEU A 65 -10.768 -11.034 -5.345 1.00 72.22 C ATOM 1017 CD1 LEU A 65 -10.342 -11.034 -3.885 1.00 71.45 C ATOM 1018 CD2 LEU A 65 -12.214 -10.579 -5.480 1.00 62.45 C ATOM 0 H LEU A 65 -8.948 -8.537 -4.482 1.00 45.14 H new ATOM 0 HA LEU A 65 -8.071 -11.114 -5.446 1.00 13.30 H new ATOM 0 HB2 LEU A 65 -10.233 -9.122 -6.139 1.00 23.20 H new ATOM 0 HB3 LEU A 65 -9.893 -10.465 -7.212 1.00 23.20 H new ATOM 0 HG LEU A 65 -10.692 -12.053 -5.725 1.00 72.22 H new ATOM 0 HD11 LEU A 65 -11.010 -11.676 -3.311 1.00 71.45 H new ATOM 0 HD12 LEU A 65 -9.321 -11.408 -3.804 1.00 71.45 H new ATOM 0 HD13 LEU A 65 -10.388 -10.018 -3.492 1.00 71.45 H new ATOM 0 HD21 LEU A 65 -12.856 -11.227 -4.884 1.00 62.45 H new ATOM 0 HD22 LEU A 65 -12.307 -9.552 -5.127 1.00 62.45 H new ATOM 0 HD23 LEU A 65 -12.516 -10.632 -6.526 1.00 62.45 H new ATOM 1030 N GLU A 66 -7.229 -8.372 -6.987 1.00 61.32 N ATOM 1031 CA GLU A 66 -6.403 -7.825 -8.057 1.00 52.02 C ATOM 1032 C GLU A 66 -4.921 -8.058 -7.774 1.00 15.21 C ATOM 1033 O GLU A 66 -4.099 -8.082 -8.690 1.00 25.12 O ATOM 1034 CB GLU A 66 -6.672 -6.327 -8.224 1.00 73.55 C ATOM 1035 CG GLU A 66 -8.109 -6.006 -8.599 1.00 32.10 C ATOM 1036 CD GLU A 66 -8.556 -6.718 -9.861 1.00 40.14 C ATOM 1037 OE1 GLU A 66 -8.999 -7.882 -9.760 1.00 2.33 O ATOM 1038 OE2 GLU A 66 -8.464 -6.113 -10.949 1.00 43.13 O ATOM 0 H GLU A 66 -7.568 -7.680 -6.319 1.00 61.32 H new ATOM 0 HA GLU A 66 -6.664 -8.339 -8.982 1.00 52.02 H new ATOM 0 HB2 GLU A 66 -6.425 -5.816 -7.293 1.00 73.55 H new ATOM 0 HB3 GLU A 66 -6.008 -5.930 -8.992 1.00 73.55 H new ATOM 0 HG2 GLU A 66 -8.766 -6.286 -7.776 1.00 32.10 H new ATOM 0 HG3 GLU A 66 -8.213 -4.930 -8.737 1.00 32.10 H new ATOM 1045 N LEU A 67 -4.589 -8.228 -6.499 1.00 62.13 N ATOM 1046 CA LEU A 67 -3.207 -8.459 -6.093 1.00 53.20 C ATOM 1047 C LEU A 67 -2.779 -9.890 -6.404 1.00 55.30 C ATOM 1048 O LEU A 67 -3.599 -10.805 -6.482 1.00 41.34 O ATOM 1049 CB LEU A 67 -3.040 -8.177 -4.598 1.00 70.54 C ATOM 1050 CG LEU A 67 -3.197 -6.719 -4.168 1.00 44.21 C ATOM 1051 CD1 LEU A 67 -3.155 -6.602 -2.652 1.00 41.14 C ATOM 1052 CD2 LEU A 67 -2.114 -5.857 -4.802 1.00 61.12 C ATOM 0 H LEU A 67 -5.258 -8.210 -5.729 1.00 62.13 H new ATOM 0 HA LEU A 67 -2.570 -7.779 -6.658 1.00 53.20 H new ATOM 0 HB2 LEU A 67 -3.769 -8.776 -4.052 1.00 70.54 H new ATOM 0 HB3 LEU A 67 -2.052 -8.521 -4.292 1.00 70.54 H new ATOM 0 HG LEU A 67 -4.167 -6.361 -4.512 1.00 44.21 H new ATOM 0 HD11 LEU A 67 -3.268 -5.557 -2.364 1.00 41.14 H new ATOM 0 HD12 LEU A 67 -3.966 -7.187 -2.219 1.00 41.14 H new ATOM 0 HD13 LEU A 67 -2.200 -6.978 -2.284 1.00 41.14 H new ATOM 0 HD21 LEU A 67 -2.241 -4.822 -4.485 1.00 61.12 H new ATOM 0 HD22 LEU A 67 -1.134 -6.215 -4.488 1.00 61.12 H new ATOM 0 HD23 LEU A 67 -2.191 -5.916 -5.888 1.00 61.12 H new ATOM 1064 N PRO A 68 -1.466 -10.090 -6.583 1.00 44.43 N ATOM 1065 CA PRO A 68 -0.900 -11.407 -6.886 1.00 44.12 C ATOM 1066 C PRO A 68 -0.981 -12.360 -5.698 1.00 71.21 C ATOM 1067 O PRO A 68 -1.730 -12.121 -4.750 1.00 64.22 O ATOM 1068 CB PRO A 68 0.562 -11.097 -7.222 1.00 31.13 C ATOM 1069 CG PRO A 68 0.853 -9.825 -6.503 1.00 64.23 C ATOM 1070 CD PRO A 68 -0.431 -9.044 -6.505 1.00 11.44 C ATOM 0 HA PRO A 68 -1.440 -11.907 -7.690 1.00 44.12 H new ATOM 0 HB2 PRO A 68 1.223 -11.899 -6.892 1.00 31.13 H new ATOM 0 HB3 PRO A 68 0.707 -10.987 -8.297 1.00 31.13 H new ATOM 0 HG2 PRO A 68 1.189 -10.021 -5.485 1.00 64.23 H new ATOM 0 HG3 PRO A 68 1.648 -9.269 -7.000 1.00 64.23 H new ATOM 0 HD2 PRO A 68 -0.536 -8.441 -5.603 1.00 11.44 H new ATOM 0 HD3 PRO A 68 -0.485 -8.361 -7.353 1.00 11.44 H new ATOM 1078 N GLU A 69 -0.207 -13.439 -5.756 1.00 33.42 N ATOM 1079 CA GLU A 69 -0.195 -14.427 -4.684 1.00 23.15 C ATOM 1080 C GLU A 69 1.236 -14.754 -4.263 1.00 14.43 C ATOM 1081 O GLU A 69 1.494 -15.073 -3.102 1.00 72.21 O ATOM 1082 CB GLU A 69 -0.911 -15.704 -5.128 1.00 62.35 C ATOM 1083 CG GLU A 69 -0.350 -16.303 -6.408 1.00 15.31 C ATOM 1084 CD GLU A 69 -1.334 -16.241 -7.559 1.00 74.44 C ATOM 1085 OE1 GLU A 69 -1.346 -15.218 -8.276 1.00 2.13 O ATOM 1086 OE2 GLU A 69 -2.092 -17.216 -7.747 1.00 23.15 O ATOM 0 H GLU A 69 0.419 -13.651 -6.533 1.00 33.42 H new ATOM 0 HA GLU A 69 -0.721 -14.003 -3.828 1.00 23.15 H new ATOM 0 HB2 GLU A 69 -0.844 -16.444 -4.331 1.00 62.35 H new ATOM 0 HB3 GLU A 69 -1.969 -15.486 -5.272 1.00 62.35 H new ATOM 0 HG2 GLU A 69 0.561 -15.772 -6.684 1.00 15.31 H new ATOM 0 HG3 GLU A 69 -0.072 -17.341 -6.228 1.00 15.31 H new ATOM 1093 N ARG A 70 2.160 -14.671 -5.213 1.00 74.14 N ATOM 1094 CA ARG A 70 3.564 -14.960 -4.942 1.00 74.11 C ATOM 1095 C ARG A 70 4.455 -13.820 -5.424 1.00 51.14 C ATOM 1096 O ARG A 70 5.527 -14.053 -5.985 1.00 55.44 O ATOM 1097 CB ARG A 70 3.978 -16.267 -5.619 1.00 75.43 C ATOM 1098 CG ARG A 70 3.003 -17.411 -5.384 1.00 5.51 C ATOM 1099 CD ARG A 70 3.500 -18.350 -4.296 1.00 45.13 C ATOM 1100 NE ARG A 70 2.998 -19.710 -4.476 1.00 11.35 N ATOM 1101 CZ ARG A 70 3.520 -20.772 -3.873 1.00 71.15 C ATOM 1102 NH1 ARG A 70 4.556 -20.633 -3.057 1.00 2.10 N ATOM 1103 NH2 ARG A 70 3.007 -21.977 -4.086 1.00 54.24 N ATOM 0 H ARG A 70 1.963 -14.406 -6.178 1.00 74.14 H new ATOM 0 HA ARG A 70 3.687 -15.064 -3.864 1.00 74.11 H new ATOM 0 HB2 ARG A 70 4.073 -16.097 -6.691 1.00 75.43 H new ATOM 0 HB3 ARG A 70 4.963 -16.559 -5.254 1.00 75.43 H new ATOM 0 HG2 ARG A 70 2.029 -17.009 -5.103 1.00 5.51 H new ATOM 0 HG3 ARG A 70 2.863 -17.968 -6.311 1.00 5.51 H new ATOM 0 HD2 ARG A 70 4.590 -18.363 -4.298 1.00 45.13 H new ATOM 0 HD3 ARG A 70 3.187 -17.974 -3.322 1.00 45.13 H new ATOM 0 HE ARG A 70 2.203 -19.852 -5.099 1.00 11.35 H new ATOM 0 HH11 ARG A 70 4.954 -19.709 -2.891 1.00 2.10 H new ATOM 0 HH12 ARG A 70 4.955 -21.450 -2.595 1.00 2.10 H new ATOM 0 HH21 ARG A 70 2.211 -22.089 -4.714 1.00 54.24 H new ATOM 0 HH22 ARG A 70 3.409 -22.792 -3.622 1.00 54.24 H new ATOM 1117 N GLN A 71 4.006 -12.589 -5.203 1.00 1.01 N ATOM 1118 CA GLN A 71 4.763 -11.413 -5.616 1.00 63.13 C ATOM 1119 C GLN A 71 4.491 -10.236 -4.686 1.00 41.12 C ATOM 1120 O GLN A 71 3.387 -9.693 -4.640 1.00 3.41 O ATOM 1121 CB GLN A 71 4.411 -11.034 -7.056 1.00 14.23 C ATOM 1122 CG GLN A 71 4.737 -12.119 -8.068 1.00 20.33 C ATOM 1123 CD GLN A 71 4.138 -11.844 -9.433 1.00 23.11 C ATOM 1124 OE1 GLN A 71 4.756 -11.192 -10.275 1.00 0.12 O ATOM 1125 NE2 GLN A 71 2.928 -12.342 -9.660 1.00 50.34 N ATOM 0 H GLN A 71 3.121 -12.380 -4.740 1.00 1.01 H new ATOM 0 HA GLN A 71 5.824 -11.657 -5.561 1.00 63.13 H new ATOM 0 HB2 GLN A 71 3.347 -10.804 -7.112 1.00 14.23 H new ATOM 0 HB3 GLN A 71 4.948 -10.125 -7.325 1.00 14.23 H new ATOM 0 HG2 GLN A 71 5.819 -12.209 -8.162 1.00 20.33 H new ATOM 0 HG3 GLN A 71 4.368 -13.076 -7.700 1.00 20.33 H new ATOM 0 HE21 GLN A 71 2.452 -12.877 -8.933 1.00 50.34 H new ATOM 0 HE22 GLN A 71 2.475 -12.190 -10.561 1.00 50.34 H new ATOM 1134 N PRO A 72 5.519 -9.831 -3.927 1.00 2.54 N ATOM 1135 CA PRO A 72 5.415 -8.713 -2.984 1.00 5.30 C ATOM 1136 C PRO A 72 5.281 -7.369 -3.691 1.00 63.11 C ATOM 1137 O PRO A 72 6.036 -7.065 -4.615 1.00 11.34 O ATOM 1138 CB PRO A 72 6.733 -8.780 -2.208 1.00 44.41 C ATOM 1139 CG PRO A 72 7.685 -9.456 -3.134 1.00 74.31 C ATOM 1140 CD PRO A 72 6.863 -10.432 -3.930 1.00 25.20 C ATOM 0 HA PRO A 72 4.529 -8.792 -2.354 1.00 5.30 H new ATOM 0 HB2 PRO A 72 7.084 -7.784 -1.937 1.00 44.41 H new ATOM 0 HB3 PRO A 72 6.618 -9.340 -1.280 1.00 44.41 H new ATOM 0 HG2 PRO A 72 8.174 -8.733 -3.787 1.00 74.31 H new ATOM 0 HG3 PRO A 72 8.472 -9.968 -2.580 1.00 74.31 H new ATOM 0 HD2 PRO A 72 7.248 -10.549 -4.943 1.00 25.20 H new ATOM 0 HD3 PRO A 72 6.861 -11.422 -3.473 1.00 25.20 H new ATOM 1148 N ARG A 73 4.316 -6.568 -3.251 1.00 43.21 N ATOM 1149 CA ARG A 73 4.083 -5.256 -3.843 1.00 42.10 C ATOM 1150 C ARG A 73 3.400 -4.324 -2.846 1.00 43.33 C ATOM 1151 O ARG A 73 2.876 -4.766 -1.824 1.00 64.15 O ATOM 1152 CB ARG A 73 3.226 -5.387 -5.104 1.00 45.10 C ATOM 1153 CG ARG A 73 1.784 -5.774 -4.823 1.00 74.12 C ATOM 1154 CD ARG A 73 1.647 -7.267 -4.564 1.00 4.40 C ATOM 1155 NE ARG A 73 0.433 -7.584 -3.817 1.00 63.13 N ATOM 1156 CZ ARG A 73 0.288 -8.681 -3.083 1.00 1.32 C ATOM 1157 NH1 ARG A 73 1.277 -9.562 -2.997 1.00 54.54 N ATOM 1158 NH2 ARG A 73 -0.847 -8.900 -2.432 1.00 3.24 N ATOM 0 H ARG A 73 3.683 -6.804 -2.487 1.00 43.21 H new ATOM 0 HA ARG A 73 5.049 -4.829 -4.111 1.00 42.10 H new ATOM 0 HB2 ARG A 73 3.241 -4.440 -5.643 1.00 45.10 H new ATOM 0 HB3 ARG A 73 3.672 -6.134 -5.760 1.00 45.10 H new ATOM 0 HG2 ARG A 73 1.419 -5.219 -3.959 1.00 74.12 H new ATOM 0 HG3 ARG A 73 1.159 -5.492 -5.670 1.00 74.12 H new ATOM 0 HD2 ARG A 73 1.637 -7.800 -5.515 1.00 4.40 H new ATOM 0 HD3 ARG A 73 2.516 -7.620 -4.009 1.00 4.40 H new ATOM 0 HE ARG A 73 -0.346 -6.927 -3.861 1.00 63.13 H new ATOM 0 HH11 ARG A 73 2.151 -9.397 -3.496 1.00 54.54 H new ATOM 0 HH12 ARG A 73 1.163 -10.404 -2.432 1.00 54.54 H new ATOM 0 HH21 ARG A 73 -1.609 -8.225 -2.495 1.00 3.24 H new ATOM 0 HH22 ARG A 73 -0.957 -9.743 -1.869 1.00 3.24 H new ATOM 1172 N PHE A 74 3.413 -3.030 -3.151 1.00 72.24 N ATOM 1173 CA PHE A 74 2.797 -2.034 -2.281 1.00 54.13 C ATOM 1174 C PHE A 74 1.390 -1.688 -2.762 1.00 3.10 C ATOM 1175 O PHE A 74 1.072 -1.836 -3.942 1.00 73.11 O ATOM 1176 CB PHE A 74 3.657 -0.769 -2.230 1.00 34.45 C ATOM 1177 CG PHE A 74 5.089 -1.034 -1.864 1.00 51.02 C ATOM 1178 CD1 PHE A 74 5.416 -1.560 -0.625 1.00 33.34 C ATOM 1179 CD2 PHE A 74 6.109 -0.756 -2.760 1.00 1.14 C ATOM 1180 CE1 PHE A 74 6.733 -1.803 -0.285 1.00 50.01 C ATOM 1181 