USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1052 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 41 LYS NZ :NH3+ 180:sc= 2.22 (180deg=1.08) USER MOD Set 1.2: A 184 ASN : amide:sc= 1.02 K(o=3.2,f=-13!) USER MOD Set 2.1: A 130 ASN : amide:sc= -1.31! X(o=-0.65!,f=-0.15) USER MOD Set 2.2: A 133 ASN : amide:sc= 0.662 X(o=-0.65,f=-0.15) USER MOD Set 3.1: A 88 ASN : amide:sc= 0.453 X(o=0.88,f=0.62) USER MOD Set 3.2: A 142 TYR OH : rot 180:sc= 0.423 USER MOD Set 4.1: A 40 HIS : no HE2:sc= 2.01 K(o=2.2,f=-12!) USER MOD Set 4.2: A 65 LYS NZ :NH3+ 149:sc= 0.323 (180deg=0) USER MOD Set 4.3: A 179 HIS : no HE2:sc= -0.448 K(o=2.2,f=-6.2!) USER MOD Set 4.4: A 181 TYR OH : rot 180:sc= 0.304 USER MOD Set 5.1: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 36 SER OG : rot 105:sc= 1.19 USER MOD Single : A 32 THR OG1 : rot -24:sc= 0.309 USER MOD Single : A 33 THR OG1 : rot 147:sc= 1.38 USER MOD Single : A 34 THR OG1 : rot 17:sc= 0.403 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 161:sc= -0.319 (180deg=-0.874) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.988 K(o=0.99,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 72 ASN : amide:sc= -0.0987 K(o=-0.099,f=-1.9) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl -167:sc= 0 (180deg=-0.154) USER MOD Single : A 84 THR OG1 : rot -23:sc= 0.836 USER MOD Single : A 85 ASN : amide:sc= -0.0587 X(o=-0.059,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= 1.15 K(o=1.2,f=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.438 X(o=-0.44,f=-0.029) USER MOD Single : A 105 GLN : amide:sc= -0.0635 X(o=-0.063,f=-0.063) USER MOD Single : A 106 THR OG1 : rot -170:sc= -0.218 USER MOD Single : A 108 LYS NZ :NH3+ 177:sc= 0.794 (180deg=0.789) USER MOD Single : A 110 SER OG : rot -42:sc= 0.389 USER MOD Single : A 113 MET CE :methyl 169:sc= -0.0225 (180deg=-0.0791) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.247 USER MOD Single : A 118 MET CE :methyl 144:sc= -0.621 (180deg=-1.8!) USER MOD Single : A 119 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0158) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 160:sc= 0.0163 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot 5:sc= 0.536 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0626 X(o=-0.063,f=-0.25) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ -164:sc= -0.012 (180deg=-0.148) USER MOD Single : A 173 ASN : amide:sc= -0.0941 X(o=-0.094,f=-0.094) USER MOD Single : A 183 LYS NZ :NH3+ 165:sc= -0.0312 (180deg=-0.445) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -1.275 -20.501 -2.649 1.00 1.39 N ATOM 168 CA THR A 32 -0.347 -19.418 -3.027 1.00 1.15 C ATOM 169 C THR A 32 1.074 -19.856 -3.392 1.00 1.19 C ATOM 170 O THR A 32 1.409 -21.040 -3.337 1.00 1.57 O ATOM 171 CB THR A 32 -0.290 -18.392 -1.881 1.00 1.12 C ATOM 172 OG1 THR A 32 -0.171 -19.015 -0.619 1.00 1.43 O ATOM 173 CG2 THR A 32 -1.562 -17.568 -1.852 1.00 1.11 C ATOM 0 HA THR A 32 -0.752 -18.992 -3.945 1.00 1.15 H new ATOM 0 HB THR A 32 0.585 -17.769 -2.067 1.00 1.12 H new ATOM 0 HG1 THR A 32 -0.522 -19.929 -0.671 1.00 1.43 H new ATOM 0 HG21 THR A 32 -1.509 -16.846 -1.037 1.00 1.11 H new ATOM 0 HG22 THR A 32 -1.675 -17.039 -2.798 1.00 1.11 H new ATOM 0 HG23 THR A 32 -2.418 -18.225 -1.700 1.00 1.11 H new ATOM 181 N THR A 33 1.922 -18.883 -3.753 1.00 0.88 N ATOM 182 CA THR A 33 3.351 -19.072 -4.077 1.00 0.89 C ATOM 183 C THR A 33 4.307 -18.250 -3.196 1.00 0.88 C ATOM 184 O THR A 33 5.523 -18.281 -3.386 1.00 1.21 O ATOM 185 CB THR A 33 3.602 -18.724 -5.551 1.00 1.04 C ATOM 186 OG1 THR A 33 3.294 -17.373 -5.802 1.00 1.45 O ATOM 187 CG2 THR A 33 2.748 -19.558 -6.504 1.00 1.37 C ATOM 0 H THR A 33 1.627 -17.910 -3.831 1.00 0.88 H new ATOM 0 HA THR A 33 3.566 -20.122 -3.879 1.00 0.89 H new ATOM 0 HB THR A 33 4.657 -18.933 -5.728 1.00 1.04 H new ATOM 0 HG1 THR A 33 3.895 -17.023 -6.492 1.00 1.45 H new ATOM 0 HG21 THR A 33 2.965 -19.271 -7.533 1.00 1.37 H new ATOM 0 HG22 THR A 33 2.976 -20.615 -6.366 1.00 1.37 H new ATOM 0 HG23 THR A 33 1.693 -19.384 -6.294 1.00 1.37 H new ATOM 195 N THR A 34 3.789 -17.466 -2.247 1.00 0.84 N ATOM 196 CA THR A 34 4.529 -16.464 -1.447 1.00 0.88 C ATOM 197 C THR A 34 3.801 -16.194 -0.118 1.00 0.70 C ATOM 198 O THR A 34 2.601 -16.453 -0.018 1.00 0.83 O