CE2 PHE A 74 7.428 -0.998 -2.427 1.00 24.03 C ATOM 1182 CZ PHE A 74 7.741 -1.522 -1.188 1.00 30.25 C ATOM 0 H PHE A 74 3.843 -2.647 -3.993 1.00 72.24 H new ATOM 0 HA PHE A 74 2.726 -2.457 -1.279 1.00 54.13 H new ATOM 0 HB2 PHE A 74 3.624 -0.277 -3.202 1.00 34.45 H new ATOM 0 HB3 PHE A 74 3.227 -0.076 -1.507 1.00 34.45 H new ATOM 0 HD1 PHE A 74 4.632 -1.783 0.084 1.00 33.34 H new ATOM 0 HD2 PHE A 74 5.870 -0.345 -3.730 1.00 1.14 H new ATOM 0 HE1 PHE A 74 6.974 -2.212 0.685 1.00 50.01 H new ATOM 0 HE2 PHE A 74 8.213 -0.778 -3.135 1.00 24.03 H new ATOM 0 HZ PHE A 74 8.771 -1.712 -0.925 1.00 30.25 H new ATOM 1192 N VAL A 75 0.553 -1.225 -1.839 1.00 61.34 N ATOM 1193 CA VAL A 75 -0.819 -0.857 -2.168 1.00 13.43 C ATOM 1194 C VAL A 75 -1.351 0.198 -1.203 1.00 24.41 C ATOM 1195 O VAL A 75 -1.302 0.020 0.015 1.00 45.44 O ATOM 1196 CB VAL A 75 -1.752 -2.081 -2.138 1.00 61.52 C ATOM 1197 CG1 VAL A 75 -3.208 -1.646 -2.207 1.00 0.42 C ATOM 1198 CG2 VAL A 75 -1.417 -3.033 -3.277 1.00 32.45 C ATOM 0 H VAL A 75 0.801 -1.096 -0.858 1.00 61.34 H new ATOM 0 HA VAL A 75 -0.803 -0.447 -3.178 1.00 13.43 H new ATOM 0 HB VAL A 75 -1.600 -2.608 -1.196 1.00 61.52 H new ATOM 0 HG11 VAL A 75 -3.852 -2.525 -2.185 1.00 0.42 H new ATOM 0 HG12 VAL A 75 -3.437 -1.006 -1.355 1.00 0.42 H new ATOM 0 HG13 VAL A 75 -3.379 -1.094 -3.131 1.00 0.42 H new ATOM 0 HG21 VAL A 75 -2.086 -3.893 -3.241 1.00 32.45 H new ATOM 0 HG22 VAL A 75 -1.539 -2.518 -4.230 1.00 32.45 H new ATOM 0 HG23 VAL A 75 -0.386 -3.371 -3.177 1.00 32.45 H new ATOM 1208 N VAL A 76 -1.860 1.294 -1.755 1.00 5.13 N ATOM 1209 CA VAL A 76 -2.403 2.376 -0.943 1.00 2.41 C ATOM 1210 C VAL A 76 -3.915 2.482 -1.108 1.00 44.51 C ATOM 1211 O VAL A 76 -4.405 3.114 -2.045 1.00 24.32 O ATOM 1212 CB VAL A 76 -1.762 3.729 -1.309 1.00 63.41 C ATOM 1213 CG1 VAL A 76 -2.408 4.857 -0.520 1.00 70.11 C ATOM 1214 CG2 VAL A 76 -0.261 3.688 -1.066 1.00 10.40 C ATOM 0 H VAL A 76 -1.908 1.456 -2.761 1.00 5.13 H new ATOM 0 HA VAL A 76 -2.169 2.140 0.095 1.00 2.41 H new ATOM 0 HB VAL A 76 -1.931 3.918 -2.369 1.00 63.41 H new ATOM 0 HG11 VAL A 76 -1.942 5.804 -0.792 1.00 70.11 H new ATOM 0 HG12 VAL A 76 -3.473 4.897 -0.749 1.00 70.11 H new ATOM 0 HG13 VAL A 76 -2.272 4.679 0.547 1.00 70.11 H new ATOM 0 HG21 VAL A 76 0.177 4.651 -1.329 1.00 10.40 H new ATOM 0 HG22 VAL A 76 -0.068 3.477 -0.014 1.00 10.40 H new ATOM 0 HG23 VAL A 76 0.186 2.906 -1.680 1.00 10.40 H new ATOM 1224 N TYR A 77 -4.650 1.860 -0.193 1.00 5.30 N ATOM 1225 CA TYR A 77 -6.106 1.882 -0.238 1.00 12.21 C ATOM 1226 C TYR A 77 -6.657 3.082 0.527 1.00 61.13 C ATOM 1227 O TYR A 77 -6.192 3.401 1.621 1.00 12.33 O ATOM 1228 CB TYR A 77 -6.675 0.587 0.343 1.00 54.20 C ATOM 1229 CG TYR A 77 -8.152 0.400 0.075 1.00 60.12 C ATOM 1230 CD1 TYR A 77 -8.692 0.682 -1.174 1.00 70.30 C ATOM 1231 CD2 TYR A 77 -9.006 -0.060 1.070 1.00 25.02 C ATOM 1232 CE1 TYR A 77 -10.040 0.513 -1.423 1.00 33.42 C ATOM 1233 CE2 TYR A 77 -10.355 -0.233 0.829 1.00 72.40 C ATOM 1234 CZ TYR A 77 -10.867 0.055 -0.419 1.00 73.32 C ATOM 1235 OH TYR A 77 -12.211 -0.116 -0.663 1.00 61.43 O ATOM 0 H TYR A 77 -4.260 1.334 0.589 1.00 5.30 H new ATOM 0 HA TYR A 77 -6.410 1.968 -1.281 1.00 12.21 H new ATOM 0 HB2 TYR A 77 -6.129 -0.259 -0.074 1.00 54.20 H new ATOM 0 HB3 TYR A 77 -6.506 0.577 1.420 1.00 54.20 H new ATOM 0 HD1 TYR A 77 -8.047 1.039 -1.963 1.00 70.30 H new ATOM 0 HD2 TYR A 77 -8.608 -0.286 2.048 1.00 25.02 H new ATOM 0 HE1 TYR A 77 -10.444 0.738 -2.399 1.00 33.42 H new ATOM 0 HE2 TYR A 77 -11.005 -0.592 1.613 1.00 72.40 H new ATOM 0 HH TYR A 77 -12.439 0.279 -1.531 1.00 61.43 H new ATOM 1245 N SER A 78 -7.651 3.743 -0.058 1.00 12.11 N ATOM 1246 CA SER A 78 -8.265 4.909 0.567 1.00 41.23 C ATOM 1247 C SER A 78 -9.723 4.632 0.921 1.00 51.14 C ATOM 1248 O SER A 78 -10.613 4.760 0.079 1.00 20.15 O ATOM 1249 CB SER A 78 -8.176 6.119 -0.366 1.00 73.42 C ATOM 1250 OG SER A 78 -8.821 7.247 0.199 1.00 62.32 O ATOM 0 H SER A 78 -8.048 3.491 -0.963 1.00 12.11 H new ATOM 0 HA SER A 78 -7.721 5.126 1.487 1.00 41.23 H new ATOM 0 HB2 SER A 78 -7.130 6.355 -0.562 1.00 73.42 H new ATOM 0 HB3 SER A 78 -8.634 5.877 -1.325 1.00 73.42 H new ATOM 0 HG SER A 78 -8.749 8.007 -0.416 1.00 62.32 H new ATOM 1256 N TYR A 79 -9.959 4.253 2.171 1.00 62.31 N ATOM 1257 CA TYR A 79 -11.308 3.955 2.638 1.00 72.30 C ATOM 1258 C TYR A 79 -12.040 5.232 3.040 1.00 22.31 C ATOM 1259 O TYR A 79 -11.429 6.290 3.194 1.00 72.33 O ATOM 1260 CB TYR A 79 -11.259 2.987 3.821 1.00 34.25 C ATOM 1261 CG TYR A 79 -12.593 2.802 4.508 1.00 12.34 C ATOM 1262 CD1 TYR A 79 -13.508 1.862 4.051 1.00 54.41 C ATOM 1263 CD2 TYR A 79 -12.939 3.568 5.614 1.00 13.42 C ATOM 1264 CE1 TYR A 79 -14.729 1.692 4.675 1.00 73.44 C ATOM 1265 CE2 TYR A 79 -14.156 3.403 6.246 1.00 14.40 C ATOM 1266 CZ TYR A 79 -15.048 2.463 5.772 1.00 54.54 C ATOM 1267 OH TYR A 79 -16.262 2.296 6.397 1.00 13.04 O ATOM 0 H TYR A 79 -9.234 4.145 2.880 1.00 62.31 H new ATOM 0 HA TYR A 79 -11.854 3.488 1.818 1.00 72.30 H new ATOM 0 HB2 TYR A 79 -10.902 2.018 3.472 1.00 34.25 H new ATOM 0 HB3 TYR A 79 -10.533 3.351 4.548 1.00 34.25 H new ATOM 0 HD1 TYR A 79 -13.261 1.254 3.193 1.00 54.41 H new ATOM 0 HD2 TYR A 79 -12.244 4.306 5.986 1.00 13.42 H new ATOM 0 HE1 TYR A 79 -15.430 0.959 4.305 1.00 73.44 H new ATOM 0 HE2 TYR A 79 -14.408 4.006 7.106 1.00 14.40 H new ATOM 0 HH TYR A 79 -16.329 2.916 7.153 1.00 13.04 H new ATOM 1277 N LYS A 80 -13.354 5.124 3.210 1.00 23.41 N ATOM 1278 CA LYS A 80 -14.171 6.267 3.597 1.00 14.31 C ATOM 1279 C LYS A 80 -14.849 6.022 4.942 1.00 72.41 C ATOM 1280 O LYS A 80 -15.728 5.167 5.057 1.00 43.52 O ATOM 1281 CB LYS A 80 -15.226 6.552 2.527 1.00 52.04 C ATOM 1282 CG LYS A 80 -16.068 7.784 2.813 1.00 62.45 C ATOM 1283 CD LYS A 80 -17.132 7.992 1.748 1.00 24.03 C ATOM 1284 CE LYS A 80 -18.364 7.141 2.017 1.00 1.40 C ATOM 1285 NZ LYS A 80 -18.796 6.392 0.805 1.00 44.51 N ATOM 0 H LYS A 80 -13.875 4.256 3.086 1.00 23.41 H new ATOM 0 HA LYS A 80 -13.516 7.133 3.693 1.00 14.31 H new ATOM 0 HB2 LYS A 80 -14.730 6.677 1.564 1.00 52.04 H new ATOM 0 HB3 LYS A 80 -15.883 5.687 2.437 1.00 52.04 H new ATOM 0 HG2 LYS A 80 -16.543 7.682 3.789 1.00 62.45 H new ATOM 0 HG3 LYS A 80 -15.424 8.662 2.862 1.00 62.45 H new ATOM 0 HD2 LYS A 80 -17.415 9.044 1.716 1.00 24.03 H new ATOM 0 HD3 LYS A 80 -16.722 7.742 0.769 1.00 24.03 H new ATOM 0 HE2 LYS A 80 -18.151 6.438 2.822 1.00 1.40 H new ATOM 0 HE3 LYS A 80 -19.179 7.779 2.359 1.00 1.40 H new ATOM 0 HZ1 LYS A 80 -19.638 5.824 1.029 1.00 44.51 H new ATOM 0 HZ2 LYS A 80 -19.024 7.064 0.045 1.00 44.51 H new ATOM 0 HZ3 LYS A 80 -18.028 5.764 0.493 1.00 44.51 H new ATOM 1299 N TYR A 81 -14.436 6.776 5.953 1.00 1.53 N ATOM 1300 CA TYR A 81 -15.003 6.639 7.290 1.00 52.12 C ATOM 1301 C TYR A 81 -15.940 7.800 7.605 1.00 12.22 C ATOM 1302 O TYR A 81 -15.581 8.967 7.442 1.00 62.10 O ATOM 1303 CB TYR A 81 -13.889 6.570 8.335 1.00 44.32 C ATOM 1304 CG TYR A 81 -14.177 5.611 9.467 1.00 74.42 C ATOM 1305 CD1 TYR A 81 -15.312 5.759 10.256 1.00 24.32 C ATOM 1306 CD2 TYR A 81 -13.316 4.557 9.748 1.00 75.04 C ATOM 1307 CE1 TYR A 81 -15.581 4.885 11.292 1.00 63.42 C ATOM 1308 CE2 TYR A 81 -13.578 3.677 10.780 1.00 12.25 C ATOM 1309 CZ TYR A 81 -14.711 3.845 11.550 1.00 52.23 C ATOM 1310 OH TYR A 81 -14.974 2.972 12.580 1.00 24.32 O ATOM 0 H TYR A 81 -13.711 7.489 5.873 1.00 1.53 H new ATOM 0 HA TYR A 81 -15.578 5.713 7.320 1.00 52.12 H new ATOM 0 HB2 TYR A 81 -12.962 6.273 7.846 1.00 44.32 H new ATOM 0 HB3 TYR A 81 -13.727 7.566 8.747 1.00 44.32 H new ATOM 0 HD1 TYR A 81 -15.995 6.571 10.056 1.00 24.32 H new ATOM 0 HD2 TYR A 81 -12.427 4.424 9.149 1.00 75.04 H new ATOM 0 HE1 TYR A 81 -16.467 5.015 11.896 1.00 63.42 H new ATOM 0 HE2 TYR A 81 -12.900 2.862 10.983 1.00 12.25 H new ATOM 0 HH TYR A 81 -14.264 2.298 12.627 1.00 24.32 H new ATOM 1320 N VAL A 82 -17.146 7.473 8.059 1.00 22.23 N ATOM 1321 CA VAL A 82 -18.136 8.487 8.401 1.00 1.21 C ATOM 1322 C VAL A 82 -18.141 8.770 9.898 1.00 25.25 C ATOM 1323 O VAL A 82 -17.794 7.907 10.705 1.00 25.44 O ATOM 1324 CB VAL A 82 -19.551 8.059 7.967 1.00 61.33 C ATOM 1325 CG1 VAL A 82 -20.534 9.205 8.145 1.00 13.12 C ATOM 1326 CG2 VAL A 82 -19.541 7.574 6.525 1.00 31.42 C ATOM 0 H VAL A 82 -17.461 6.513 8.198 1.00 22.23 H new ATOM 0 HA VAL A 82 -17.857 9.394 7.864 1.00 1.21 H new ATOM 0 HB VAL A 82 -19.873 7.234 8.602 1.00 61.33 H new ATOM 0 HG11 VAL A 82 -21.528 8.884 7.833 1.00 13.12 H new ATOM 0 HG12 VAL A 82 -20.561 9.502 9.193 1.00 13.12 H new ATOM 0 HG13 VAL A 82 -20.219 10.052 7.536 1.00 13.12 H new ATOM 0 HG21 VAL A 82 -20.548 7.276 6.235 1.00 31.42 H new ATOM 0 HG22 VAL A 82 -19.198 8.378 5.873 1.00 31.42 H new ATOM 0 HG23 VAL A 82 -18.869 6.721 6.433 1.00 31.42 H new ATOM 1336 N HIS A 83 -18.535 9.985 10.265 1.00 72.42 N ATOM 1337 CA HIS A 83 -18.586 10.381 11.668 1.00 43.42 C ATOM 1338 C HIS A 83 -19.973 10.133 12.253 1.00 25.42 C ATOM 1339 O HIS A 83 -20.276 9.029 12.709 1.00 42.43 O ATOM 1340 CB HIS A 83 -18.215 11.858 11.816 1.00 61.11 C ATOM 1341 CG HIS A 83 -16.768 12.142 11.551 1.00 70.52 C ATOM 1342 ND1 HIS A 83 -16.019 11.955 10.439 1.00 61.21 N flip ATOM 1343 CD2 HIS A 83 -15.922 12.681 12.496 1.00 31.13 C flip ATOM 1344 CE1 HIS A 83 -14.746 12.382 10.730 1.00 30.32 C flip ATOM 1345 NE2 HIS A 83 -14.715 12.816 11.977 1.00 12.12 N flip ATOM 0 H HIS A 83 -18.824 10.712 9.611 1.00 72.42 H new ATOM 0 HA HIS A 83 -17.865 9.775 12.217 1.00 43.42 H new ATOM 0 HB2 HIS A 83 -18.824 12.447 11.130 1.00 61.11 H new ATOM 0 HB3 HIS A 83 -18.462 12.187 12.825 1.00 61.11 H new ATOM 0 HD1 HIS A 83 -16.340 11.569 9.551 1.00 61.21 H new ATOM 0 HD2 HIS A 83 -16.202 12.951 13.504 1.00 31.13 H new ATOM 0 HE1 HIS A 83 -13.907 12.365 10.050 1.00 30.32 H new ATOM 1354 N ASP A 84 -20.809 11.164 12.239 1.00 51.24 N ATOM 1355 CA ASP A 84 -22.165 11.057 12.768 1.00 24.31 C ATOM 1356 C ASP A 84 -22.921 12.370 12.597 1.00 41.44 C ATOM 1357 O ASP A 84 -24.081 12.381 12.185 1.00 13.23 O ATOM 1358 CB ASP A 84 -22.127 10.664 14.246 1.00 14.32 C ATOM 1359 CG ASP A 84 -23.244 9.709 14.620 1.00 54.32 C ATOM 1360 OD1 ASP A 84 -23.198 8.541 14.180 1.00 40.41 O ATOM 1361 OD2 ASP A 84 -24.163 10.130 15.353 1.00 73.33 O ATOM 0 H ASP A 84 -20.573 12.084 11.867 1.00 51.24 H new ATOM 0 HA ASP A 84 -22.688 10.283 12.207 1.00 24.31 H new ATOM 0 HB2 ASP A 84 -21.166 10.201 14.471 1.00 14.32 H new ATOM 0 HB3 ASP A 84 -22.200 11.562 14.860 1.00 14.32 H new ATOM 1366 N ASP A 85 -22.256 13.476 12.915 1.00 22.50 N ATOM 1367 CA ASP A 85 -22.865 14.795 12.795 1.00 1.43 C ATOM 1368 C ASP A 85 -23.096 15.157 11.332 1.00 44.41 C ATOM 1369 O ASP A 85 -23.723 16.169 11.023 1.00 3.54 O ATOM 1370 CB ASP A 85 -21.981 15.850 13.461 1.00 4.42 C ATOM 1371 CG ASP A 85 -22.686 16.563 14.598 1.00 13.24 C ATOM 1372 OD1 ASP A 85 -23.928 16.674 14.550 1.00 72.34 O ATOM 1373 OD2 ASP A 85 -21.995 17.011 15.538 1.00 22.13 O ATOM 0 H ASP A 85 -21.295 13.485 13.258 1.00 22.50 H new ATOM 0 HA ASP A 85 -23.831 14.769 13.300 1.00 1.43 H new ATOM 0 HB2 ASP A 85 -21.076 15.375 13.840 1.00 4.42 H new ATOM 0 HB3 ASP A 85 -21.669 16.581 12.715 1.00 4.42 H new ATOM 1378 N GLY A 86 -22.582 14.322 10.433 1.00 73.01 N ATOM 1379 CA GLY A 86 -22.742 14.572 9.013 1.00 42.44 C ATOM 1380 C GLY A 86 -21.415 14.777 8.307 1.00 14.02 C ATOM 1381 O GLY A 86 -21.376 15.237 7.165 1.00 32.53 O ATOM 0 H GLY A 86 -22.058 13.478 10.663 1.00 73.01 H new ATOM 0 HA2 GLY A 86 -23.267 13.733 8.556 1.00 42.44 H new ATOM 0 HA3 GLY A 86 -23.366 15.454 8.871 1.00 42.44 H new ATOM 1385 N ARG A 87 -20.327 14.435 8.988 1.00 45.55 N ATOM 1386 CA ARG A 87 -18.992 14.588 8.421 1.00 61.14 C ATOM 1387 C ARG A 87 -18.377 13.227 8.105 1.00 75.41 C ATOM 1388 O ARG A 87 -18.418 12.311 8.927 1.00 62.24 O ATOM 1389 CB ARG A 87 -18.088 15.356 9.387 1.00 73.35 C ATOM 1390 CG ARG A 87 -18.519 16.796 9.608 1.00 3.24 C ATOM 1391 CD ARG A 87 -18.228 17.659 8.390 1.00 53.13 C ATOM 1392 NE ARG A 87 -18.961 18.922 8.426 1.00 22.24 N ATOM 1393 CZ ARG A 87 -18.617 19.947 9.197 1.00 41.43 C ATOM 1394 NH1 ARG A 87 -17.559 19.861 9.990 1.00 25.22 N ATOM 1395 NH2 ARG A 87 -19.334 21.065 9.175 1.00 72.02 N ATOM 0 H ARG A 87 -20.343 14.050 9.933 1.00 45.55 H new ATOM 0 HA ARG A 87 -19.082 15.152 7.493 1.00 61.14 H new ATOM 0 HB2 ARG A 87 -18.073 14.839 10.346 1.00 73.35 H new ATOM 0 HB3 ARG A 87 -17.068 15.346 9.003 1.00 73.35 H new ATOM 0 HG2 ARG A 87 -19.586 16.827 9.831 1.00 3.24 H new ATOM 0 HG3 ARG A 87 -18.000 17.203 10.476 1.00 3.24 H new ATOM 0 HD2 ARG A 87 -17.158 17.862 8.337 1.00 53.13 H new ATOM 0 HD3 ARG A 87 -18.494 17.111 7.486 1.00 53.13 H new ATOM 0 HE ARG A 87 -19.781 19.022 7.827 1.00 22.24 H new ATOM 0 HH11 ARG A 87 -17.005 19.005 10.010 1.00 25.22 H new ATOM 0 HH12 ARG A 87 -17.299 20.651 10.580 1.00 25.22 H new ATOM 0 HH21 ARG A 87 -20.149 21.136 8.566 1.00 72.02 H new ATOM 0 HH22 ARG A 87 -19.070 21.852 9.767 1.00 72.02 H new ATOM 1409 N VAL A 88 -17.810 13.102 6.909 1.00 12.34 N ATOM 1410 CA VAL A 88 -17.187 11.854 6.486 1.00 42.22 C ATOM 1411 C VAL A 88 -15.845 12.113 5.809 1.00 62.32 C ATOM 1412 O VAL A 88 -15.763 12.860 4.834 1.00 21.53 O ATOM 1413 CB VAL A 88 -18.095 11.074 5.518 1.00 33.21 C ATOM 1414 CG1 VAL A 88 -18.687 12.005 4.471 1.00 40.11 C ATOM 1415 CG2 VAL A 88 -17.322 9.940 4.859 1.00 15.21 C ATOM 0 H VAL A 88 -17.769 13.850 6.216 1.00 12.34 H new ATOM 0 HA VAL A 88 -17.029 11.258 7.385 1.00 42.22 H new ATOM 0 HB VAL A 88 -18.916 10.641 6.089 1.00 33.21 H new ATOM 0 HG11 VAL A 88 -19.326 11.435 3.796 1.00 40.11 H new ATOM 0 HG12 VAL A 88 -19.278 12.778 4.963 1.00 40.11 H new ATOM 0 HG13 VAL A 88 -17.883 12.471 3.902 1.00 40.11 H new ATOM 0 HG21 VAL A 88 -17.979 9.399 4.178 1.00 15.21 H new ATOM 0 HG22 VAL A 88 -16.480 10.350 4.302 1.00 15.21 H new ATOM 0 HG23 VAL A 88 -16.953 9.258 5.625 1.00 15.21 H new ATOM 1425 N SER A 89 -14.794 11.488 6.332 1.00 73.01 N ATOM 1426 CA SER A 89 -13.455 11.652 5.780 1.00 4.41 C ATOM 1427 C SER A 89 -12.910 10.322 5.271 1.00 71.44 C ATOM 1428 O SER A 89 -13.347 9.254 5.700 1.00 33.42 O ATOM 1429 CB SER A 89 -12.513 12.232 6.838 1.00 24.51 C ATOM 1430 OG SER A 89 -13.046 13.416 7.402 1.00 14.15 O ATOM 0 H SER A 89 -14.845 10.864 7.137 1.00 73.01 H new ATOM 0 HA SER A 89 -13.517 12.344 4.940 1.00 4.41 H new ATOM 0 HB2 SER A 89 -12.346 11.495 7.623 1.00 24.51 H new ATOM 0 HB3 SER A 89 -11.543 12.445 6.388 1.00 24.51 H new ATOM 0 HG SER A 89 -12.426 13.765 8.076 1.00 14.15 H new ATOM 1436 N TYR A 90 -11.953 10.395 4.353 1.00 62.31 N ATOM 1437 CA TYR A 90 -11.350 9.197 3.781 1.00 24.33 C ATOM 1438 C TYR A 90 -9.955 8.963 4.355 1.00 31.13 C ATOM 1439 O TYR A 90 -8.960 9.506 3.877 1.00 5.40 O ATOM 1440 CB TYR A 90 -11.273 9.315 2.258 1.00 23.45 C ATOM 1441 CG TYR A 90 -12.422 10.088 1.652 1.00 23.34 C ATOM 1442 CD1 TYR A 90 -13.656 9.486 1.441 1.00 22.53 C ATOM 1443 CD2 TYR A 90 -12.274 11.421 1.291 1.00 5.34 C ATOM 1444 CE1 TYR A 90 -14.708 10.188 0.887 1.00 1.34 C ATOM 1445 CE2 TYR A 90 -13.321 12.132 0.738 1.00 3.42 C ATOM 1446 CZ TYR A 90 -14.536 11.511 0.537 1.00 12.44 C ATOM 1447 OH TYR A 90 -15.582 12.215 -0.013 1.00 54.32 O ATOM 0 H TYR A 90 -11.578 11.271 3.989 1.00 62.31 H new ATOM 0 HA TYR A 90 -11.979 8.345 4.041 1.00 24.33 H new ATOM 0 HB2 TYR A 90 -10.336 9.801 1.987 1.00 23.45 H new ATOM 0 HB3 TYR A 90 -11.250 8.315 1.825 1.00 23.45 H new ATOM 0 HD1 TYR A 90 -13.795 8.451 1.715 1.00 22.53 H new ATOM 0 HD2 TYR A 90 -11.324 11.910 1.445 1.00 5.34 H new ATOM 0 HE1 TYR A 90 -15.660 9.704 0.729 1.00 1.34 H new ATOM 0 HE2 TYR A 90 -13.189 13.168 0.465 1.00 3.42 H new ATOM 0 HH TYR A 90 -15.295 13.133 -0.201 1.00 54.32 H new ATOM 1457 N PRO A 91 -9.881 8.132 5.407 1.00 53.23 N ATOM 1458 CA PRO A 91 -8.615 7.806 6.070 1.00 71.32 C ATOM 1459 C PRO A 91 -7.712 6.940 5.198 1.00 22.51 C ATOM 1460 O PRO A 91 -7.866 5.720 5.145 1.00 35.42 O ATOM 1461 CB PRO A 91 -9.056 7.033 7.315 1.00 14.42 C ATOM 1462 CG PRO A 91 -10.381 6.455 6.954 1.00 2.12 C ATOM 1463 CD PRO A 91 -11.028 7.449 6.030 1.00 41.45 C ATOM 0 HA PRO A 91 -8.028 8.698 6.291 1.00 71.32 H new ATOM 0 HB2 PRO A 91 -8.340 6.252 7.570 1.00 14.42 H new ATOM 0 HB3 PRO A 91 -9.134 7.690 8.182 1.00 14.42 H new ATOM 0 HG2 PRO A 91 -10.265 5.487 6.466 1.00 2.12 H new ATOM 0 HG3 PRO A 91 -10.991 6.293 7.842 1.00 2.12 H new ATOM 0 HD2 PRO A 91 -11.655 6.957 5.286 1.00 41.45 H new ATOM 0 HD3 PRO A 91 -11.665 8.147 6.573 1.00 41.45 H new ATOM 1471 N LEU A 92 -6.767 7.579 4.516 1.00 31.45 N ATOM 1472 CA LEU A 92 -5.837 6.867 3.647 1.00 71.33 C ATOM 1473 C LEU A 92 -4.830 6.066 4.466 1.00 24.44 C ATOM 1474 O LEU A 92 -4.326 6.541 5.485 1.00 64.13 O ATOM 1475 CB LEU A 92 -5.102 7.852 2.736 1.00 72.40 C ATOM 1476 CG LEU A 92 -5.545 7.872 1.273 1.00 41.21 C ATOM 1477 CD1 LEU A 92 -6.203 9.200 0.932 1.00 33.20 C ATOM 1478 CD2 LEU A 92 -4.360 7.610 0.354 1.00 55.32 C ATOM 0 H LEU A 92 -6.625 8.589 4.548 1.00 31.45 H new ATOM 0 HA LEU A 92 -6.412 6.174 3.033 1.00 71.33 H new ATOM 0 HB2 LEU A 92 -5.224 8.855 3.145 1.00 72.40 H new ATOM 0 HB3 LEU A 92 -4.037 7.621 2.769 1.00 72.40 H new ATOM 0 HG LEU A 92 -6.278 7.079 1.124 1.00 41.21 H new ATOM 0 HD11 LEU A 92 -6.512 9.195 -0.113 1.00 33.20 H new ATOM 0 HD12 LEU A 92 -7.076 9.347 1.567 1.00 33.20 H new ATOM 0 HD13 LEU A 92 -5.493 10.011 1.097 1.00 33.20 H new ATOM 0 HD21 LEU A 92 -4.693 7.628 -0.684 1.00 55.32 H new ATOM 0 HD22 LEU A 92 -3.605 8.381 0.506 1.00 55.32 H new ATOM 0 HD23 LEU A 92 -3.932 6.633 0.581 1.00 55.32 H new ATOM 1490 N CYS A 93 -4.539 4.851 4.014 1.00 52.31 N ATOM 1491 CA CYS A 93 -3.591 3.985 4.705 1.00 62.23 C ATOM 1492 C CYS A 93 -2.659 3.299 3.712 1.00 21.30 C ATOM 1493 O CYS A 93 -2.979 3.171 2.529 1.00 24.25 O ATOM 1494 CB CYS A 93 -4.335 2.936 5.532 1.00 61.52 C ATOM 1495 SG CYS A 93 -5.273 3.619 6.919 1.00 61.35 S ATOM 0 H CYS A 93 -4.946 4.444 3.172 1.00 52.31 H new ATOM 0 HA CYS A 93 -2.991 4.604 5.372 1.00 62.23 H new ATOM 0 HB2 CYS A 93 -5.017 2.391 4.879 1.00 61.52 H new ATOM 0 HB3 CYS A 93 -3.615 2.213 5.915 1.00 61.52 H new ATOM 0 HG CYS A 93 -4.829 3.116 8.033 1.00 61.35 H new ATOM 1501 N PHE A 94 -1.502 2.860 4.199 1.00 41.34 N ATOM 1502 CA PHE A 94 -0.522 2.190 3.353 1.00 5.22 C ATOM 1503 C PHE A 94 -0.560 0.680 3.569 1.00 45.03 C ATOM 1504 O PHE A 94 -0.036 0.170 4.559 1.00 1.14 O ATOM 1505 CB PHE A 94 0.883 2.722 3.645 1.00 11.14 C ATOM 1506 CG PHE A 94 1.942 2.141 2.753 1.00 71.34 C ATOM 1507 CD1 PHE A 94 2.093 2.589 1.451 1.00 41.41 C ATOM 1508 CD2 PHE A 94 2.786 1.144 3.216 1.00 23.14 C ATOM 1509 CE1 PHE A 94 3.067 2.056 0.627 1.00 33.12 C ATOM 1510 CE2 PHE A 94 3.762 0.608 2.398 1.00 53.14 C ATOM 1511 CZ PHE A 94 3.901 1.063 1.101 1.00 24.31 C ATOM 0 H PHE A 94 -1.221 2.957 5.175 1.00 41.34 H new ATOM 0 HA PHE A 94 -0.774 2.398 2.313 1.00 5.22 H new ATOM 0 HB2 PHE A 94 0.882 3.806 3.535 1.00 11.14 H new ATOM 0 HB3 PHE A 94 1.136 2.507 4.683 1.00 11.14 H new ATOM 0 HD1 PHE