ATOM 199 CB THR A 34 4.691 -15.194 -2.305 1.00 1.42 C ATOM 200 OG1 THR A 34 5.730 -15.377 -3.237 1.00 2.60 O ATOM 201 CG2 THR A 34 5.006 -13.894 -1.575 1.00 0.89 C ATOM 0 H THR A 34 2.801 -17.507 -1.998 1.00 0.84 H new ATOM 0 HA THR A 34 5.520 -16.832 -1.180 1.00 0.88 H new ATOM 0 HB THR A 34 3.701 -15.075 -2.746 1.00 1.42 H new ATOM 0 HG1 THR A 34 5.927 -16.333 -3.324 1.00 2.60 H new ATOM 0 HG21 THR A 34 5.093 -13.083 -2.298 1.00 0.89 H new ATOM 0 HG22 THR A 34 4.205 -13.668 -0.871 1.00 0.89 H new ATOM 0 HG23 THR A 34 5.946 -14.000 -1.033 1.00 0.89 H new ATOM 209 N THR A 35 4.507 -15.682 0.899 1.00 0.78 N ATOM 210 CA THR A 35 4.022 -15.460 2.287 1.00 0.69 C ATOM 211 C THR A 35 4.002 -13.997 2.756 1.00 0.66 C ATOM 212 O THR A 35 3.434 -13.689 3.810 1.00 0.70 O ATOM 213 CB THR A 35 4.877 -16.253 3.289 1.00 0.94 C ATOM 214 OG1 THR A 35 6.250 -15.948 3.151 1.00 1.19 O ATOM 215 CG2 THR A 35 4.681 -17.757 3.147 1.00 1.11 C ATOM 0 H THR A 35 5.479 -15.395 0.781 1.00 0.78 H new ATOM 0 HA THR A 35 2.987 -15.802 2.259 1.00 0.69 H new ATOM 0 HB THR A 35 4.539 -15.952 4.281 1.00 0.94 H new ATOM 0 HG1 THR A 35 6.767 -16.466 3.802 1.00 1.19 H new ATOM 0 HG21 THR A 35 5.305 -18.276 3.875 1.00 1.11 H new ATOM 0 HG22 THR A 35 3.635 -18.006 3.323 1.00 1.11 H new ATOM 0 HG23 THR A 35 4.963 -18.067 2.141 1.00 1.11 H new ATOM 223 N SER A 36 4.626 -13.092 2.003 1.00 0.66 N ATOM 224 CA SER A 36 4.804 -11.679 2.332 1.00 0.66 C ATOM 225 C SER A 36 4.713 -10.763 1.110 1.00 0.63 C ATOM 226 O SER A 36 5.007 -11.145 -0.025 1.00 0.76 O ATOM 227 CB SER A 36 6.132 -11.452 3.075 1.00 0.80 C ATOM 228 OG SER A 36 7.214 -12.204 2.543 1.00 2.22 O ATOM 0 H SER A 36 5.041 -13.336 1.104 1.00 0.66 H new ATOM 0 HA SER A 36 3.976 -11.411 2.989 1.00 0.66 H new ATOM 0 HB2 SER A 36 6.383 -10.392 3.038 1.00 0.80 H new ATOM 0 HB3 SER A 36 6.001 -11.712 4.125 1.00 0.80 H new ATOM 0 HG SER A 36 7.800 -11.613 2.026 1.00 2.22 H new ATOM 234 N VAL A 37 4.315 -9.523 1.379 1.00 0.52 N ATOM 235 CA VAL A 37 4.238 -8.412 0.433 1.00 0.49 C ATOM 236 C VAL A 37 4.924 -7.188 1.041 1.00 0.45 C ATOM 237 O VAL A 37 4.699 -6.879 2.210 1.00 0.49 O ATOM 238 CB VAL A 37 2.784 -8.138 0.000 1.00 0.46 C ATOM 239 CG1 VAL A 37 1.887 -7.756 1.165 1.00 0.42 C ATOM 240 CG2 VAL A 37 2.693 -7.066 -1.092 1.00 0.47 C ATOM 0 H VAL A 37 4.020 -9.250 2.317 1.00 0.52 H new ATOM 0 HA VAL A 37 4.768 -8.673 -0.483 1.00 0.49 H new ATOM 0 HB VAL A 37 2.426 -9.082 -0.410 1.00 0.46 H new ATOM 0 HG11 VAL A 37 0.876 -7.575 0.801 1.00 0.42 H new ATOM 0 HG12 VAL A 37 1.871 -8.567 1.893 1.00 0.42 H new ATOM 0 HG13 VAL A 37 2.270 -6.852 1.638 1.00 0.42 H new ATOM 0 HG21 VAL A 37 1.649 -6.910 -1.362 1.00 0.47 H new ATOM 0 HG22 VAL A 37 3.116 -6.132 -0.721 1.00 0.47 H new ATOM 0 HG23 VAL A 37 3.250 -7.393 -1.970 1.00 0.47 H new ATOM 250 N THR A 38 5.749 -6.480 0.271 1.00 0.43 N ATOM 251 CA THR A 38 6.402 -5.241 0.730 1.00 0.41 C ATOM 252 C THR A 38 5.902 -4.046 -0.071 1.00 0.42 C ATOM 253 O THR A 38 5.931 -4.050 -1.300 1.00 0.41 O ATOM 254 CB THR A 38 7.933 -5.346 0.713 1.00 0.51 C ATOM 255 OG1 THR A 38 8.329 -6.427 1.524 1.00 0.85 O ATOM 256 CG2 THR A 38 8.620 -4.127 1.321 1.00 0.58 C ATOM 0 H THR A 38 5.987 -6.742 -0.686 1.00 0.43 H new ATOM 0 HA THR A 38 6.124 -5.088 1.773 1.00 0.41 H new ATOM 0 HB THR A 38 8.216 -5.452 -0.334 1.00 0.51 H new ATOM 0 HG1 THR A 38 9.306 -6.501 1.516 1.00 0.85 H new ATOM 0 HG21 THR A 38 9.701 -4.261 1.280 1.00 0.58 H new ATOM 0 HG22 THR A 38 8.343 -3.235 0.759 1.00 0.58 H new ATOM 0 HG23 THR A 38 8.307 -4.013 2.359 1.00 0.58 H new ATOM 264 N VAL A 39 5.417 -3.018 0.621 1.00 0.50 N ATOM 265 CA VAL A 39 4.909 -1.778 0.014 1.00 0.56 C ATOM 266 C VAL A 39 5.994 -0.700 0.021 1.00 0.60 C ATOM 267 O VAL A 39 6.651 -0.459 1.034 1.00 0.62 O ATOM 268 CB VAL A 39 3.581 -1.340 0.661 1.00 0.66 C ATOM 269 CG1 VAL A 39 3.629 -1.269 2.180 1.00 0.80 C ATOM 270 CG2 VAL A 39 3.093 0.015 0.149 1.00 0.74 C ATOM 0 H VAL A 39 5.363 -3.018 1.640 1.00 0.50 H new ATOM 0 HA VAL A 39 4.668 -1.961 -1.033 1.00 0.56 H new ATOM 0 HB VAL A 39 2.886 -2.126 0.366 1.00 0.66 H new ATOM 0 HG11 VAL A 39 2.657 -0.954 2.560 1.00 0.80 H new ATOM 0 HG12 VAL A 39 3.875 -2.252 2.583 1.00 0.80 H new ATOM 0 HG13 VAL A 39 4.389 -0.551 2.487 1.00 0.80 H new ATOM 0 HG21 VAL A 39 2.154 