A 94 1.442 3.364 1.075 1.00 41.41 H new ATOM 0 HD2 PHE A 94 2.680 0.782 4.228 1.00 23.14 H new ATOM 0 HE1 PHE A 94 3.175 2.416 -0.386 1.00 33.12 H new ATOM 0 HE2 PHE A 94 4.416 -0.166 2.772 1.00 53.14 H new ATOM 0 HZ PHE A 94 4.661 0.643 0.459 1.00 24.31 H new ATOM 1521 N ILE A 95 -1.184 -0.029 2.634 1.00 5.22 N ATOM 1522 CA ILE A 95 -1.291 -1.480 2.721 1.00 31.32 C ATOM 1523 C ILE A 95 -0.148 -2.161 1.975 1.00 42.24 C ATOM 1524 O ILE A 95 -0.164 -2.258 0.748 1.00 70.12 O ATOM 1525 CB ILE A 95 -2.631 -1.981 2.151 1.00 22.42 C ATOM 1526 CG1 ILE A 95 -3.800 -1.377 2.933 1.00 25.01 C ATOM 1527 CG2 ILE A 95 -2.689 -3.500 2.192 1.00 72.41 C ATOM 1528 CD1 ILE A 95 -5.155 -1.838 2.446 1.00 71.41 C ATOM 0 H ILE A 95 -1.623 0.378 1.808 1.00 5.22 H new ATOM 0 HA ILE A 95 -1.236 -1.738 3.779 1.00 31.32 H new ATOM 0 HB ILE A 95 -2.709 -1.662 1.112 1.00 22.42 H new ATOM 0 HG12 ILE A 95 -3.694 -1.636 3.986 1.00 25.01 H new ATOM 0 HG13 ILE A 95 -3.749 -0.290 2.865 1.00 25.01 H new ATOM 0 HG21 ILE A 95 -3.642 -3.839 1.786 1.00 72.41 H new ATOM 0 HG22 ILE A 95 -1.874 -3.911 1.597 1.00 72.41 H new ATOM 0 HG23 ILE A 95 -2.593 -3.840 3.223 1.00 72.41 H new ATOM 0 HD11 ILE A 95 -5.936 -1.370 3.046 1.00 71.41 H new ATOM 0 HD12 ILE A 95 -5.282 -1.555 1.401 1.00 71.41 H new ATOM 0 HD13 ILE A 95 -5.226 -2.922 2.540 1.00 71.41 H new ATOM 1540 N PHE A 96 0.843 -2.633 2.724 1.00 72.23 N ATOM 1541 CA PHE A 96 1.993 -3.306 2.134 1.00 23.23 C ATOM 1542 C PHE A 96 1.775 -4.815 2.085 1.00 25.42 C ATOM 1543 O PHE A 96 2.072 -5.527 3.045 1.00 32.22 O ATOM 1544 CB PHE A 96 3.261 -2.988 2.930 1.00 22.02 C ATOM 1545 CG PHE A 96 4.417 -3.889 2.603 1.00 34.14 C ATOM 1546 CD1 PHE A 96 4.588 -4.379 1.318 1.00 2.05 C ATOM 1547 CD2 PHE A 96 5.331 -4.248 3.580 1.00 23.23 C ATOM 1548 CE1 PHE A 96 5.651 -5.209 1.013 1.00 1.51 C ATOM 1549 CE2 PHE A 96 6.396 -5.077 3.282 1.00 41.22 C ATOM 1550 CZ PHE A 96 6.556 -5.559 1.997 1.00 75.14 C ATOM 0 H PHE A 96 0.872 -2.562 3.741 1.00 72.23 H new ATOM 0 HA PHE A 96 2.111 -2.941 1.114 1.00 23.23 H new ATOM 0 HB2 PHE A 96 3.551 -1.955 2.739 1.00 22.02 H new ATOM 0 HB3 PHE A 96 3.041 -3.065 3.995 1.00 22.02 H new ATOM 0 HD1 PHE A 96 3.883 -4.109 0.546 1.00 2.05 H new ATOM 0 HD2 PHE A 96 5.210 -3.876 4.587 1.00 23.23 H new ATOM 0 HE1 PHE A 96 5.774 -5.583 0.007 1.00 1.51 H new ATOM 0 HE2 PHE A 96 7.102 -5.348 4.053 1.00 41.22 H new ATOM 0 HZ PHE A 96 7.387 -6.208 1.762 1.00 75.14 H new ATOM 1560 N SER A 97 1.254 -5.296 0.962 1.00 41.35 N ATOM 1561 CA SER A 97 0.991 -6.720 0.788 1.00 5.13 C ATOM 1562 C SER A 97 2.267 -7.465 0.407 1.00 12.03 C ATOM 1563 O SER A 97 2.779 -7.316 -0.702 1.00 44.24 O ATOM 1564 CB SER A 97 -0.078 -6.936 -0.284 1.00 74.24 C ATOM 1565 OG SER A 97 -0.791 -8.140 -0.059 1.00 32.25 O ATOM 0 H SER A 97 1.005 -4.720 0.158 1.00 41.35 H new ATOM 0 HA SER A 97 0.629 -7.116 1.737 1.00 5.13 H new ATOM 0 HB2 SER A 97 -0.771 -6.094 -0.286 1.00 74.24 H new ATOM 0 HB3 SER A 97 0.390 -6.965 -1.268 1.00 74.24 H new ATOM 0 HG SER A 97 -1.719 -8.030 -0.353 1.00 32.25 H new ATOM 1571 N SER A 98 2.774 -8.270 1.336 1.00 3.41 N ATOM 1572 CA SER A 98 3.993 -9.036 1.101 1.00 51.13 C ATOM 1573 C SER A 98 3.812 -10.487 1.535 1.00 64.35 C ATOM 1574 O SER A 98 3.971 -10.837 2.705 1.00 51.23 O ATOM 1575 CB SER A 98 5.168 -8.409 1.852 1.00 3.22 C ATOM 1576 OG SER A 98 6.364 -8.505 1.099 1.00 65.04 O ATOM 0 H SER A 98 2.360 -8.409 2.258 1.00 3.41 H new ATOM 0 HA SER A 98 4.205 -9.018 0.032 1.00 51.13 H new ATOM 0 HB2 SER A 98 4.951 -7.362 2.064 1.00 3.22 H new ATOM 0 HB3 SER A 98 5.298 -8.908 2.812 1.00 3.22 H new ATOM 0 HG SER A 98 6.684 -7.606 0.878 1.00 65.04 H new ATOM 1582 N PRO A 99 3.474 -11.355 0.570 1.00 23.23 N ATOM 1583 CA PRO A 99 3.265 -12.783 0.827 1.00 63.32 C ATOM 1584 C PRO A 99 4.566 -13.509 1.158 1.00 55.11 C ATOM 1585 O PRO A 99 5.655 -12.955 1.002 1.00 53.32 O ATOM 1586 CB PRO A 99 2.686 -13.300 -0.492 1.00 61.10 C ATOM 1587 CG PRO A 99 3.186 -12.349 -1.524 1.00 24.52 C ATOM 1588 CD PRO A 99 3.268 -11.009 -0.847 1.00 24.43 C ATOM 0 HA PRO A 99 2.618 -12.952 1.688 1.00 63.32 H new ATOM 0 HB2 PRO A 99 3.017 -14.318 -0.698 1.00 61.10 H new ATOM 0 HB3 PRO A 99 1.596 -13.319 -0.466 1.00 61.10 H new ATOM 0 HG2 PRO A 99 4.162 -12.657 -1.899 1.00 24.52 H new ATOM 0 HG3 PRO A 99 2.513 -12.313 -2.380 1.00 24.52 H new ATOM 0 HD2 PRO A 99 4.091 -10.411 -1.238 1.00 24.43 H new ATOM 0 HD3 PRO A 99 2.356 -10.430 -0.991 1.00 24.43 H new ATOM 1596 N VAL A 100 4.445 -14.751 1.616 1.00 51.13 N ATOM 1597 CA VAL A 100 5.611 -15.553 1.968 1.00 42.53 C ATOM 1598 C VAL A 100 5.856 -16.648 0.937 1.00 75.43 C ATOM 1599 O VAL A 100 6.615 -17.585 1.179 1.00 23.13 O ATOM 1600 CB VAL A 100 5.451 -16.196 3.358 1.00 33.51 C ATOM 1601 CG1 VAL A 100 4.233 -17.108 3.387 1.00 53.45 C ATOM 1602 CG2 VAL A 100 6.709 -16.962 3.738 1.00 4.04 C ATOM 0 H VAL A 100 3.551 -15.224 1.752 1.00 51.13 H new ATOM 0 HA VAL A 100 6.466 -14.878 1.986 1.00 42.53 H new ATOM 0 HB VAL A 100 5.300 -15.404 4.091 1.00 33.51 H new ATOM 0 HG11 VAL A 100 4.136 -17.554 4.377 1.00 53.45 H new ATOM 0 HG12 VAL A 100 3.338 -16.528 3.161 1.00 53.45 H new ATOM 0 HG13 VAL A 100 4.351 -17.897 2.644 1.00 53.45 H new ATOM 0 HG21 VAL A 100 6.579 -17.410 4.723 1.00 4.04 H new ATOM 0 HG22 VAL A 100 6.893 -17.747 3.004 1.00 4.04 H new ATOM 0 HG23 VAL A 100 7.558 -16.279 3.760 1.00 4.04 H new ATOM 1612 N GLY A 101 5.205 -16.525 -0.216 1.00 44.00 N ATOM 1613 CA GLY A 101 5.366 -17.512 -1.268 1.00 54.20 C ATOM 1614 C GLY A 101 6.376 -17.086 -2.314 1.00 40.41 C ATOM 1615 O GLY A 101 6.848 -17.906 -3.103 1.00 2.34 O ATOM 0 H GLY A 101 4.569 -15.760 -0.440 1.00 44.00 H new ATOM 0 HA2 GLY A 101 5.680 -18.459 -0.829 1.00 54.20 H new ATOM 0 HA3 GLY A 101 4.403 -17.687 -1.748 1.00 54.20 H new ATOM 1619 N CYS A 102 6.708 -15.799 -2.325 1.00 1.42 N ATOM 1620 CA CYS A 102 7.667 -15.264 -3.285 1.00 12.25 C ATOM 1621 C CYS A 102 9.097 -15.575 -2.854 1.00 41.41 C ATOM 1622 O CYS A 102 9.326 -16.151 -1.792 1.00 21.14 O ATOM 1623 CB CYS A 102 7.483 -13.753 -3.434 1.00 32.42 C ATOM 1624 SG CYS A 102 7.984 -13.104 -5.045 1.00 11.23 S ATOM 0 H CYS A 102 6.327 -15.107 -1.680 1.00 1.42 H new ATOM 0 HA CYS A 102 7.485 -15.741 -4.248 1.00 12.25 H new ATOM 0 HB2 CYS A 102 6.435 -13.507 -3.265 1.00 32.42 H new ATOM 0 HB3 CYS A 102 8.058 -13.249 -2.657 1.00 32.42 H new ATOM 0 HG CYS A 102 7.023 -13.281 -5.902 1.00 11.23 H new ATOM 1630 N LYS A 103 10.058 -15.188 -3.688 1.00 34.12 N ATOM 1631 CA LYS A 103 11.466 -15.425 -3.396 1.00 15.12 C ATOM 1632 C LYS A 103 11.978 -14.437 -2.352 1.00 14.35 C ATOM 1633 O LYS A 103 11.479 -13.319 -2.223 1.00 0.34 O ATOM 1634 CB LYS A 103 12.299 -15.310 -4.674 1.00 23.13 C ATOM 1635 CG LYS A 103 11.639 -15.938 -5.889 1.00 61.21 C ATOM 1636 CD LYS A 103 11.656 -14.996 -7.081 1.00 1.20 C ATOM 1637 CE LYS A 103 13.076 -14.616 -7.472 1.00 22.50 C ATOM 1638 NZ LYS A 103 13.486 -15.250 -8.756 1.00 23.00 N ATOM 0 H LYS A 103 9.886 -14.709 -4.572 1.00 34.12 H new ATOM 0 HA LYS A 103 11.564 -16.434 -2.995 1.00 15.12 H new ATOM 0 HB2 LYS A 103 12.491 -14.257 -4.879 1.00 23.13 H new ATOM 0 HB3 LYS A 103 13.267 -15.784 -4.511 1.00 23.13 H new ATOM 0 HG2 LYS A 103 12.155 -16.863 -6.147 1.00 61.21 H new ATOM 0 HG3 LYS A 103 10.610 -16.204 -5.649 1.00 61.21 H new ATOM 0 HD2 LYS A 103 11.159 -15.470 -7.927 1.00 1.20 H new ATOM 0 HD3 LYS A 103 11.090 -14.096 -6.842 1.00 1.20 H new ATOM 0 HE2 LYS A 103 13.150 -13.532 -7.562 1.00 22.50 H new ATOM 0 HE3 LYS A 103 13.763 -14.918 -6.682 1.00 22.50 H new ATOM 0 HZ1 LYS A 103 14.459 -14.967 -8.988 1.00 23.00 H new ATOM 0 HZ2 LYS A 103 13.440 -16.285 -8.663 1.00 23.00 H new ATOM 0 HZ3 LYS A 103 12.846 -14.942 -9.515 1.00 23.00 H new ATOM 1652 N PRO A 104 12.999 -14.857 -1.589 1.00 42.53 N ATOM 1653 CA PRO A 104 13.602 -14.022 -0.546 1.00 34.55 C ATOM 1654 C PRO A 104 14.386 -12.848 -1.122 1.00 64.41 C ATOM 1655 O PRO A 104 14.777 -11.936 -0.396 1.00 2.40 O ATOM 1656 CB PRO A 104 14.541 -14.989 0.181 1.00 2.30 C ATOM 1657 CG PRO A 104 14.870 -16.031 -0.831 1.00 42.33 C ATOM 1658 CD PRO A 104 13.643 -16.177 -1.689 1.00 3.24 C ATOM 0 HA PRO A 104 12.850 -13.569 0.100 1.00 34.55 H new ATOM 0 HB2 PRO A 104 15.439 -14.480 0.532 1.00 2.30 H new ATOM 0 HB3 PRO A 104 14.060 -15.425 1.056 1.00 2.30 H new ATOM 0 HG2 PRO A 104 15.732 -15.735 -1.429 1.00 42.33 H new ATOM 0 HG3 PRO A 104 15.125 -16.975 -0.350 1.00 42.33 H new ATOM 0 HD2 PRO A 104 13.900 -16.422 -2.720 1.00 3.24 H new ATOM 0 HD3 PRO A 104 12.991 -16.971 -1.326 1.00 3.24 H new ATOM 1666 N GLU A 105 14.612 -12.880 -2.432 1.00 1.42 N ATOM 1667 CA GLU A 105 15.350 -11.817 -3.105 1.00 12.04 C ATOM 1668 C GLU A 105 14.460 -10.600 -3.339 1.00 63.41 C ATOM 1669 O GLU A 105 14.940 -9.468 -3.381 1.00 54.20 O ATOM 1670 CB GLU A 105 15.908 -12.319 -4.437 1.00 62.25 C ATOM 1671 CG GLU A 105 17.211 -13.090 -4.301 1.00 23.11 C ATOM 1672 CD GLU A 105 18.181 -12.431 -3.340 1.00 14.40 C ATOM 1673 OE1 GLU A 105 18.743 -11.374 -3.694 1.00 52.34 O ATOM 1674 OE2 GLU A 105 18.377 -12.972 -2.232 1.00 63.23 O ATOM 0 H GLU A 105 14.295 -13.629 -3.047 1.00 1.42 H new ATOM 0 HA GLU A 105 16.178 -11.520 -2.461 1.00 12.04 H new ATOM 0 HB2 GLU A 105 15.166 -12.959 -4.914 1.00 62.25 H new ATOM 0 HB3 GLU A 105 16.067 -11.467 -5.098 1.00 62.25 H new ATOM 0 HG2 GLU A 105 16.996 -14.102 -3.957 1.00 23.11 H new ATOM 0 HG3 GLU A 105 17.680 -13.179 -5.281 1.00 23.11 H new ATOM 1681 N GLN A 106 13.162 -10.844 -3.491 1.00 71.51 N ATOM 1682 CA GLN A 106 12.205 -9.769 -3.723 1.00 62.23 C ATOM 1683 C GLN A 106 11.593 -9.293 -2.410 1.00 45.21 C ATOM 1684 O GLN A 106 11.671 -8.113 -2.070 1.00 53.50 O ATOM 1685 CB GLN A 106 11.102 -10.236 -4.674 1.00 51.43 C ATOM 1686 CG GLN A 106 11.589 -11.200 -5.744 1.00 31.21 C ATOM 1687 CD GLN A 106 12.322 -10.501 -6.871 1.00 25.04 C ATOM 1688 OE1 GLN A 106 13.487 -10.792 -7.144 1.00 31.43 O ATOM 1689 NE2 GLN A 106 11.643 -9.571 -7.532 1.00 74.12 N ATOM 0 H GLN A 106 12.749 -11.776 -3.458 1.00 71.51 H new ATOM 0 HA GLN A 106 12.738 -8.934 -4.178 1.00 62.23 H new ATOM 0 HB2 GLN A 106 10.314 -10.717 -4.095 1.00 51.43 H new ATOM 0 HB3 GLN A 106 10.657 -9.366 -5.156 1.00 51.43 H new ATOM 0 HG2 GLN A 106 12.250 -11.938 -5.289 1.00 31.21 H new ATOM 0 HG3 GLN A 106 10.737 -11.744 -6.152 1.00 31.21 H new ATOM 0 HE21 GLN A 106 10.679 -9.362 -7.272 1.00 74.12 H new ATOM 0 HE22 GLN A 106 12.085 -9.066 -8.300 1.00 74.12 H new ATOM 1698 N GLN A 107 10.984 -10.219 -1.677 1.00 4.13 N ATOM 1699 CA GLN A 107 10.357 -9.892 -0.401 1.00 22.52 C ATOM 1700 C GLN A 107 11.148 -8.815 0.334 1.00 1.40 C ATOM 1701 O GLN A 107 10.576 -7.991 1.047 1.00 23.12 O ATOM 1702 CB GLN A 107 10.247 -11.144 0.472 1.00 32.41 C ATOM 1703 CG GLN A 107 8.828 -11.442 0.930 1.00 64.41 C ATOM 1704 CD GLN A 107 8.724 -11.615 2.433 1.00 4.30 C ATOM 1705 OE1 GLN A 107 8.304 -12.664 2.922 1.00 60.23 O ATOM 1706 NE2 GLN A 107 9.110 -10.583 3.175 1.00 32.15 N ATOM 0 H GLN A 107 10.911 -11.201 -1.944 1.00 4.13 H new ATOM 0 HA GLN A 107 9.357 -9.509 -0.604 1.00 22.52 H new ATOM 0 HB2 GLN A 107 10.628 -12.000 -0.085 1.00 32.41 H new ATOM 0 HB3 GLN A 107 10.885 -11.024 1.347 1.00 32.41 H new ATOM 0 HG2 GLN A 107 8.171 -10.631 0.615 1.00 64.41 H new ATOM 0 HG3 GLN A 107 8.474 -12.348 0.438 1.00 64.41 H new ATOM 0 HE21 GLN A 107 9.452 -9.733 2.727 1.00 32.15 H new ATOM 0 HE22 GLN A 107 9.065 -10.641 4.192 1.00 32.15 H new ATOM 1715 N MET A 108 12.464 -8.827 0.154 1.00 22.10 N ATOM 1716 CA MET A 108 13.333 -7.849 0.799 1.00 50.31 C ATOM 1717 C MET A 108 13.285 -6.512 0.066 1.00 11.13 C ATOM 1718 O MET A 108 13.192 -5.455 0.690 1.00 24.11 O ATOM 1719 CB MET A 108 14.772 -8.367 0.847 1.00 13.52 C ATOM 1720 CG MET A 108 15.010 -9.398 1.939 1.00 44.54 C ATOM 1721 SD MET A 108 16.713 -9.397 2.533 1.00 61.44 S ATOM 1722 CE MET A 108 17.592 -9.859 1.042 1.00 53.51 C ATOM 0 H MET A 108 12.953 -9.503 -0.433 1.00 22.10 H new ATOM 0 HA MET A 108 12.975 -7.698 1.817 1.00 50.31 H new ATOM 0 HB2 MET A 108 15.024 -8.807 -0.118 1.00 13.52 H new ATOM 0 HB3 MET A 108 15.448 -7.525 1.000 1.00 13.52 H new ATOM 0 HG2 MET A 108 14.338 -9.200 2.774 1.00 44.54 H new ATOM 0 HG3 MET A 108 14.762 -10.389 1.558 1.00 44.54 H new ATOM 0 HE1 MET A 108 18.650 -9.988 1.269 1.00 53.51 H new ATOM 0 HE2 MET A 108 17.187 -10.794 0.656 1.00 53.51 H new ATOM 0 HE3 MET A 108 17.474 -9.076 0.293 1.00 53.51 H new ATOM 1732 N MET A 109 13.349 -6.566 -1.260 1.00 75.32 N ATOM 1733 CA MET A 109 13.312 -5.359 -2.077 1.00 33.02 C ATOM 1734 C MET A 109 12.195 -4.427 -1.618 1.00 12.21 C ATOM 1735 O MET A 109 12.332 -3.205 -1.673 1.00 51.42 O ATOM 1736 CB MET A 109 13.117 -5.720 -3.551 1.00 25.21 C ATOM 1737 CG MET A 109 14.364 -6.294 -4.204 1.00 74.34 C ATOM 1738 SD MET A 109 14.036 -6.982 -5.839 1.00 43.32 S ATOM 1739 CE MET A 109 13.433 -5.533 -6.701 1.00 52.54 C ATOM 0 H MET A 109 13.427 -7.433 -1.792 1.00 75.32 H new ATOM 0 HA MET A 109 14.264 -4.842 -1.960 1.00 33.02 H new ATOM 0 HB2 MET A 109 12.306 -6.444 -3.636 1.00 25.21 H new ATOM 0 HB3 MET A 109 12.808 -4.829 -4.097 1.00 25.21 H new ATOM 0 HG2 MET A 109 15.119 -5.512 -4.288 1.00 74.34 H new ATOM 0 HG3 MET A 109 14.780 -7.072 -3.563 1.00 74.34 H new ATOM 0 HE1 MET A 109 13.137 -5.809 -7.713 1.00 52.54 H new ATOM 0 HE2 MET A 109 12.573 -5.125 -6.170 1.00 52.54 H new ATOM 0 HE3 MET A 109 14.222 -4.782 -6.746 1.00 52.54 H new ATOM 1749 N TYR A 110 11.091 -5.011 -1.167 1.00 33.10 N ATOM 1750 CA TYR A 110 9.948 -4.232 -0.701 1.00 65.13 C ATOM 1751 C TYR A 110 10.020 -4.009 0.806 1.00 72.30 C ATOM 1752 O TYR A 110 9.621 -2.959 1.308 1.00 15.25 O ATOM 1753 CB TYR A 110 8.641 -4.939 -1.063 1.00 33.31 C ATOM 1754 CG TYR A 110 8.511 -5.256 -2.536 1.00 52.41 C ATOM 1755 CD1 TYR A 110 9.296 -6.239 -3.126 1.00 43.55 C ATOM 1756 CD2 TYR A 110 7.603 -4.574 -3.336 1.00 12.14 C ATOM 1757 CE1 TYR A 110 9.181 -6.531 -4.472 1.00 40.51 C ATOM 1758 CE2 TYR A 110 7.480 -4.860 -4.681 1.00 73.31 C ATOM 1759 CZ TYR A 110 8.272 -5.839 -5.245 1.00 21.43 C ATOM 1760 OH TYR A 110 8.153 -6.128 -6.585 1.00 61.34 O ATOM 0 H TYR A 110 10.962 -6.021 -1.114 1.00 33.10 H new ATOM 0 HA TYR A 110 9.976 -3.261 -1.195 1.00 65.13 H new ATOM 0 HB2 TYR A 110 8.569 -5.865 -0.493 1.00 33.31 H new ATOM 0 HB3 TYR A 110 7.803 -4.312 -0.760 1.00 33.31 H new ATOM 0 HD1 TYR A 110 10.007 -6.784 -2.523 1.00 43.55 H new ATOM 0 HD2 TYR A 110 6.982 -3.806 -2.898 1.00 12.14 H new ATOM 0 HE1 TYR A 110 9.800 -7.297 -4.916 1.00 40.51 H new ATOM 0 HE2 TYR A 110 6.768 -4.321 -5.288 1.00 73.31 H new ATOM 0 HH TYR A 110 7.468 -5.552 -6.984 1.00 61.34 H new ATOM 1770 N ALA A 111 10.531 -5.006 1.521 1.00 33.21 N ATOM 1771 CA ALA A 111 10.657 -4.919 2.971 1.00 62.41 C ATOM 1772 C ALA A 111 11.688 -3.868 3.370 1.00 12.25 C ATOM 1773 O ALA A 111 11.649 -3.337 4.480 1.00 41.21 O ATOM 1774 CB ALA A 111 11.032 -6.275 3.551 1.00 72.32 C ATOM 0 H ALA A 111 10.864 -5.883 1.120 1.00 33.21 H new ATOM 0 HA ALA A 111 9.692 -4.617 3.377 1.00 62.41 H new ATOM 0 HB1 ALA A 111 11.123 -6.195 4.634 1.00 72.32 H new ATOM 0 HB2 ALA A 111 10.259 -7.003 3.304 1.00 72.32 H new ATOM 0 HB3 ALA A 111 11.984 -6.600 3.130 1.00 72.32 H new ATOM 1780 N GLY A 112 12.609 -3.573 2.458 1.00 4.14 N ATOM 1781 CA GLY A 112 13.638 -2.587 2.735 1.00 1.14 C ATOM 1782 C GLY A 112 13.321 -1.234 2.130 1.00 24.14 C ATOM 1783 O GLY A 112 13.720 -0.199 2.666 1.00 52.05 O ATOM 0 H GLY A 112 12.661 -3.999 1.533 1.00 4.14 H new ATOM 0 HA2 GLY A 112 13.755 -2.481 3.814 1.00 1.14 H new ATOM 0 HA3 GLY A 112 14.592 -2.942 2.344 1.00 1.14 H new ATOM 1787 N SER A 113 12.604 -1.241 1.011 1.00 1.54 N ATOM 1788 CA SER A 113 12.239 -0.003 0.331 1.00 62.54 C ATOM 1789 C SER A 113 10.855 0.468 0.766 1.00 12.44 C ATOM 1790 O SER A 113 10.426 1.570 0.424 1.00 31.12 O ATOM 1791 CB SER A 113 12.268 -0.204 -1.186 1.00 74.23 C ATOM 1792 OG SER A 113 13.413 -0.940 -1.582 1.00 15.23 O ATOM 0 H SER A 113 12.265 -2.089 0.556 1.00 1.54 H new ATOM 0 HA SER A 113 12.966 0.762 0.604 1.00 62.54 H new ATOM 0 HB2 SER A 113 11.367 -0.729 -1.504 1.00 74.23 H new ATOM 0 HB3 SER A 113 12.265 0.765 -1.684 1.00 74.23 H new ATOM 0 HG SER A 113 13.283 -1.888 -1.368 1.00 15.23 H new ATOM 1798 N LYS A 114 10.161 -0.373 1.525 1.00 44.12 N ATOM 1799 CA LYS A 114 8.827 -0.044 2.011 1.00 54.25 C ATOM 1800 C LYS A 114 8.815 1.325 2.682 1.00 15.03 C ATOM 1801 O LYS A 114 8.001 2.185 2.345 1.00 45.04 O ATOM 1802 CB LYS A 114 8.342 -1.111 2.995 1.00 54.14 C ATOM 1803 CG LYS A 114 7.263 -0.619 3.943 1.00 73.23 C ATOM 1804 CD LYS A 114 6.790 -1.725 4.871 1.00 11.43 C ATOM 1805 CE LYS A 114 7.284 -1.507 6.294 1.00 72.34 C ATOM 1806 NZ LYS A 114 6.514 -2.317 7.278 1.00 3.10 N ATOM 0 H LYS A 114 10.501 -1.289 1.817 1.00 44.12 H new ATOM 0 HA LYS A 114 8.153 -0.015 1.155 1.00 54.25 H new ATOM 0 HB2 LYS A 114 7.960 -1.964 2.434 1.00 54.14 H new ATOM 0 HB3 LYS A 114 9.191 -1.468 3.578 1.00 54.14 H new ATOM 0 HG2 LYS A 114 7.648 0.213 4.533 1.00 73.23 H new ATOM 0 HG3 LYS A 114 6.418 -0.239 3.369 1.00 73.23 H new ATOM 0 HD2 LYS A 114 5.701 -1.766 4.865 1.00 11.43 H new ATOM 0 HD3 LYS A 114 7.147 -2.687 4.504 1.00 11.43 H new ATOM 0 HE2 LYS A 114 8.340 -1.768 6.356 1.00 72.34 H new ATOM 0 HE3 LYS A 114 7.202 -0.451 6.549 1.00 72.34 H new ATOM 0 HZ1 LYS A 114 6.881 -2.141 8.235 1.00 3.10 H new ATOM 0 HZ2 LYS A 114 5.510 -2.050 7.237 1.00 3.10 H new ATOM 0 HZ3 LYS A 114 6.613 -3.327 7.050 1.00 3.10 H new ATOM 1820 N ASN A 115 9.720 1.521 3.635 1.00 64.34 N ATOM 1821 CA ASN A 115 9.814 2.786 4.353 1.00 41.22 C ATOM 1822 C ASN A 115 10.100 3.937 3.392 1.00 73.23 C ATOM 1823 O ASN A 115 9.516 5.015 3.508 1.00 64.22 O ATOM 1824 CB ASN A 115 10.910 2.712 5.417 1.00 1.53 C ATOM 1825 CG ASN A 115 10.346 2.557 6.817 1.00 71.40 C ATOM 1826 OD1 ASN A 115 9.804 3.502 7.389 1.00 43.11 O ATOM 1827 ND2 ASN A 115 10.473 1.358 7.375 1.00 12.12 N ATOM 0 H ASN A 115 10.399 0.819 3.928 1.00 64.34 H new ATOM 0 HA ASN A 115 8.856 2.971 4.839 1.00 41.22 H new ATOM 0 HB2 ASN A 115 11.569 1.872 5.198 1.00 1.53 H new ATOM 0 HB3 ASN A 115 11.519 3.615 5.371 1.00 1.53 H new ATOM 0 HD21 ASN A 115 10.114 1.192 8.315 1.00 12.12 H new ATOM 0 HD22 ASN A 115 10.930 0.603 6.863 1.00 12.12 H new ATOM 1834 N ARG A 116 11.001 3.700 2.445 1.00 72.25 N ATOM 1835 CA ARG A 116 11.363 4.716 1.464 1.00 65.50 C ATOM 1836 C ARG A 116 10.125 5.252 0.751 1.00 23.13 C ATOM 1837 O ARG A 116 9.863 6.455 0.760 1.00 54.12 O ATOM 1838 CB ARG A 116 12.346 4.140 0.441 1.00 55.31 C ATOM 1839 CG ARG A 116 12.725 5.121 -0.656 1.00 24.34 C ATOM 1840 CD ARG A 116 13.602 6.243 -0.120 1.00 53.15 C ATOM 1841 NE ARG A 116 15.018 5.888 -0.136 1.00 75.25 N ATOM 1842 CZ ARG A 116 15.636 5.286 0.874 1.00 33.30 C ATOM 1843 NH1 ARG A 116 14.964 4.973 1.974 1.00 1.51 N ATOM 1844 NH2 ARG A 116 16.926 4.994 0.785 1.00 4.22 N ATOM 0 H ARG A 116 11.494 2.814 2.336 1.00 72.25 H new ATOM 0 HA ARG A 116 11.840 5.541 1.993 1.00 65.50 H new ATOM 0 