0.272 0.639 1.00 0.74 H new ATOM 0 HG22 VAL A 39 3.839 0.778 0.371 1.00 0.74 H new ATOM 0 HG23 VAL A 39 2.937 -0.038 -0.929 1.00 0.74 H new ATOM 280 N HIS A 40 6.169 -0.055 -1.129 1.00 0.61 N ATOM 281 CA HIS A 40 7.215 0.935 -1.401 1.00 0.69 C ATOM 282 C HIS A 40 6.586 2.203 -2.003 1.00 0.99 C ATOM 283 O HIS A 40 6.269 2.255 -3.191 1.00 2.07 O ATOM 284 CB HIS A 40 8.235 0.321 -2.369 1.00 0.71 C ATOM 285 CG HIS A 40 8.831 -0.998 -1.947 1.00 0.59 C ATOM 286 ND1 HIS A 40 9.976 -1.189 -1.213 1.00 0.63 N ATOM 287 CD2 HIS A 40 8.376 -2.236 -2.308 1.00 0.56 C ATOM 288 CE1 HIS A 40 10.212 -2.506 -1.135 1.00 0.65 C ATOM 289 NE2 HIS A 40 9.275 -3.193 -1.811 1.00 0.57 N ATOM 0 H HIS A 40 5.562 -0.212 -1.933 1.00 0.61 H new ATOM 0 HA HIS A 40 7.721 1.213 -0.476 1.00 0.69 H new ATOM 0 HB2 HIS A 40 7.753 0.187 -3.337 1.00 0.71 H new ATOM 0 HB3 HIS A 40 9.046 1.035 -2.513 1.00 0.71 H new ATOM 0 HD1 HIS A 40 10.549 -0.454 -0.798 1.00 0.63 H new ATOM 0 HD2 HIS A 40 7.481 -2.442 -2.876 1.00 0.56 H new ATOM 0 HE1 HIS A 40 11.039 -2.953 -0.603 1.00 0.65 H new ATOM 297 N LYS A 41 6.344 3.236 -1.187 1.00 0.37 N ATOM 298 CA LYS A 41 5.551 4.399 -1.615 1.00 0.43 C ATOM 299 C LYS A 41 6.345 5.317 -2.555 1.00 0.42 C ATOM 300 O LYS A 41 7.427 5.784 -2.194 1.00 0.48 O ATOM 301 CB LYS A 41 4.983 5.121 -0.379 1.00 0.59 C ATOM 302 CG LYS A 41 3.783 6.020 -0.725 1.00 0.93 C ATOM 303 CD LYS A 41 4.166 7.443 -1.165 1.00 0.82 C ATOM 304 CE LYS A 41 3.044 8.056 -2.001 1.00 0.77 C ATOM 305 NZ LYS A 41 1.854 8.378 -1.191 1.00 0.95 N ATOM 0 H LYS A 41 6.685 3.292 -0.227 1.00 0.37 H new ATOM 0 HA LYS A 41 4.703 4.058 -2.209 1.00 0.43 H new ATOM 0 HB2 LYS A 41 4.678 4.382 0.362 1.00 0.59 H new ATOM 0 HB3 LYS A 41 5.767 5.726 0.077 1.00 0.59 H new ATOM 0 HG2 LYS A 41 3.208 5.548 -1.522 1.00 0.93 H new ATOM 0 HG3 LYS A 41 3.129 6.085 0.145 1.00 0.93 H new ATOM 0 HD2 LYS A 41 4.358 8.063 -0.289 1.00 0.82 H new ATOM 0 HD3 LYS A 41 5.089 7.416 -1.745 1.00 0.82 H new ATOM 0 HE2 LYS A 41 3.408 8.963 -2.484 1.00 0.77 H new ATOM 0 HE3 LYS A 41 2.764 7.362 -2.794 1.00 0.77 H new ATOM 0 HZ1 LYS A 41 1.120 8.791 -1.801 1.00 0.95 H new ATOM 0 HZ2 LYS A 41 1.489 7.510 -0.750 1.00 0.95 H new ATOM 0 HZ3 LYS A 41 2.113 9.060 -0.450 1.00 0.95 H new ATOM 319 N LEU A 42 5.776 5.607 -3.729 1.00 0.41 N ATOM 320 CA LEU A 42 6.394 6.441 -4.765 1.00 0.39 C ATOM 321 C LEU A 42 5.810 7.856 -4.833 1.00 0.39 C ATOM 322 O LEU A 42 4.634 8.080 -4.549 1.00 0.43 O ATOM 323 CB LEU A 42 6.292 5.749 -6.142 1.00 0.42 C ATOM 324 CG LEU A 42 7.059 4.432 -6.289 1.00 0.49 C ATOM 325 CD1 LEU A 42 7.139 4.040 -7.763 1.00 0.55 C ATOM 326 CD2 LEU A 42 8.494 4.510 -5.788 1.00 0.61 C ATOM 0 H LEU A 42 4.853 5.261 -3.991 1.00 0.41 H new ATOM 0 HA LEU A 42 7.442 6.554 -4.488 1.00 0.39 H new ATOM 0 HB2 LEU A 42 5.240 5.559 -6.354 1.00 0.42 H new ATOM 0 HB3 LEU A 42 6.651 6.442 -6.903 1.00 0.42 H new ATOM 0 HG LEU A 42 6.510 3.705 -5.690 1.00 0.49 H new ATOM 0 HD11 LEU A 42 7.686 3.102 -7.861 1.00 0.55 H new ATOM 0 HD12 LEU A 42 6.132 3.916 -8.162 1.00 0.55 H new ATOM 0 HD13 LEU A 42 7.656 4.821 -8.320 1.00 0.55 H new ATOM 0 HD21 LEU A 42 8.979 3.543 -5.922 1.00 0.61 H new ATOM 0 HD22 LEU A 42 9.036 5.269 -6.352 1.00 0.61 H new ATOM 0 HD23 LEU A 42 8.496 4.774 -4.730 1.00 0.61 H new ATOM 338 N LEU A 43 6.644 8.798 -5.277 1.00 0.43 N ATOM 339 CA LEU A 43 6.268 10.167 -5.640 1.00 0.48 C ATOM 340 C LEU A 43 6.973 10.562 -6.952 1.00 0.47 C ATOM 341 O LEU A 43 7.966 9.947 -7.352 1.00 0.52 O ATOM 342 CB LEU A 43 6.608 11.143 -4.485 1.00 0.60 C ATOM 343 CG LEU A 43 5.462 12.048 -3.985 1.00 0.93 C ATOM 344 CD1 LEU A 43 4.758 12.849 -5.083 1.00 2.06 C ATOM 345 CD2 LEU A 43 4.408 11.233 -3.240 1.00 0.89 C ATOM 0 H LEU A 43 7.641 8.621 -5.399 1.00 0.43 H new ATOM 0 HA LEU A 43 5.192 10.223 -5.803 1.00 0.48 H new ATOM 0 HB2 LEU A 43 6.973 10.558 -3.641 1.00 0.60 H new ATOM 0 HB3 LEU A 43 7.430 11.782 -4.809 1.00 0.60 H new ATOM 0 HG LEU A 43 5.950 12.763 -3.323 1.00 0.93 H new ATOM 0 HD11 LEU A 43 3.968 13.456 -4.641 1.00 2.06 H new ATOM 0 HD12 LEU A 43 5.479 13.498 -5.579 1.00 2.06 H new ATOM 0 HD13 LEU A 43 4.325 12.164 -5.812 1.00 2.06 H new ATOM 0 HD21 LEU A 43 3.612 11.894 -2.898 1.00 0.89 H new ATOM 0 HD22 LEU A 43 3.992 10.479 -3.908 1.00 0.89 H new ATOM 0 HD23 LEU