HB2 ARG A 116 13.250 3.819 0.959 1.00 55.31 H new ATOM 0 HB3 ARG A 116 11.906 3.252 -0.013 1.00 55.31 H new ATOM 0 HG2 ARG A 116 13.252 4.594 -1.451 1.00 24.34 H new ATOM 0 HG3 ARG A 116 11.822 5.542 -1.097 1.00 24.34 H new ATOM 0 HD2 ARG A 116 13.447 7.141 -0.718 1.00 53.15 H new ATOM 0 HD3 ARG A 116 13.300 6.483 0.900 1.00 53.15 H new ATOM 0 HE ARG A 116 15.563 6.115 -0.968 1.00 75.25 H new ATOM 0 HH11 ARG A 116 13.971 5.195 2.045 1.00 1.51 H new ATOM 0 HH12 ARG A 116 15.440 4.511 2.748 1.00 1.51 H new ATOM 0 HH21 ARG A 116 17.446 5.232 -0.060 1.00 4.22 H new ATOM 0 HH22 ARG A 116 17.399 4.532 1.562 1.00 4.22 H new ATOM 1858 N LEU A 117 9.368 4.351 0.135 1.00 32.21 N ATOM 1859 CA LEU A 117 8.158 4.733 -0.583 1.00 73.15 C ATOM 1860 C LEU A 117 7.164 5.418 0.350 1.00 42.34 C ATOM 1861 O LEU A 117 6.767 6.561 0.119 1.00 30.33 O ATOM 1862 CB LEU A 117 7.509 3.502 -1.220 1.00 44.35 C ATOM 1863 CG LEU A 117 6.124 3.713 -1.831 1.00 61.13 C ATOM 1864 CD1 LEU A 117 6.240 4.318 -3.222 1.00 41.13 C ATOM 1865 CD2 LEU A 117 5.357 2.400 -1.882 1.00 3.14 C ATOM 0 H LEU A 117 9.571 3.351 0.118 1.00 32.21 H new ATOM 0 HA LEU A 117 8.438 5.437 -1.367 1.00 73.15 H new ATOM 0 HB2 LEU A 117 8.174 3.127 -1.998 1.00 44.35 H new ATOM 0 HB3 LEU A 117 7.435 2.722 -0.462 1.00 44.35 H new ATOM 0 HG LEU A 117 5.572 4.409 -1.199 1.00 61.13 H new ATOM 0 HD11 LEU A 117 5.244 4.461 -3.641 1.00 41.13 H new ATOM 0 HD12 LEU A 117 6.749 5.280 -3.159 1.00 41.13 H new ATOM 0 HD13 LEU A 117 6.811 3.647 -3.864 1.00 41.13 H new ATOM 0 HD21 LEU A 117 4.373 2.570 -2.320 1.00 3.14 H new ATOM 0 HD22 LEU A 117 5.906 1.681 -2.491 1.00 3.14 H new ATOM 0 HD23 LEU A 117 5.241 2.007 -0.872 1.00 3.14 H new ATOM 1877 N VAL A 118 6.769 4.714 1.405 1.00 74.33 N ATOM 1878 CA VAL A 118 5.824 5.256 2.375 1.00 63.55 C ATOM 1879 C VAL A 118 6.167 6.698 2.730 1.00 4.10 C ATOM 1880 O VAL A 118 5.324 7.589 2.633 1.00 74.02 O ATOM 1881 CB VAL A 118 5.798 4.414 3.665 1.00 64.34 C ATOM 1882 CG1 VAL A 118 4.855 5.029 4.686 1.00 4.34 C ATOM 1883 CG2 VAL A 118 5.399 2.979 3.355 1.00 43.14 C ATOM 0 H VAL A 118 7.088 3.767 1.610 1.00 74.33 H new ATOM 0 HA VAL A 118 4.839 5.224 1.909 1.00 63.55 H new ATOM 0 HB VAL A 118 6.801 4.405 4.093 1.00 64.34 H new ATOM 0 HG11 VAL A 118 4.850 4.420 5.590 1.00 4.34 H new ATOM 0 HG12 VAL A 118 5.190 6.037 4.929 1.00 4.34 H new ATOM 0 HG13 VAL A 118 3.848 5.071 4.272 1.00 4.34 H new ATOM 0 HG21 VAL A 118 5.386 2.398 4.277 1.00 43.14 H new ATOM 0 HG22 VAL A 118 4.407 2.967 2.904 1.00 43.14 H new ATOM 0 HG23 VAL A 118 6.118 2.543 2.662 1.00 43.14 H new ATOM 1893 N GLN A 119 7.412 6.921 3.141 1.00 74.32 N ATOM 1894 CA GLN A 119 7.867 8.255 3.510 1.00 1.03 C ATOM 1895 C GLN A 119 7.613 9.249 2.381 1.00 62.12 C ATOM 1896 O GLN A 119 7.331 10.423 2.624 1.00 62.22 O ATOM 1897 CB GLN A 119 9.356 8.231 3.859 1.00 21.21 C ATOM 1898 CG GLN A 119 9.629 8.107 5.349 1.00 24.04 C ATOM 1899 CD GLN A 119 10.148 9.396 5.957 1.00 31.30 C ATOM 1900 OE1 GLN A 119 9.664 10.483 5.641 1.00 43.44 O ATOM 1901 NE2 GLN A 119 11.137 9.281 6.835 1.00 21.31 N ATOM 0 H GLN A 119 8.123 6.194 3.226 1.00 74.32 H new ATOM 0 HA GLN A 119 7.301 8.575 4.385 1.00 1.03 H new ATOM 0 HB2 GLN A 119 9.829 7.397 3.341 1.00 21.21 H new ATOM 0 HB3 GLN A 119 9.823 9.143 3.487 1.00 21.21 H new ATOM 0 HG2 GLN A 119 8.712 7.813 5.859 1.00 24.04 H new ATOM 0 HG3 GLN A 119 10.356 7.312 5.516 1.00 24.04 H new ATOM 0 HE21 GLN A 119 11.508 8.360 7.068 1.00 21.31 H new ATOM 0 HE22 GLN A 119 11.526 10.114 7.277 1.00 21.31 H new ATOM 1910 N THR A 120 7.715 8.771 1.145 1.00 45.23 N ATOM 1911 CA THR A 120 7.499 9.617 -0.022 1.00 43.13 C ATOM 1912 C THR A 120 6.052 10.090 -0.098 1.00 2.24 C ATOM 1913 O THR A 120 5.784 11.262 -0.360 1.00 64.20 O ATOM 1914 CB THR A 120 7.854 8.878 -1.326 1.00 11.33 C ATOM 1915 OG1 THR A 120 9.063 8.130 -1.151 1.00 33.52 O ATOM 1916 CG2 THR A 120 8.021 9.860 -2.476 1.00 22.44 C ATOM 0 H THR A 120 7.946 7.802 0.926 1.00 45.23 H new ATOM 0 HA THR A 120 8.156 10.480 0.088 1.00 43.13 H new ATOM 0 HB THR A 120 7.037 8.197 -1.566 1.00 11.33 H new ATOM 0 HG1 THR A 120 8.892 7.364 -0.564 1.00 33.52 H new ATOM 0 HG21 THR A 120 8.271 9.315 -3.386 1.00 22.44 H new ATOM 0 HG22 THR A 120 7.090 10.407 -2.625 1.00 22.44 H new ATOM 0 HG23 THR A 120 8.821 10.562 -2.242 1.00 22.44 H new ATOM 1924 N ALA A 121 5.121 9.171 0.135 1.00 33.53 N ATOM 1925 CA ALA A 121 3.700 9.494 0.096 1.00 4.41 C ATOM 1926 C ALA A 121 3.287 10.297 1.326 1.00 61.33 C ATOM 1927 O ALA A 121 2.308 11.042 1.290 1.00 13.02 O ATOM 1928 CB ALA A 121 2.871 8.223 -0.010 1.00 4.15 C ATOM 0 H ALA A 121 5.326 8.196 0.353 1.00 33.53 H new ATOM 0 HA ALA A 121 3.516 10.108 -0.786 1.00 4.41 H new ATOM 0 HB1 ALA A 121 1.812 8.480 -0.038 1.00 4.15 H new ATOM 0 HB2 ALA A 121 3.139 7.689 -0.922 1.00 4.15 H new ATOM 0 HB3 ALA A 121 3.067 7.588 0.854 1.00 4.15 H new ATOM 1934 N GLU A 122 4.038 10.139 2.410 1.00 1.21 N ATOM 1935 CA GLU A 122 3.747 10.849 3.650 1.00 13.43 C ATOM 1936 C GLU A 122 2.557 10.222 4.370 1.00 74.33 C ATOM 1937 O GLU A 122 1.739 10.922 4.968 1.00 24.12 O ATOM 1938 CB GLU A 122 3.464 12.325 3.365 1.00 70.14 C ATOM 1939 CG GLU A 122 4.121 13.273 4.354 1.00 13.35 C ATOM 1940 CD GLU A 122 3.653 13.045 5.779 1.00 62.33 C ATOM 1941 OE1 GLU A 122 3.970 11.976 6.343 1.00 62.12 O ATOM 1942 OE2 GLU A 122 2.972 13.935 6.329 1.00 32.50 O ATOM 0 H GLU A 122 4.852 9.526 2.455 1.00 1.21 H new ATOM 0 HA GLU A 122 4.622 10.772 4.296 1.00 13.43 H new ATOM 0 HB2 GLU A 122 3.810 12.565 2.360 1.00 70.14 H new ATOM 0 HB3 GLU A 122 2.386 12.489 3.379 1.00 70.14 H new ATOM 0 HG2 GLU A 122 5.203 13.149 4.307 1.00 13.35 H new ATOM 0 HG3 GLU A 122 3.905 14.301 4.065 1.00 13.35 H new ATOM 1949 N LEU A 123 2.465 8.898 4.306 1.00 33.40 N ATOM 1950 CA LEU A 123 1.374 8.175 4.950 1.00 32.42 C ATOM 1951 C LEU A 123 1.695 7.897 6.415 1.00 50.01 C ATOM 1952 O LEU A 123 2.581 7.102 6.729 1.00 43.01 O ATOM 1953 CB LEU A 123 1.105 6.859 4.217 1.00 22.31 C ATOM 1954 CG LEU A 123 0.699 6.980 2.748 1.00 2.24 C ATOM 1955 CD1 LEU A 123 1.106 5.733 1.977 1.00 41.53 C ATOM 1956 CD2 LEU A 123 -0.799 7.218 2.627 1.00 71.14 C ATOM 0 H LEU A 123 3.133 8.304 3.815 1.00 33.40 H new ATOM 0 HA LEU A 123 0.481 8.799 4.904 1.00 32.42 H new ATOM 0 HB2 LEU A 123 2.003 6.244 4.276 1.00 22.31 H new ATOM 0 HB3 LEU A 123 0.317 6.325 4.748 1.00 22.31 H new ATOM 0 HG LEU A 123 1.219 7.835 2.316 1.00 2.24 H new ATOM 0 HD11 LEU A 123 0.809 5.837 0.933 1.00 41.53 H new ATOM 0 HD12 LEU A 123 2.187 5.606 2.036 1.00 41.53 H new ATOM 0 HD13 LEU A 123 0.614 4.861 2.409 1.00 41.53 H new ATOM 0 HD21 LEU A 123 -1.070 7.302 1.575 1.00 71.14 H new ATOM 0 HD22 LEU A 123 -1.337 6.383 3.075 1.00 71.14 H new ATOM 0 HD23 LEU A 123 -1.064 8.140 3.144 1.00 71.14 H new ATOM 1968 N THR A 124 0.966 8.557 7.310 1.00 4.41 N ATOM 1969 CA THR A 124 1.172 8.381 8.743 1.00 41.35 C ATOM 1970 C THR A 124 0.714 7.001 9.199 1.00 50.31 C ATOM 1971 O THR A 124 1.108 6.525 10.263 1.00 64.41 O ATOM 1972 CB THR A 124 0.421 9.454 9.554 1.00 51.11 C ATOM 1973 OG1 THR A 124 0.518 9.167 10.953 1.00 10.03 O ATOM 1974 CG2 THR A 124 -1.042 9.517 9.143 1.00 33.34 C ATOM 0 H THR A 124 0.228 9.218 7.068 1.00 4.41 H new ATOM 0 HA THR A 124 2.242 8.483 8.924 1.00 41.35 H new ATOM 0 HB THR A 124 0.881 10.421 9.350 1.00 51.11 H new ATOM 0 HG1 THR A 124 0.039 9.854 11.462 1.00 10.03 H new ATOM 0 HG21 THR A 124 -1.552 10.282 9.729 1.00 33.34 H new ATOM 0 HG22 THR A 124 -1.112 9.765 8.084 1.00 33.34 H new ATOM 0 HG23 THR A 124 -1.512 8.550 9.321 1.00 33.34 H new ATOM 1982 N LYS A 125 -0.123 6.363 8.387 1.00 43.01 N ATOM 1983 CA LYS A 125 -0.634 5.035 8.706 1.00 10.22 C ATOM 1984 C LYS A 125 0.020 3.974 7.827 1.00 52.23 C ATOM 1985 O LYS A 125 -0.091 4.014 6.602 1.00 71.32 O ATOM 1986 CB LYS A 125 -2.153 4.996 8.527 1.00 73.45 C ATOM 1987 CG LYS A 125 -2.884 6.095 9.277 1.00 34.33 C ATOM 1988 CD LYS A 125 -4.030 5.538 10.105 1.00 30.14 C ATOM 1989 CE LYS A 125 -4.988 6.636 10.541 1.00 54.24 C ATOM 1990 NZ LYS A 125 -5.731 6.267 11.778 1.00 5.33 N ATOM 0 H LYS A 125 -0.462 6.744 7.504 1.00 43.01 H new ATOM 0 HA LYS A 125 -0.390 4.819 9.746 1.00 10.22 H new ATOM 0 HB2 LYS A 125 -2.387 5.075 7.465 1.00 73.45 H new ATOM 0 HB3 LYS A 125 -2.525 4.029 8.864 1.00 73.45 H new ATOM 0 HG2 LYS A 125 -2.185 6.619 9.928 1.00 34.33 H new ATOM 0 HG3 LYS A 125 -3.269 6.827 8.567 1.00 34.33 H new ATOM 0 HD2 LYS A 125 -4.571 4.791 9.524 1.00 30.14 H new ATOM 0 HD3 LYS A 125 -3.632 5.031 10.984 1.00 30.14 H new ATOM 0 HE2 LYS A 125 -4.430 7.557 10.714 1.00 54.24 H new ATOM 0 HE3 LYS A 125 -5.697 6.839 9.738 1.00 54.24 H new ATOM 0 HZ1 LYS A 125 -6.373 7.042 12.041 1.00 5.33 H new ATOM 0 HZ2 LYS A 125 -6.283 5.403 11.606 1.00 5.33 H new ATOM 0 HZ3 LYS A 125 -5.056 6.099 12.551 1.00 5.33 H new ATOM 2004 N VAL A 126 0.702 3.025 8.461 1.00 41.45 N ATOM 2005 CA VAL A 126 1.372 1.952 7.736 1.00 21.02 C ATOM 2006 C VAL A 126 0.886 0.586 8.206 1.00 74.24 C ATOM 2007 O VAL A 126 1.157 0.172 9.333 1.00 73.20 O ATOM 2008 CB VAL A 126 2.900 2.029 7.908 1.00 63.51 C ATOM 2009 CG1 VAL A 126 3.600 1.219 6.826 1.00 4.24 C ATOM 2010 CG2 VAL A 126 3.367 3.476 7.889 1.00 62.51 C ATOM 0 H VAL A 126 0.805 2.978 9.475 1.00 41.45 H new ATOM 0 HA VAL A 126 1.126 2.079 6.682 1.00 21.02 H new ATOM 0 HB VAL A 126 3.161 1.601 8.876 1.00 63.51 H new ATOM 0 HG11 VAL A 126 4.679 1.285 6.963 1.00 4.24 H new ATOM 0 HG12 VAL A 126 3.289 0.177 6.893 1.00 