A 43 4.867 10.743 -2.381 1.00 0.89 H new ATOM 357 N ALA A 44 6.469 11.599 -7.617 1.00 0.49 N ATOM 358 CA ALA A 44 7.110 12.205 -8.782 1.00 0.51 C ATOM 359 C ALA A 44 7.933 13.447 -8.406 1.00 0.58 C ATOM 360 O ALA A 44 7.605 14.136 -7.431 1.00 0.66 O ATOM 361 CB ALA A 44 6.039 12.549 -9.812 1.00 0.54 C ATOM 0 H ALA A 44 5.591 12.049 -7.358 1.00 0.49 H new ATOM 0 HA ALA A 44 7.812 11.487 -9.207 1.00 0.51 H new ATOM 0 HB1 ALA A 44 6.507 13.002 -10.686 1.00 0.54 H new ATOM 0 HB2 ALA A 44 5.516 11.640 -10.110 1.00 0.54 H new ATOM 0 HB3 ALA A 44 5.328 13.251 -9.377 1.00 0.54 H new ATOM 367 N THR A 45 8.953 13.773 -9.203 1.00 0.71 N ATOM 368 CA THR A 45 9.810 14.949 -8.962 1.00 0.81 C ATOM 369 C THR A 45 9.289 16.248 -9.588 1.00 0.91 C ATOM 370 O THR A 45 9.671 17.326 -9.122 1.00 1.10 O ATOM 371 CB THR A 45 11.273 14.683 -9.350 1.00 0.94 C ATOM 372 OG1 THR A 45 11.417 14.412 -10.725 1.00 1.04 O ATOM 373 CG2 THR A 45 11.851 13.501 -8.569 1.00 0.98 C ATOM 0 H THR A 45 9.212 13.236 -10.031 1.00 0.71 H new ATOM 0 HA THR A 45 9.769 15.110 -7.885 1.00 0.81 H new ATOM 0 HB THR A 45 11.817 15.595 -9.105 1.00 0.94 H new ATOM 0 HG1 THR A 45 12.362 14.250 -10.929 1.00 1.04 H new ATOM 0 HG21 THR A 45 12.887 13.340 -8.867 1.00 0.98 H new ATOM 0 HG22 THR A 45 11.810 13.716 -7.501 1.00 0.98 H new ATOM 0 HG23 THR A 45 11.268 12.605 -8.782 1.00 0.98 H new ATOM 381 N ASP A 46 8.404 16.171 -10.592 1.00 0.86 N ATOM 382 CA ASP A 46 7.654 17.299 -11.170 1.00 0.95 C ATOM 383 C ASP A 46 6.286 16.862 -11.758 1.00 1.04 C ATOM 384 O ASP A 46 5.950 17.138 -12.915 1.00 1.44 O ATOM 385 CB ASP A 46 8.523 18.050 -12.191 1.00 1.06 C ATOM 386 CG ASP A 46 7.879 19.353 -12.666 1.00 1.21 C ATOM 387 OD1 ASP A 46 7.452 20.183 -11.821 1.00 1.91 O ATOM 388 OD2 ASP A 46 7.779 19.570 -13.895 1.00 2.17 O ATOM 0 H ASP A 46 8.181 15.284 -11.044 1.00 0.86 H new ATOM 0 HA ASP A 46 7.415 17.992 -10.363 1.00 0.95 H new ATOM 0 HB2 ASP A 46 9.493 18.270 -11.745 1.00 1.06 H new ATOM 0 HB3 ASP A 46 8.706 17.405 -13.051 1.00 1.06 H new ATOM 393 N GLY A 47 5.474 16.153 -10.968 1.00 0.85 N ATOM 394 CA GLY A 47 4.089 15.798 -11.320 1.00 0.90 C ATOM 395 C GLY A 47 3.924 14.663 -12.342 1.00 0.84 C ATOM 396 O GLY A 47 2.915 14.560 -13.044 1.00 1.11 O ATOM 0 H GLY A 47 5.760 15.803 -10.054 1.00 0.85 H new ATOM 0 HA2 GLY A 47 3.564 15.517 -10.407 1.00 0.90 H new ATOM 0 HA3 GLY A 47 3.595 16.687 -11.711 1.00 0.90 H new ATOM 400 N ASP A 48 4.940 13.813 -12.432 1.00 0.70 N ATOM 401 CA ASP A 48 5.116 12.709 -13.377 1.00 0.75 C ATOM 402 C ASP A 48 4.372 11.401 -13.023 1.00 0.68 C ATOM 403 O ASP A 48 4.640 10.369 -13.636 1.00 0.66 O ATOM 404 CB ASP A 48 6.621 12.419 -13.508 1.00 0.82 C ATOM 405 CG ASP A 48 7.458 13.686 -13.668 1.00 0.94 C ATOM 406 OD1 ASP A 48 7.628 14.138 -14.822 1.00 1.74 O ATOM 407 OD2 ASP A 48 7.926 14.237 -12.645 1.00 1.86 O ATOM 0 H ASP A 48 5.731 13.882 -11.792 1.00 0.70 H new ATOM 0 HA ASP A 48 4.669 13.042 -14.314 1.00 0.75 H new ATOM 0 HB2 ASP A 48 6.959 11.875 -12.626 1.00 0.82 H new ATOM 0 HB3 ASP A 48 6.787 11.769 -14.367 1.00 0.82 H new ATOM 412 N MET A 49 3.458 11.389 -12.043 1.00 0.68 N ATOM 413 CA MET A 49 2.860 10.130 -11.553 1.00 0.69 C ATOM 414 C MET A 49 2.160 9.332 -12.670 1.00 0.76 C ATOM 415 O MET A 49 2.195 8.103 -12.661 1.00 0.83 O ATOM 416 CB MET A 49 1.874 10.386 -10.397 1.00 0.65 C ATOM 417 CG MET A 49 2.475 10.995 -9.119 1.00 0.59 C ATOM 418 SD MET A 49 3.035 9.834 -7.827 1.00 0.58 S ATOM 419 CE MET A 49 4.344 8.892 -8.655 1.00 0.64 C ATOM 0 H MET A 49 3.116 12.228 -11.574 1.00 0.68 H new ATOM 0 HA MET A 49 3.690 9.527 -11.184 1.00 0.69 H new ATOM 0 HB2 MET A 49 1.088 11.050 -10.757 1.00 0.65 H new ATOM 0 HB3 MET A 49 1.398 9.441 -10.136 1.00 0.65 H new ATOM 0 HG2 MET A 49 3.324 11.615 -9.407 1.00 0.59 H new ATOM 0 HG3 MET A 49 1.731 11.658 -8.678 1.00 0.59 H new ATOM 0 HE1 MET A 49 4.974 8.411 -7.907 1.00 0.64 H new ATOM 0 HE2 MET A 49 3.896 8.132 -9.296 1.00 0.64 H new ATOM 0 HE3 MET A 49 4.950 9.566 -9.261 1.00 0.64 H new ATOM 429 N ASP A 50 1.605 10.020 -13.671 1.00 0.76 N ATOM 430 CA ASP A 50 0.887 9.421 -14.801 1.00 0.81 C ATOM 431 C ASP A 50 1.799 8.645 -15.763 1.00 0.79 C ATOM 432 O ASP A 50 1.516 7.488 -16.083 1.00 0.85 O ATOM 433 CB ASP A 50 0.156 10.519 -15.580 1.00 0.87 C ATOM 434 CG ASP A 50 -0.666 11.417 -14.669 1.00 1.14 C ATOM 435 OD1 ASP A 50 -1.811 11.047 -14.317 1.00 1.70 O ATOM 436 OD2 ASP A 50 -0.145 12.494 -14.286 1.00 2.31 O ATOM 0 H ASP A 50 1.643 11.038 -13.720 1.00 0.76 H new ATOM 0 HA ASP A 50 0.185 8.702 -14.379 1.00 0.81 H new ATOM 0 HB2 ASP A 50 0.883 11.123 -16.123 1.00 0.87 H new ATOM 0 HB3 ASP A 50 -0.497 10.062 -16.323 1.00 0.87 H new ATOM 441 N LYS A 51 2.918 9.235 -16.219 1.00 0.72 N ATOM 442 CA LYS A 51 3.845 8.536 -17.117 1.00 0.67 C ATOM 443 C LYS A 51 4.582 7.408 -16.394 1.00 0.68 C ATOM 444 O LYS A 51 4.775 6.358 -17.002 1.00 0.72 O ATOM 445 CB LYS A 51 4.736 9.544 -17.846 1.00 0.65 C ATOM 446 CG LYS A 51 5.638 10.366 -16.917 1.00 0.71 C ATOM 447 CD LYS A 51 5.893 11.760 -17.488 1.00 0.70 C ATOM 448 CE LYS A 51 4.683 12.698 -17.378 1.00 2.72 C ATOM 449 NZ LYS A 51 4.780 13.828 -18.328 1.00 3.18 N ATOM 0 H LYS A 51 3.198 10.186 -15.981 1.00 0.72 H new ATOM 0 HA LYS A 51 3.287 8.024 -17.901 1.00 0.67 H new ATOM 0 HB2 LYS A 51 5.360 9.010 -18.562 1.00 0.65 H new ATOM 0 HB3 LYS A 51 4.105 10.224 -18.418 1.00 0.65 H new ATOM 0 HG2 LYS A 51 5.172 10.452 -15.935 1.00 0.71 H new ATOM 0 HG3 LYS A 51 6.587 9.849 -16.775 1.00 0.71 H new ATOM 0 HD2 LYS A 51 6.739 12.208 -16.967 1.00 0.70 H new ATOM 0 HD3 LYS A 51 6.177 11.668 -18.536 1.00 0.70 H new ATOM 0 HE2 LYS A 51 3.769 12.137 -17.571 1.00 2.72 H new ATOM 0 HE3 LYS A 51 4.612 13.083 -16.361 1.00 2.72 H new ATOM 0 HZ1 LYS A 51 3.946 14.440 -18.225 1.00 3.18 H new ATOM 0 HZ2 LYS A 51 5.640 14.378 -18.127 1.00 3.18 H new ATOM 0 HZ3 LYS A 51 4.823 13.461 -19.300 1.00 3.18 H new ATOM 463 N ILE A 52 4.873 7.568 -15.096 1.00 0.66 N ATOM 464 CA ILE A 52 5.351 6.495 -14.211 1.00 0.68 C ATOM 465 C ILE A 52 4.332 5.348 -14.175 1.00 0.72 C ATOM 466 O ILE A 52 4.693 4.213 -14.476 1.00 0.72 O ATOM 467 CB ILE A 52 5.644 7.042 -12.794 1.00 0.70 C ATOM 468 CG1 ILE A 52 6.799 8.065 -12.870 1.00 0.63 C ATOM 469 CG2 ILE A 52 6.018 5.900 -11.823 1.00 0.78 C ATOM 470 CD1 ILE A 52 7.054 8.855 -11.593 1.00 0.60 C ATOM 0 H ILE A 52 4.781 8.466 -14.621 1.00 0.66 H new ATOM 0 HA ILE A 52 6.287 6.102 -14.607 1.00 0.68 H new ATOM 0 HB ILE A 52 4.744 7.526 -12.415 1.00 0.70 H new ATOM 0 HG12 ILE A 52 7.713 7.536 -13.139 1.00 0.63 H new ATOM 0 HG13 ILE A 52 6.588 8.768 -13.676 1.00 0.63 H new ATOM 0 HG21 ILE A 52 6.219 6.314 -10.835 1.00 0.78 H new ATOM 0 HG22 ILE A 52 5.192 5.192 -11.759 1.00 0.78 H new ATOM 0 HG23 ILE A 52 6.908 5.388 -12.189 1.00 0.78 H new ATOM 0 HD11 ILE A 52 7.883 9.544 -11.751 1.00 0.60 H new ATOM 0 HD12 ILE A 52 6.159 9.418 -11.329 1.00 0.60 H new ATOM 0 HD13 ILE A 52 7.302 8.168 -10.784 1.00 0.60 H new ATOM 482 N ALA A 53 3.054 5.621 -13.888 1.00 0.76 N ATOM 483 CA ALA A 53 2.002 4.600 -13.893 1.00 0.78 C ATOM 484 C ALA A 53 1.876 3.891 -15.254 1.00 0.73 C ATOM 485 O ALA A 53 1.690 2.676 -15.300 1.00 0.78 O ATOM 486 CB ALA A 53 0.684 5.253 -13.464 1.00 0.85 C ATOM 0 H ALA A 53 2.721 6.554 -13.646 1.00 0.76 H new ATOM 0 HA ALA A 53 2.267 3.817 -13.183 1.00 0.78 H new ATOM 0 HB1 ALA A 53 -0.109 4.505 -13.463 1.00 0.85 H new ATOM 0 HB2 ALA A 53 0.793 5.668 -12.462 1.00 0.85 H new ATOM 0 HB3 ALA A 53 0.429 6.051 -14.162 1.00 0.85 H new ATOM 492 N ASN A 54 2.092 4.606 -16.364 1.00 0.68 N ATOM 493 CA ASN A 54 2.129 3.993 -17.690 1.00 0.69 C ATOM 494 C ASN A 54 3.340 3.058 -17.900 1.00 0.72 C ATOM 495 O ASN A 54 3.206 2.063 -18.615 1.00 0.80 O ATOM 496 CB ASN A 54 2.049 5.067 -18.788 1.00 0.72 C ATOM 497 CG ASN A 54 0.640 5.576 -19.065 1.00 0.80 C ATOM 498 OD1 ASN A 54 0.064 5.329 -20.115 1.00 0.96 O ATOM 499 ND2 ASN A 54 0.029 6.311 -18.165 1.00 0.81 N ATOM 0 H ASN A 54 2.244 5.615 -16.366 1.00 0.68 H new ATOM 0 HA ASN A 54 1.248 3.355 -17.762 1.00 0.69 H new ATOM 0 HB2 ASN A 54 2.678 5.910 -18.502 1.00 0.72 H new ATOM 0 HB3 ASN A 54 2.463 4.659 -19.710 1.00 0.72 H new ATOM 0 HD21 ASN A 54 -0.910 6.665 -18.348 1.00 0.81 H new ATOM 0 HD22 ASN A 54 0.493 6.528 -17.283 1.00 0.81 H new ATOM 506 N GLU A 55 4.502 3.322 -17.296 1.00 0.76 N ATOM 507 CA GLU A 55 5.651 2.392 -17.302 1.00 0.90 C ATOM 508 C GLU A 55 5.410 1.132 -16.451 1.00 0.95 C ATOM 509 O GLU A 55 5.971 0.072 -16.745 1.00 1.14 O ATOM 510 CB GLU A 55 6.938 3.075 -16.820 1.00 1.03 C ATOM 511 CG GLU A 55 7.423 4.244 -17.681 1.00 1.00 C