4.24 H new ATOM 0 HG13 VAL A 126 3.334 1.615 5.846 1.00 4.24 H new ATOM 0 HG21 VAL A 126 4.449 3.511 8.012 1.00 62.51 H new ATOM 0 HG22 VAL A 126 3.095 3.934 6.938 1.00 62.51 H new ATOM 0 HG23 VAL A 126 2.892 4.022 8.704 1.00 62.51 H new ATOM 2020 N PHE A 127 0.167 -0.113 7.332 1.00 13.02 N ATOM 2021 CA PHE A 127 -0.358 -1.433 7.657 1.00 24.33 C ATOM 2022 C PHE A 127 0.180 -2.486 6.691 1.00 14.45 C ATOM 2023 O PHE A 127 0.126 -2.309 5.475 1.00 40.14 O ATOM 2024 CB PHE A 127 -1.888 -1.422 7.617 1.00 43.11 C ATOM 2025 CG PHE A 127 -2.503 -0.395 8.523 1.00 31.55 C ATOM 2026 CD1 PHE A 127 -1.914 -0.080 9.738 1.00 70.40 C ATOM 2027 CD2 PHE A 127 -3.672 0.256 8.162 1.00 33.05 C ATOM 2028 CE1 PHE A 127 -2.478 0.865 10.573 1.00 33.24 C ATOM 2029 CE2 PHE A 127 -4.241 1.201 8.994 1.00 3.23 C ATOM 2030 CZ PHE A 127 -3.643 1.506 10.202 1.00 22.43 C ATOM 0 H PHE A 127 -0.065 0.214 6.394 1.00 13.02 H new ATOM 0 HA PHE A 127 -0.030 -1.688 8.665 1.00 24.33 H new ATOM 0 HB2 PHE A 127 -2.216 -1.236 6.594 1.00 43.11 H new ATOM 0 HB3 PHE A 127 -2.258 -2.409 7.895 1.00 43.11 H new ATOM 0 HD1 PHE A 127 -1.004 -0.579 10.035 1.00 70.40 H new ATOM 0 HD2 PHE A 127 -4.144 0.022 7.219 1.00 33.05 H new ATOM 0 HE1 PHE A 127 -2.008 1.102 11.516 1.00 33.24 H new ATOM 0 HE2 PHE A 127 -5.152 1.701 8.701 1.00 3.23 H new ATOM 0 HZ PHE A 127 -4.086 2.244 10.854 1.00 22.43 H new ATOM 2040 N GLU A 128 0.697 -3.578 7.244 1.00 44.21 N ATOM 2041 CA GLU A 128 1.246 -4.657 6.431 1.00 2.31 C ATOM 2042 C GLU A 128 0.410 -5.925 6.574 1.00 73.54 C ATOM 2043 O GLU A 128 -0.006 -6.286 7.674 1.00 34.23 O ATOM 2044 CB GLU A 128 2.696 -4.941 6.831 1.00 35.14 C ATOM 2045 CG GLU A 128 3.315 -6.111 6.086 1.00 34.00 C ATOM 2046 CD GLU A 128 4.588 -6.612 6.741 1.00 51.01 C ATOM 2047 OE1 GLU A 128 5.629 -5.937 6.609 1.00 13.15 O ATOM 2048 OE2 GLU A 128 4.541 -7.682 7.384 1.00 3.44 O ATOM 0 H GLU A 128 0.747 -3.739 8.250 1.00 44.21 H new ATOM 0 HA GLU A 128 1.220 -4.341 5.388 1.00 2.31 H new ATOM 0 HB2 GLU A 128 3.295 -4.048 6.651 1.00 35.14 H new ATOM 0 HB3 GLU A 128 2.736 -5.141 7.902 1.00 35.14 H new ATOM 0 HG2 GLU A 128 2.593 -6.926 6.033 1.00 34.00 H new ATOM 0 HG3 GLU A 128 3.532 -5.810 5.061 1.00 34.00 H new ATOM 2055 N ILE A 129 0.167 -6.596 5.452 1.00 14.43 N ATOM 2056 CA ILE A 129 -0.619 -7.824 5.452 1.00 12.43 C ATOM 2057 C ILE A 129 0.212 -9.008 4.972 1.00 31.13 C ATOM 2058 O ILE A 129 0.647 -9.050 3.821 1.00 13.14 O ATOM 2059 CB ILE A 129 -1.868 -7.692 4.560 1.00 0.33 C ATOM 2060 CG1 ILE A 129 -1.477 -7.192 3.169 1.00 55.15 C ATOM 2061 CG2 ILE A 129 -2.881 -6.754 5.201 1.00 24.22 C ATOM 2062 CD1 ILE A 129 -2.662 -6.823 2.304 1.00 60.42 C ATOM 0 H ILE A 129 0.503 -6.310 4.532 1.00 14.43 H new ATOM 0 HA ILE A 129 -0.934 -7.998 6.481 1.00 12.43 H new ATOM 0 HB ILE A 129 -2.328 -8.675 4.456 1.00 0.33 H new ATOM 0 HG12 ILE A 129 -0.829 -6.322 3.274 1.00 55.15 H new ATOM 0 HG13 ILE A 129 -0.896 -7.964 2.665 1.00 55.15 H new ATOM 0 HG21 ILE A 129 -3.758 -6.671 4.559 1.00 24.22 H new ATOM 0 HG22 ILE A 129 -3.179 -7.149 6.172 1.00 24.22 H new ATOM 0 HG23 ILE A 129 -2.433 -5.769 5.332 1.00 24.22 H new ATOM 0 HD11 ILE A 129 -2.309 -6.477 1.332 1.00 60.42 H new ATOM 0 HD12 ILE A 129 -3.300 -7.697 2.169 1.00 60.42 H new ATOM 0 HD13 ILE A 129 -3.232 -6.029 2.787 1.00 60.42 H new ATOM 2074 N ARG A 130 0.428 -9.972 5.862 1.00 13.31 N ATOM 2075 CA ARG A 130 1.206 -11.159 5.529 1.00 22.04 C ATOM 2076 C ARG A 130 0.674 -11.820 4.261 1.00 42.41 C ATOM 2077 O ARG A 130 1.429 -12.430 3.503 1.00 72.13 O ATOM 2078 CB ARG A 130 1.176 -12.156 6.688 1.00 0.24 C ATOM 2079 CG ARG A 130 1.722 -13.527 6.327 1.00 65.11 C ATOM 2080 CD ARG A 130 3.216 -13.474 6.044 1.00 74.34 C ATOM 2081 NE ARG A 130 4.010 -13.770 7.233 1.00 52.23 N ATOM 2082 CZ ARG A 130 4.123 -14.984 7.758 1.00 31.45 C ATOM 2083 NH1 ARG A 130 3.497 -16.012 7.201 1.00 62.01 N ATOM 2084 NH2 ARG A 130 4.864 -15.174 8.842 1.00 4.11 N ATOM 0 H ARG A 130 0.075 -9.954 6.819 1.00 13.31 H new ATOM 0 HA ARG A 130 2.236 -10.850 5.352 1.00 22.04 H new ATOM 0 HB2 ARG A 130 1.754 -11.752 7.519 1.00 0.24 H new ATOM 0 HB3 ARG A 130 0.149 -12.264 7.037 1.00 0.24 H new ATOM 0 HG2 ARG A 130 1.529 -14.223 7.143 1.00 65.11 H new ATOM 0 HG3 ARG A 130 1.198 -13.910 5.451 1.00 65.11 H new ATOM 0 HD2 ARG A 130 3.461 -14.188 5.258 1.00 74.34 H new ATOM 0 HD3 ARG A 130 3.479 -12.485 5.670 1.00 74.34 H new ATOM 0 HE ARG A 130 4.505 -13.001 7.685 1.00 52.23 H new ATOM 0 HH11 ARG A 130 2.927 -15.871 6.367 1.00 62.01 H new ATOM 0 HH12 ARG A 130 3.586 -16.944 7.607 1.00 62.01 H new ATOM 0 HH21 ARG A 130 5.348 -14.387 9.273 1.00 4.11 H new ATOM 0 HH22 ARG A 130 4.950 -16.108 9.244 1.00 4.11 H new ATOM 2098 N THR A 131 -0.630 -11.694 4.037 1.00 73.10 N ATOM 2099 CA THR A 131 -1.264 -12.280 2.863 1.00 63.12 C ATOM 2100 C THR A 131 -2.513 -11.502 2.465 1.00 64.11 C ATOM 2101 O THR A 131 -3.211 -10.951 3.317 1.00 72.31 O ATOM 2102 CB THR A 131 -1.645 -13.753 3.107 1.00 50.15 C ATOM 2103 OG1 THR A 131 -2.544 -14.202 2.086 1.00 43.44 O ATOM 2104 CG2 THR A 131 -2.295 -13.924 4.471 1.00 20.41 C ATOM 0 H THR A 131 -1.268 -11.191 4.654 1.00 73.10 H new ATOM 0 HA THR A 131 -0.536 -12.230 2.053 1.00 63.12 H new ATOM 0 HB THR A 131 -0.734 -14.351 3.078 1.00 50.15 H new ATOM 0 HG1 THR A 131 -2.780 -15.139 2.247 1.00 43.44 H new ATOM 0 HG21 THR A 131 -2.555 -14.972 4.621 1.00 20.41 H new ATOM 0 HG22 THR A 131 -1.599 -13.608 5.248 1.00 20.41 H new ATOM 0 HG23 THR A 131 -3.197 -13.315 4.523 1.00 20.41 H new ATOM 2112 N THR A 132 -2.790 -11.461 1.166 1.00 30.12 N ATOM 2113 CA THR A 132 -3.955 -10.750 0.656 1.00 14.31 C ATOM 2114 C THR A 132 -5.195 -11.055 1.489 1.00 62.44 C ATOM 2115 O THR A 132 -5.912 -10.147 1.909 1.00 51.42 O ATOM 2116 CB THR A 132 -4.237 -11.113 -0.814 1.00 63.23 C ATOM 2117 OG1 THR A 132 -4.186 -12.534 -0.986 1.00 60.10 O ATOM 2118 CG2 THR A 132 -3.226 -10.449 -1.739 1.00 74.22 C ATOM 0 H THR A 132 -2.223 -11.912 0.448 1.00 30.12 H new ATOM 0 HA THR A 132 -3.728 -9.686 0.723 1.00 14.31 H new ATOM 0 HB THR A 132 -5.233 -10.752 -1.070 1.00 63.23 H new ATOM 0 HG1 THR A 132 -4.368 -12.757 -1.923 1.00 60.10 H new ATOM 0 HG21 THR A 132 -3.445 -10.720 -2.772 1.00 74.22 H new ATOM 0 HG22 THR A 132 -3.287 -9.366 -1.627 1.00 74.22 H new ATOM 0 HG23 THR A 132 -2.222 -10.785 -1.481 1.00 74.22 H new ATOM 2126 N ASP A 133 -5.440 -12.339 1.726 1.00 71.44 N ATOM 2127 CA ASP A 133 -6.593 -12.765 2.511 1.00 43.41 C ATOM 2128 C ASP A 133 -6.853 -11.798 3.663 1.00 62.15 C ATOM 2129 O ASP A 133 -7.991 -11.630 4.100 1.00 52.42 O ATOM 2130 CB ASP A 133 -6.374 -14.177 3.054 1.00 62.21 C ATOM 2131 CG ASP A 133 -6.938 -15.245 2.137 1.00 30.03 C ATOM 2132 OD1 ASP A 133 -6.257 -15.601 1.153 1.00 21.40 O ATOM 2133 OD2 ASP A 133 -8.061 -15.722 2.403 1.00 53.21 O ATOM 0 H ASP A 133 -4.856 -13.103 1.386 1.00 71.44 H new ATOM 0 HA ASP A 133 -7.465 -12.767 1.858 1.00 43.41 H new ATOM 0 HB2 ASP A 133 -5.306 -14.348 3.192 1.00 62.21 H new ATOM 0 HB3 ASP A 133 -6.840 -14.262 4.036 1.00 62.21 H new ATOM 2138 N ASP A 134 -5.790 -11.167 4.149 1.00 34.43 N ATOM 2139 CA ASP A 134 -5.903 -10.218 5.251 1.00 42.42 C ATOM 2140 C ASP A 134 -6.707 -8.991 4.831 1.00 64.24 C ATOM 2141 O ASP A 134 -7.607 -8.551 5.546 1.00 72.40 O ATOM 2142 CB ASP A 134 -4.514 -9.793 5.730 1.00 41.25 C ATOM 2143 CG ASP A 134 -4.452 -9.610 7.234 1.00 24.31 C ATOM 2144 OD1 ASP A 134 -5.497 -9.294 7.836 1.00 12.14 O ATOM 2145 OD2 ASP A 134 -3.355 -9.783 7.808 1.00 62.14 O ATOM 0 H ASP A 134 -4.841 -11.295 3.798 1.00 34.43 H new ATOM 0 HA ASP A 134 -6.427 -10.711 6.070 1.00 42.42 H new ATOM 0 HB2 ASP A 134 -3.783 -10.543 5.428 1.00 41.25 H new ATOM 0 HB3 ASP A 134 -4.234 -8.860 5.241 1.00 41.25 H new ATOM 2150 N LEU A 135 -6.375 -8.444 3.666 1.00 2.35 N ATOM 2151 CA LEU A 135 -7.065 -7.266 3.151 1.00 21.23 C ATOM 2152 C LEU A 135 -8.576 -7.479 3.146 1.00 61.05 C ATOM 2153 O LEU A 135 -9.154 -7.885 2.136 1.00 62.10 O ATOM 2154 CB LEU A 135 -6.579 -6.945 1.737 1.00 52.12 C ATOM 2155 CG LEU A 135 -7.439 -5.963 0.938 1.00 3.14 C ATOM 2156 CD1 LEU A 135 -7.885 -4.806 1.820 1.00 63.04 C ATOM 2157 CD2 LEU A 135 -6.675 -5.448 -0.274 1.00 21.55 C ATOM 0 H LEU A 135 -5.633 -8.797 3.061 1.00 2.35 H new ATOM 0 HA LEU A 135 -6.837 -6.426 3.807 1.00 21.23 H new ATOM 0 HB2 LEU A 135 -5.569 -6.541 1.805 1.00 52.12 H new ATOM 0 HB3 LEU A 135 -6.512 -7.878 1.177 1.00 52.12 H new ATOM 0 HG LEU A 135 -8.326 -6.489 0.586 1.00 3.14 H new ATOM 0 HD11 LEU A 135 -8.495 -4.117 1.236 1.00 63.04 H new ATOM 0 HD12 LEU A 135 -8.470 -5.190 2.656 1.00 63.04 H new ATOM 0 HD13 LEU A 135 -7.009 -4.281 2.201 1.00 63.04 H new ATOM 0 HD21 LEU A 135 -7.302 -4.751 -0.830 1.00 21.55 H new ATOM 0 HD22 LEU A 135 -5.770 -4.938 0.056 1.00 21.55 H new ATOM 0 HD23 LEU A 135 -6.405 -6.286 -0.917 1.00 21.55 H new ATOM 2169 N THR A 136 -9.211 -7.202 4.279 1.00 35.35 N ATOM 2170 CA THR A 136 -10.655 -7.363 4.407 1.00 45.43 C ATOM 2171 C THR A 136 -11.308 -6.080 4.908 1.00 41.23 C ATOM 2172 O THR A 136 -10.720 -5.340 5.695 1.00 43.30 O ATOM 2173 CB THR A 136 -11.010 -8.515 5.365 1.00 40.44 C ATOM 2174 OG1 THR A 136 -10.010 -8.631 6.383 1.00 31.41 O ATOM 2175 CG2 THR A 136 -11.128 -9.830 4.609 1.00 11.12 C ATOM 0 H THR A 136 -8.748 -6.865 5.123 1.00 35.35 H new ATOM 0 HA THR A 136 -11.036 -7.598 3.413 1.00 45.43 H new ATOM 0 HB THR A 136 -11.972 -8.292 5.826 1.00 40.44 H new ATOM 0 HG1 THR A 136 -9.180 -8.971 5.989 1.00 31.41 H new ATOM 0 HG21 