ATOM 512 CD GLU A 55 7.577 3.903 -19.167 1.00 1.01 C ATOM 513 OE1 GLU A 55 6.562 3.910 -19.907 1.00 1.98 O ATOM 514 OE2 GLU A 55 8.723 3.685 -19.628 1.00 1.86 O ATOM 0 H GLU A 55 4.680 4.187 -16.786 1.00 0.76 H new ATOM 0 HA GLU A 55 5.765 2.087 -18.342 1.00 0.90 H new ATOM 0 HB2 GLU A 55 6.779 3.436 -15.804 1.00 1.03 H new ATOM 0 HB3 GLU A 55 7.730 2.328 -16.773 1.00 1.03 H new ATOM 0 HG2 GLU A 55 6.721 5.072 -17.580 1.00 1.00 H new ATOM 0 HG3 GLU A 55 8.382 4.591 -17.297 1.00 1.00 H new ATOM 521 N LEU A 56 4.576 1.227 -15.407 1.00 0.84 N ATOM 522 CA LEU A 56 4.271 0.103 -14.522 1.00 0.85 C ATOM 523 C LEU A 56 3.108 -0.770 -15.013 1.00 0.87 C ATOM 524 O LEU A 56 3.205 -1.994 -14.964 1.00 0.95 O ATOM 525 CB LEU A 56 4.047 0.606 -13.090 1.00 0.83 C ATOM 526 CG LEU A 56 5.206 1.431 -12.492 1.00 0.89 C ATOM 527 CD1 LEU A 56 5.017 1.500 -10.985 1.00 1.01 C ATOM 528 CD2 LEU A 56 6.612 0.889 -12.761 1.00 0.99 C ATOM 0 H LEU A 56 4.094 2.090 -15.155 1.00 0.84 H new ATOM 0 HA LEU A 56 5.139 -0.556 -14.533 1.00 0.85 H new ATOM 0 HB2 LEU A 56 3.143 1.215 -13.074 1.00 0.83 H new ATOM 0 HB3 LEU A 56 3.864 -0.253 -12.445 1.00 0.83 H new ATOM 0 HG LEU A 56 5.156 2.402 -12.985 1.00 0.89 H new ATOM 0 HD11 LEU A 56 5.827 2.080 -10.543 1.00 1.01 H new ATOM 0 HD12 LEU A 56 4.064 1.978 -10.759 1.00 1.01 H new ATOM 0 HD13 LEU A 56 5.024 0.492 -10.571 1.00 1.01 H new ATOM 0 HD21 LEU A 56 7.349 1.544 -12.297 1.00 0.99 H new ATOM 0 HD22 LEU A 56 6.702 -0.113 -12.342 1.00 0.99 H new ATOM 0 HD23 LEU A 56 6.787 0.850 -13.836 1.00 0.99 H new ATOM 540 N GLU A 57 2.035 -0.176 -15.538 1.00 0.85 N ATOM 541 CA GLU A 57 0.845 -0.915 -15.999 1.00 0.92 C ATOM 542 C GLU A 57 1.111 -1.795 -17.239 1.00 1.02 C ATOM 543 O GLU A 57 0.389 -2.764 -17.486 1.00 1.13 O ATOM 544 CB GLU A 57 -0.317 0.071 -16.224 1.00 0.96 C ATOM 545 CG GLU A 57 -0.203 0.822 -17.556 1.00 0.98 C ATOM 546 CD GLU A 57 -1.131 2.037 -17.683 1.00 1.82 C ATOM 547 OE1 GLU A 57 -2.022 2.267 -16.823 1.00 2.85 O ATOM 548 OE2 GLU A 57 -0.944 2.796 -18.662 1.00 2.72 O ATOM 0 H GLU A 57 1.961 0.834 -15.658 1.00 0.85 H new ATOM 0 HA GLU A 57 0.568 -1.619 -15.214 1.00 0.92 H new ATOM 0 HB2 GLU A 57 -1.261 -0.473 -16.198 1.00 0.96 H new ATOM 0 HB3 GLU A 57 -0.341 0.791 -15.406 1.00 0.96 H new ATOM 0 HG2 GLU A 57 0.828 1.153 -17.685 1.00 0.98 H new ATOM 0 HG3 GLU A 57 -0.419 0.129 -18.369 1.00 0.98 H new ATOM 555 N THR A 58 2.168 -1.497 -18.009 1.00 1.03 N ATOM 556 CA THR A 58 2.657 -2.385 -19.081 1.00 1.17 C ATOM 557 C THR A 58 3.438 -3.606 -18.541 1.00 1.18 C ATOM 558 O THR A 58 3.427 -4.670 -19.167 1.00 1.42 O ATOM 559 CB THR A 58 3.413 -1.574 -20.150 1.00 1.30 C ATOM 560 OG1 THR A 58 3.606 -2.345 -21.314 1.00 1.54 O ATOM 561 CG2 THR A 58 4.765 -1.047 -19.693 1.00 1.25 C ATOM 0 H THR A 58 2.708 -0.638 -17.909 1.00 1.03 H new ATOM 0 HA THR A 58 1.793 -2.826 -19.577 1.00 1.17 H new ATOM 0 HB THR A 58 2.778 -0.711 -20.350 1.00 1.30 H new ATOM 0 HG1 THR A 58 4.086 -1.813 -21.983 1.00 1.54 H new ATOM 0 HG21 THR A 58 5.231 -0.488 -20.504 1.00 1.25 H new ATOM 0 HG22 THR A 58 4.628 -0.392 -18.833 1.00 1.25 H new ATOM 0 HG23 THR A 58 5.406 -1.883 -19.414 1.00 1.25 H new ATOM 569 N GLY A 59 4.041 -3.505 -17.346 1.00 1.04 N ATOM 570 CA GLY A 59 4.729 -4.592 -16.624 1.00 1.06 C ATOM 571 C GLY A 59 3.802 -5.430 -15.729 1.00 0.99 C ATOM 572 O GLY A 59 2.713 -4.981 -15.372 1.00 0.93 O ATOM 0 H GLY A 59 4.064 -2.624 -16.832 1.00 1.04 H new ATOM 0 HA2 GLY A 59 5.209 -5.249 -17.349 1.00 1.06 H new ATOM 0 HA3 GLY A 59 5.520 -4.163 -16.010 1.00 1.06 H new ATOM 576 N ASN A 60 4.209 -6.642 -15.335 1.00 1.11 N ATOM 577 CA ASN A 60 3.427 -7.545 -14.462 1.00 1.11 C ATOM 578 C ASN A 60 3.600 -7.257 -12.952 1.00 0.97 C ATOM 579 O ASN A 60 3.579 -8.173 -12.122 1.00 1.03 O ATOM 580 CB ASN A 60 3.701 -9.021 -14.819 1.00 1.37 C ATOM 581 CG ASN A 60 3.256 -9.422 -16.215 1.00 1.89 C ATOM 582 OD1 ASN A 60 2.356 -8.841 -16.811 1.00 2.26 O ATOM 583 ND2 ASN A 60 3.815 -10.480 -16.750 1.00 2.31 N ATOM 0 H ASN A 60 5.107 -7.036 -15.616 1.00 1.11 H new ATOM 0 HA ASN A 60 2.375 -7.339 -14.661 1.00 1.11 H new ATOM 0 HB2 ASN A 60 4.770 -9.213 -14.722 1.00 1.37 H new ATOM 0 HB3 ASN A 60 3.196 -9.658 -14.093 1.00 1.37 H new ATOM 0 HD21 ASN A 60 3.501 -10.818 -17.660 1.00 2.31 H new ATOM 0 HD22 ASN