THR A 136 -11.379 -10.629 5.306 1.00 11.12 H new ATOM 0 HG22 THR A 136 -11.910 -9.747 3.855 1.00 11.12 H new ATOM 0 HG23 THR A 136 -10.179 -10.057 4.124 1.00 11.12 H new ATOM 2183 N GLU A 137 -12.528 -5.824 4.446 1.00 14.40 N ATOM 2184 CA GLU A 137 -13.261 -4.629 4.848 1.00 3.10 C ATOM 2185 C GLU A 137 -13.114 -4.379 6.346 1.00 34.54 C ATOM 2186 O GLU A 137 -12.865 -3.254 6.780 1.00 61.41 O ATOM 2187 CB GLU A 137 -14.741 -4.765 4.485 1.00 22.13 C ATOM 2188 CG GLU A 137 -15.558 -3.519 4.782 1.00 0.41 C ATOM 2189 CD GLU A 137 -17.004 -3.833 5.112 1.00 63.01 C ATOM 2190 OE1 GLU A 137 -17.262 -4.917 5.675 1.00 23.15 O ATOM 2191 OE2 GLU A 137 -17.877 -2.995 4.807 1.00 15.43 O ATOM 0 H GLU A 137 -13.029 -6.427 3.794 1.00 14.40 H new ATOM 0 HA GLU A 137 -12.840 -3.778 4.312 1.00 3.10 H new ATOM 0 HB2 GLU A 137 -14.826 -5.000 3.424 1.00 22.13 H new ATOM 0 HB3 GLU A 137 -15.165 -5.606 5.033 1.00 22.13 H new ATOM 0 HG2 GLU A 137 -15.107 -2.984 5.618 1.00 0.41 H new ATOM 0 HG3 GLU A 137 -15.523 -2.852 3.920 1.00 0.41 H new ATOM 2198 N THR A 138 -13.273 -5.439 7.135 1.00 52.02 N ATOM 2199 CA THR A 138 -13.161 -5.337 8.584 1.00 43.42 C ATOM 2200 C THR A 138 -11.724 -5.046 9.006 1.00 53.54 C ATOM 2201 O THR A 138 -11.443 -4.009 9.608 1.00 64.15 O ATOM 2202 CB THR A 138 -13.635 -6.628 9.277 1.00 52.40 C ATOM 2203 OG1 THR A 138 -14.938 -6.988 8.803 1.00 44.12 O ATOM 2204 CG2 THR A 138 -13.670 -6.449 10.788 1.00 75.51 C ATOM 0 H THR A 138 -13.480 -6.378 6.793 1.00 52.02 H new ATOM 0 HA THR A 138 -13.802 -4.511 8.892 1.00 43.42 H new ATOM 0 HB THR A 138 -12.929 -7.424 9.038 1.00 52.40 H new ATOM 0 HG1 THR A 138 -15.232 -7.811 9.247 1.00 44.12 H new ATOM 0 HG21 THR A 138 -14.008 -7.374 11.256 1.00 75.51 H new ATOM 0 HG22 THR A 138 -12.671 -6.204 11.149 1.00 75.51 H new ATOM 0 HG23 THR A 138 -14.356 -5.641 11.043 1.00 75.51 H new ATOM 2212 N TRP A 139 -10.822 -5.964 8.684 1.00 24.12 N ATOM 2213 CA TRP A 139 -9.413 -5.805 9.029 1.00 44.33 C ATOM 2214 C TRP A 139 -8.943 -4.381 8.753 1.00 53.31 C ATOM 2215 O TRP A 139 -7.984 -3.905 9.362 1.00 12.53 O ATOM 2216 CB TRP A 139 -8.558 -6.799 8.241 1.00 34.14 C ATOM 2217 CG TRP A 139 -7.106 -6.430 8.198 1.00 34.23 C ATOM 2218 CD1 TRP A 139 -6.132 -6.836 9.065 1.00 1.31 C ATOM 2219 CD2 TRP A 139 -6.465 -5.580 7.241 1.00 74.33 C ATOM 2220 NE1 TRP A 139 -4.924 -6.289 8.703 1.00 65.21 N ATOM 2221 CE2 TRP A 139 -5.102 -5.515 7.586 1.00 32.44 C ATOM 2222 CE3 TRP A 139 -6.911 -4.869 6.123 1.00 73.14 C ATOM 2223 CZ2 TRP A 139 -4.183 -4.767 6.856 1.00 31.23 C ATOM 2224 CZ3 TRP A 139 -5.998 -4.127 5.398 1.00 12.31 C ATOM 2225 CH2 TRP A 139 -4.646 -4.081 5.766 1.00 33.31 C ATOM 0 H TRP A 139 -11.040 -6.826 8.185 1.00 24.12 H new ATOM 0 HA TRP A 139 -9.301 -6.005 10.095 1.00 44.33 H new ATOM 0 HB2 TRP A 139 -8.661 -7.789 8.686 1.00 34.14 H new ATOM 0 HB3 TRP A 139 -8.939 -6.867 7.222 1.00 34.14 H new ATOM 0 HD1 TRP A 139 -6.288 -7.490 9.910 1.00 1.31 H new ATOM 0 HE1 TRP A 139 -4.038 -6.435 9.187 1.00 65.21 H new ATOM 0 HE3 TRP A 139 -7.950 -4.899 5.831 1.00 73.14 H new ATOM 0 HZ2 TRP A 139 -3.142 -4.729 7.140 1.00 31.23 H new ATOM 0 HZ3 TRP A 139 -6.332 -3.573 4.533 1.00 12.31 H new ATOM 0 HH2 TRP A 139 -3.957 -3.493 5.178 1.00 33.31 H new ATOM 2236 N LEU A 140 -9.623 -3.705 7.834 1.00 41.12 N ATOM 2237 CA LEU A 140 -9.275 -2.334 7.478 1.00 24.41 C ATOM 2238 C LEU A 140 -9.906 -1.342 8.450 1.00 64.40 C ATOM 2239 O LEU A 140 -9.205 -0.610 9.149 1.00 73.33 O ATOM 2240 CB LEU A 140 -9.729 -2.026 6.050 1.00 41.24 C ATOM 2241 CG LEU A 140 -9.738 -0.549 5.653 1.00 63.31 C ATOM 2242 CD1 LEU A 140 -8.487 0.149 6.163 1.00 23.54 C ATOM 2243 CD2 LEU A 140 -9.853 -0.404 4.143 1.00 55.23 C ATOM 0 H LEU A 140 -10.419 -4.084 7.321 1.00 41.12 H new ATOM 0 HA LEU A 140 -8.191 -2.233 7.538 1.00 24.41 H new ATOM 0 HB2 LEU A 140 -9.079 -2.563 5.359 1.00 41.24 H new ATOM 0 HB3 LEU A 140 -10.735 -2.424 5.916 1.00 41.24 H new ATOM 0 HG LEU A 140 -10.606 -0.075 6.111 1.00 63.31 H new ATOM 0 HD11 LEU A 140 -8.511 1.199 5.871 1.00 23.54 H new ATOM 0 HD12 LEU A 140 -8.447 0.076 7.250 1.00 23.54 H new ATOM 0 HD13 LEU A 140 -7.605 -0.326 5.734 1.00 23.54 H new ATOM 0 HD21 LEU A 140 -9.858 0.653 3.878 1.00 55.23 H new ATOM 0 HD22 LEU A 140 -9.005 -0.894 3.665 1.00 55.23 H new ATOM 0 HD23 LEU A 140 -10.779 -0.868 3.802 1.00 55.23 H new ATOM 2255 N LYS A 141 -11.234 -1.325 8.490 1.00 11.32 N ATOM 2256 CA LYS A 141 -11.961 -0.427 9.379 1.00 43.45 C ATOM 2257 C LYS A 141 -11.505 -0.604 10.824 1.00 54.15 C ATOM 2258 O LYS A 141 -11.709 0.276 11.659 1.00 42.12 O ATOM 2259 CB LYS A 141 -13.467 -0.679 9.272 1.00 25.13 C ATOM 2260 CG LYS A 141 -14.171 0.246 8.295 1.00 63.31 C ATOM 2261 CD LYS A 141 -15.329 -0.452 7.602 1.00 50.04 C ATOM 2262 CE LYS A 141 -16.667 -0.034 8.192 1.00 20.55 C ATOM 2263 NZ LYS A 141 -17.147 -1.002 9.217 1.00 71.13 N ATOM 0 H LYS A 141 -11.829 -1.923 7.917 1.00 11.32 H new ATOM 0 HA LYS A 141 -11.748 0.597 9.073 1.00 43.45 H new ATOM 0 HB2 LYS A 141 -13.633 -1.712 8.965 1.00 25.13 H new ATOM 0 HB3 LYS A 141 -13.917 -0.563 10.258 1.00 25.13 H new ATOM 0 HG2 LYS A 141 -14.539 1.124 8.825 1.00 63.31 H new ATOM 0 HG3 LYS A 141 -13.459 0.599 7.549 1.00 63.31 H new ATOM 0 HD2 LYS A 141 -15.311 -0.219 6.537 1.00 50.04 H new ATOM 0 HD3 LYS A 141 -15.211 -1.532 7.694 1.00 50.04 H new ATOM 0 HE2 LYS A 141 -16.573 0.954 8.642 1.00 20.55 H new ATOM 0 HE3 LYS A 141 -17.406 0.047 7.395 1.00 20.55 H new ATOM 0 HZ1 LYS A 141 -18.061 -0.682 9.595 1.00 71.13 H new ATOM 0 HZ2 LYS A 141 -17.261 -1.940 8.782 1.00 71.13 H new ATOM 0 HZ3 LYS A 141 -16.454 -1.061 9.990 1.00 71.13 H new ATOM 2277 N GLU A 142 -10.889 -1.746 11.109 1.00 42.44 N ATOM 2278 CA GLU A 142 -10.406 -2.037 12.454 1.00 45.34 C ATOM 2279 C GLU A 142 -9.291 -1.072 12.851 1.00 30.55 C ATOM 2280 O GLU A 142 -9.384 -0.384 13.868 1.00 70.42 O ATOM 2281 CB GLU A 142 -9.899 -3.479 12.537 1.00 54.14 C ATOM 2282 CG GLU A 142 -10.953 -4.466 13.010 1.00 70.32 C ATOM 2283 CD GLU A 142 -10.371 -5.579 13.858 1.00 24.50 C ATOM 2284 OE1 GLU A 142 -9.816 -5.275 14.936 1.00 71.41 O ATOM 2285 OE2 GLU A 142 -10.468 -6.754 13.446 1.00 3.21 O ATOM 0 H GLU A 142 -10.712 -2.484 10.428 1.00 42.44 H new ATOM 0 HA GLU A 142 -11.238 -1.911 13.147 1.00 45.34 H new ATOM 0 HB2 GLU A 142 -9.540 -3.786 11.555 1.00 54.14 H new ATOM 0 HB3 GLU A 142 -9.046 -3.517 13.215 1.00 54.14 H new ATOM 0 HG2 GLU A 142 -11.711 -3.934 13.585 1.00 70.32 H new ATOM 0 HG3 GLU A 142 -11.455 -4.898 12.144 1.00 70.32 H new ATOM 2292 N LYS A 143 -8.238 -1.028 12.042 1.00 54.41 N ATOM 2293 CA LYS A 143 -7.106 -0.148 12.307 1.00 61.13 C ATOM 2294 C LYS A 143 -7.550 1.310 12.361 1.00 71.11 C ATOM 2295 O LYS A 143 -7.095 2.078 13.209 1.00 23.35 O ATOM 2296 CB LYS A 143 -6.033 -0.326 11.230 1.00 10.40 C ATOM 2297 CG LYS A 143 -5.619 -1.772 11.017 1.00 20.11 C ATOM 2298 CD LYS A 143 -4.177 -2.006 11.435 1.00 53.00 C ATOM 2299 CE LYS A 143 -3.502 -3.041 10.549 1.00 44.15 C ATOM 2300 NZ LYS A 143 -2.029 -3.083 10.769 1.00 60.33 N ATOM 0 H LYS A 143 -8.145 -1.592 11.197 1.00 54.41 H new ATOM 0 HA LYS A 143 -6.688 -0.418 13.277 1.00 61.13 H new ATOM 0 HB2 LYS A 143 -6.404 0.079 10.289 1.00 10.40 H new ATOM 0 HB3 LYS A 143 -5.154 0.258 11.504 1.00 10.40 H new ATOM 0 HG2 LYS A 143 -6.276 -2.428 11.589 1.00 20.11 H new ATOM 0 HG3 LYS A 143 -5.742 -2.036 9.967 1.00 20.11 H new ATOM 0 HD2 LYS A 143 -3.625 -1.067 11.385 1.00 53.00 H new ATOM 0 HD3 LYS A 143 -4.147 -2.338 12.473 1.00 53.00 H new ATOM 0 HE2 LYS A 143 -3.927 -4.024 10.750 1.00 44.15 H new ATOM 0 HE3 LYS A 143 -3.707 -2.813 9.503 1.00 44.15 H new ATOM 0 HZ1 LYS A 143 -1.619 -3.868 10.223 1.00 60.33 H new ATOM 0 HZ2 LYS A 143 -1.606 -2.186 10.457 1.00 60.33 H new ATOM 0 HZ3 LYS A 143 -1.833 -3.225 11.780 1.00 60.33 H new ATOM 2314 N LEU A 144 -8.443 1.686 11.451 1.00 20.42 N ATOM 2315 CA LEU A 144 -8.951 3.052 11.397 1.00 61.24 C ATOM 2316 C LEU A 144 -9.775 3.377 12.637 1.00 30.23 C ATOM 2317 O LEU A 144 -9.571 4.407 13.278 1.00 12.42 O ATOM 2318 CB LEU A 144 -9.799 3.251 10.140 1.00 61.14 C ATOM 2319 CG LEU A 144 -9.194 2.737 8.832 1.00 12.11 C ATOM 2320 CD1 LEU A 144 -10.230 2.763 7.719 1.00 73.30 C ATOM 2321 CD2 LEU A 144 -7.975 3.561 8.448 1.00 40.20 C ATOM 0 H LEU A 144 -8.830 1.064 10.741 1.00 20.42 H new ATOM 0 HA LEU A 144 -8.098 3.730 11.364 1.00 61.24 H new ATOM 0 HB2 LEU A 144 -10.759 2.757 10.292 1.00 61.14 H new ATOM 0 HB3 LEU A 144 -10.003 4.316 10.029 1.00 61.14 H new ATOM 0 HG LEU A 144 -8.877 1.705 8.981 1.00 12.11 H new ATOM 0 HD11 LEU A 144 -9.782 2.394 6.796 1.00 73.30 H new ATOM 0 HD12 LEU A 144 -11.073 2.129 7.992 1.00 73.30 H new ATOM 0 HD13 LEU A 144 -10.578 3.785 7.570 1.00 73.30 H new ATOM 0 HD21 LEU A 144 -7.558 3.181 7.515 1.00 40.20 H new ATOM 0 HD22 LEU A 144 -8.267 4.603 8.317 1.00 40.20 H new ATOM 0 HD23 LEU A 144 -7.225 3.490 9.236 1.00 40.20 H new ATOM 2333 N ALA A 145 -10.706 2.490 12.971 1.00 75.30 N ATOM 2334 CA ALA A 145 -11.559 2.680 14.138 1.00 13.11 C ATOM 2335 C ALA A 145 -10.786 3.323 15.284 1.00 23.45 C ATOM 2336 O ALA A 145 -11.071 4.452 15.681 1.00 2.32 O ATOM 2337 CB ALA A 145 -12.154 1.350 14.579 1.00 14.43 C ATOM 0 H ALA A 145 -10.889 1.632 12.450 1.00 75.30 H new ATOM 0 HA ALA A 145 -12.370 3.353 13.859 1.00 13.11 H new ATOM 0 HB1 ALA A 145 -12.789 1.507 15.451 1.00 14.43 H new ATOM 0 HB2 ALA A 145 -12.749 0.931 13.768 1.00 14.43 H new ATOM 0 HB3 ALA A 145 -11.351 0.659 14.834 1.00 14.43 H new