A 60 4.564 -10.966 -16.257 1.00 2.31 H new ATOM 590 N TYR A 61 3.786 -5.991 -12.564 1.00 0.84 N ATOM 591 CA TYR A 61 4.181 -5.608 -11.199 1.00 0.78 C ATOM 592 C TYR A 61 3.092 -5.765 -10.123 1.00 0.75 C ATOM 593 O TYR A 61 3.284 -5.362 -8.974 1.00 0.78 O ATOM 594 CB TYR A 61 4.833 -4.221 -11.190 1.00 0.77 C ATOM 595 CG TYR A 61 5.937 -4.027 -12.214 1.00 0.85 C ATOM 596 CD1 TYR A 61 6.951 -4.992 -12.387 1.00 2.19 C ATOM 597 CD2 TYR A 61 5.943 -2.866 -13.003 1.00 1.62 C ATOM 598 CE1 TYR A 61 7.926 -4.822 -13.387 1.00 2.30 C ATOM 599 CE2 TYR A 61 6.939 -2.669 -13.976 1.00 1.68 C ATOM 600 CZ TYR A 61 7.910 -3.669 -14.201 1.00 1.19 C ATOM 601 OH TYR A 61 8.815 -3.522 -15.202 1.00 1.46 O ATOM 0 H TYR A 61 3.666 -5.195 -13.191 1.00 0.84 H new ATOM 0 HA TYR A 61 4.927 -6.343 -10.898 1.00 0.78 H new ATOM 0 HB2 TYR A 61 4.061 -3.471 -11.363 1.00 0.77 H new ATOM 0 HB3 TYR A 61 5.242 -4.034 -10.197 1.00 0.77 H new ATOM 0 HD1 TYR A 61 6.979 -5.864 -11.750 1.00 2.19 H new ATOM 0 HD2 TYR A 61 5.177 -2.118 -12.862 1.00 1.62 H new ATOM 0 HE1 TYR A 61 8.687 -5.574 -13.532 1.00 2.30 H new ATOM 0 HE2 TYR A 61 6.961 -1.754 -14.550 1.00 1.68 H new ATOM 0 HH TYR A 61 8.659 -2.671 -15.662 1.00 1.46 H new ATOM 611 N ALA A 62 1.957 -6.384 -10.459 1.00 0.79 N ATOM 612 CA ALA A 62 1.000 -6.852 -9.461 1.00 0.85 C ATOM 613 C ALA A 62 1.638 -7.974 -8.605 1.00 0.81 C ATOM 614 O ALA A 62 1.315 -8.112 -7.422 1.00 0.96 O ATOM 615 CB ALA A 62 -0.260 -7.339 -10.183 1.00 1.04 C ATOM 0 H ALA A 62 1.680 -6.572 -11.422 1.00 0.79 H new ATOM 0 HA ALA A 62 0.725 -6.042 -8.785 1.00 0.85 H new ATOM 0 HB1 ALA A 62 -0.986 -7.692 -9.450 1.00 1.04 H new ATOM 0 HB2 ALA A 62 -0.692 -6.518 -10.755 1.00 1.04 H new ATOM 0 HB3 ALA A 62 -0.000 -8.154 -10.859 1.00 1.04 H new ATOM 621 N GLY A 63 2.564 -8.756 -9.187 1.00 0.78 N ATOM 622 CA GLY A 63 3.396 -9.741 -8.487 1.00 0.79 C ATOM 623 C GLY A 63 4.798 -9.209 -8.178 1.00 0.68 C ATOM 624 O GLY A 63 5.072 -8.757 -7.064 1.00 0.60 O ATOM 0 H GLY A 63 2.757 -8.716 -10.188 1.00 0.78 H new ATOM 0 HA2 GLY A 63 2.907 -10.029 -7.557 1.00 0.79 H new ATOM 0 HA3 GLY A 63 3.478 -10.641 -9.096 1.00 0.79 H new ATOM 628 N ASN A 64 5.691 -9.309 -9.166 1.00 0.79 N ATOM 629 CA ASN A 64 7.116 -8.993 -9.018 1.00 0.75 C ATOM 630 C ASN A 64 7.419 -7.505 -8.740 1.00 0.64 C ATOM 631 O ASN A 64 6.675 -6.607 -9.138 1.00 0.67 O ATOM 632 CB ASN A 64 7.967 -9.611 -10.138 1.00 0.90 C ATOM 633 CG ASN A 64 7.840 -8.849 -11.421 1.00 1.01 C ATOM 634 OD1 ASN A 64 6.714 -8.965 -12.058 1.00 1.57 O flip ATOM 635 ND2 ASN A 64 8.732 -8.137 -11.855 1.00 1.23 N flip ATOM 0 H ASN A 64 5.442 -9.616 -10.106 1.00 0.79 H new ATOM 0 HA ASN A 64 7.430 -9.484 -8.097 1.00 0.75 H new ATOM 0 HB2 ASN A 64 9.012 -9.632 -9.830 1.00 0.90 H new ATOM 0 HB3 ASN A 64 7.661 -10.645 -10.298 1.00 0.90 H new ATOM 0 HD21 ASN A 64 9.612 -8.054 -11.346 1.00 1.23 H new ATOM 0 HD22 ASN A 64 8.597 -7.625 -12.727 1.00 1.23 H new ATOM 642 N LYS A 65 8.535 -7.251 -8.045 1.00 0.60 N ATOM 643 CA LYS A 65 9.094 -5.909 -7.801 1.00 0.57 C ATOM 644 C LYS A 65 9.416 -5.191 -9.119 1.00 0.65 C ATOM 645 O LYS A 65 9.907 -5.832 -10.047 1.00 0.78 O ATOM 646 CB LYS A 65 10.360 -6.078 -6.944 1.00 0.67 C ATOM 647 CG LYS A 65 10.855 -4.796 -6.263 1.00 1.84 C ATOM 648 CD LYS A 65 12.225 -5.045 -5.614 1.00 1.88 C ATOM 649 CE LYS A 65 12.773 -3.812 -4.889 1.00 2.14 C ATOM 650 NZ LYS A 65 12.077 -3.579 -3.603 1.00 4.03 N ATOM 0 H LYS A 65 9.093 -7.994 -7.623 1.00 0.60 H new ATOM 0 HA LYS A 65 8.363 -5.291 -7.279 1.00 0.57 H new ATOM 0 HB2 LYS A 65 10.164 -6.827 -6.177 1.00 0.67 H new ATOM 0 HB3 LYS A 65 11.159 -6.469 -7.575 1.00 0.67 H new ATOM 0 HG2 LYS A 65 10.930 -3.991 -6.994 1.00 1.84 H new ATOM 0 HG3 LYS A 65 10.138 -4.475 -5.508 1.00 1.84 H new ATOM 0 HD2 LYS A 65 12.142 -5.870 -4.906 1.00 1.88 H new ATOM 0 HD3 LYS A 65 12.934 -5.354 -6.382 1.00 1.88 H new ATOM 0 HE2 LYS A 65 13.840 -3.941 -4.707 1.00 2.14 H new ATOM 0 HE3 LYS A 65 12.662 -2.935 -5.527 1.00 2.14 H new ATOM 0 HZ1 LYS A 65 12.734 -3.139 -2.928 1.00 4.03 H new ATOM 0 HZ2 LYS A 65 11.265 -2.948 -3.757 1.00 4.03 H new ATOM 0 HZ3 LYS A 65 11.743 -4.486 -3.220 1.00 4.03 H new ATOM 664 N VAL A 66 9.207 -3.871 -9.185 1.00 0.68 N ATOM 665 CA VAL A 66 9.492 -3.062 -10.390 1.00 0.78 C ATOM 666 C VAL A 66 10.939 -3.262 -10.863 1.00 0.86 C ATOM 667 O VAL A 66 11.868 -3.257 -10.050 1.00 1.03 O ATOM 668 CB VAL A 66 9.210 -1.562 -10.159 1.00 0.80 C ATOM 669 CG1 VAL A 66 9.590 -0.700 -11.375 1.00 0.95 C ATOM 670 CG2 VAL A 66 7.720 -1.330 -9.895 1.00 0.70 C ATOM 0 H VAL A 66 8.835 -3.327 -8.407 1.00 0.68 H new ATOM 0 HA VAL A 66 8.817 -3.412 -11.171 1.00 0.78 H new ATOM 0 HB VAL A 66 9.817 -1.272 -9.302 1.00 0.80 H new ATOM 0 HG11 VAL A 66 9.372 0.346 -11.162 1.00 0.95 H new ATOM 0 HG12 VAL A 66 10.654 -0.814 -11.584 1.00 0.95 H new ATOM 0 HG13 VAL A 66 9.014 -1.021 -12.243 1.00 0.95 H new ATOM 0 HG21 VAL A 66 7.540 -0.267 -9.734 1.00 0.70 H new ATOM 0 HG22 VAL A 66 7.141 -1.670 -10.754 1.00 0.70 H new ATOM 0 HG23 VAL A 66 7.416 -1.887 -9.009 1.00 0.70 H new ATOM 680 N GLY A 67 11.134 -3.419 -12.176 1.00 0.84 N ATOM 681 CA GLY A 67 12.454 -3.608 -12.785 1.00 0.91 C ATOM 682 C GLY A 67 13.340 -2.368 -12.659 1.00 0.75 C ATOM 683 O GLY A 67 14.346 -2.394 -11.951 1.00 0.86 O ATOM 0 H GLY A 67 10.371 -3.418 -12.853 1.00 0.84 H new ATOM 0 HA2 GLY A 67 12.951 -4.455 -12.312 1.00 0.91 H new ATOM 0 HA3 GLY A 67 12.332 -3.858 -13.839 1.00 0.91 H new ATOM 687 N VAL A 68 12.940 -1.261 -13.294 1.00 0.80 N ATOM 688 CA VAL A 68 13.686 0.010 -13.310 1.00 0.86 C ATOM 689 C VAL A 68 12.736 1.195 -13.122 1.00 0.77 C ATOM 690 O VAL A 68 11.780 1.357 -13.888 1.00 0.85 O ATOM 691 CB VAL A 68 14.493 0.178 -14.618 1.00 1.19 C ATOM 692 CG1 VAL A 68 15.349 1.452 -14.595 1.00 1.78 C ATOM 693 CG2 VAL A 68 15.438 -1.004 -14.865 1.00 1.93 C ATOM 0 H VAL A 68 12.070 -1.219 -13.824 1.00 0.80 H new ATOM 0 HA VAL A 68 14.391 -0.014 -12.479 1.00 0.86 H new ATOM 0 HB VAL A 68 13.751 0.234 -15.415 1.00 1.19 H new ATOM 0 HG11 VAL A 68 15.902 1.536 -15.531 1.00 1.78 H new ATOM 0 HG12 VAL A 68 14.703 2.322 -14.476 1.00 1.78 H new ATOM 0 HG13 VAL A 68 16.051 1.404 -13.762 1.00 1.78 H new ATOM 0 HG21 VAL A 68 15.985 -0.844 -15.794 1.00 1.93 H new ATOM 0 HG22 VAL A 68 16.143 -1.085 -14.038 1.00 1.93 H new ATOM 0 HG23 VAL A 68 14.858 -1.924 -14.939 1.00 1.93 H new ATOM 703 N LEU A 69 13.011 2.050 -12.135 1.00 0.72 N ATOM 704 CA LEU A 69 12.285 3.306 -11.933 1.00 0.66 C ATOM 705 C LEU A 69 12.808 4.402 -12.882 1.00 0.68 C ATOM 706 O LEU A 69 14.019 4.483 -13.124 1.00 0.77 O ATOM 707 CB LEU A 69 12.377 3.744 -10.457 1.00 0.70 C ATOM 708 CG LEU A 69 11.638 2.823 -9.468 1.00 0.74 C ATOM 709 CD1 LEU A 69 11.836 3.327 -8.037 1.00 0.86 C ATOM 710 CD2 LEU A 69 10.132 2.766 -9.737 1.00 0.80 C ATOM 0 H LEU A 69 13.748 1.890 -11.449 1.00 0.72 H new ATOM 0 HA LEU A 69 11.234 3.144 -12.172 1.00 0.66 H new ATOM 0 HB2 LEU A 69 13.428 3.794 -10.171 1.00 0.70 H new ATOM 0 HB3 LEU A 69 11.974 4.752 -10.365 1.00 0.70 H new ATOM 0 HG LEU A 69 12.058 1.826 -9.600 1.00 0.74 H new ATOM 0 HD11 LEU A 69 11.310 2.670 -7.344 1.00 0.86 H new ATOM 0 HD12 LEU A 69 12.899 3.332 -7.797 1.00 0.86 H new ATOM 0 HD13 LEU A 69 11.440 4.339 -7.949 1.00 0.86 H new ATOM 0 HD21 LEU A 69 9.658 2.104 -9.013 1.00 0.80 H new ATOM 0 HD22 LEU A 69 9.708 3.766 -9.646 1.00 0.80 H new ATOM 0 HD23 LEU A 69 9.956 2.388 -10.744 1.00 0.80 H new ATOM 722 N PRO A 70 11.941 5.287 -13.400 1.00 0.65 N ATOM 723 CA PRO A 70 12.370 6.373 -14.275 1.00 0.69 C ATOM 724 C PRO A 70 13.131 7.466 -13.511 1.00 0.69 C ATOM 725 O PRO A 70 13.003 7.591 -12.290 1.00 0.68 O ATOM 726 CB PRO A 70 11.083 6.903 -14.885 1.00 0.69 C ATOM 727 CG PRO A 70 10.035 6.665 -13.820 1.00 0.61 C ATOM 728 CD PRO A 70 10.512 5.387 -13.122 1.00 0.59 C ATOM 0 HA PRO A 70 13.073 6.028 -15.033 1.00 0.69 H new ATOM 0 HB2 PRO A 70 11.166 7.962 -15.131 1.00 0.69 H new ATOM 0 HB3 PRO A 70 10.836 6.380 -15.809 1.00 0.69 H new ATOM 0 HG2 PRO A 70 9.973 7.502 -13.125 1.00 0.61 H new ATOM 0 HG3 PRO A 70 9.044 6.538 -14.255 1.00 0.61 H new ATOM 0 HD2 PRO A 70 10.326 5.435 -12.049 1.00 0.59 H new ATOM 0 HD3 PRO A 70 9.979 4.514 -13.499 1.00 0.59 H new ATOM 736 N ALA A 71 13.877 8.308 -14.225 1.00 0.74 N ATOM 737 CA ALA A 71 14.661 9.396 -13.629 1.00 0.82 C ATOM 738 C ALA A 71 13.797 10.469 -12.922 1.00 0.79 C ATOM 739 O ALA A 71 14.275 11.153 -12.011 1.00 0.93 O ATOM 740 CB ALA A 71 15.540 9.993 -14.733 1.00 0.93 C ATOM 0 H ALA A 71 13.957 8.256 -15.241 1.00 0.74 H new ATOM 0 HA ALA A 71 15.280 8.989 -12.829 1.00 0.82 H new ATOM 0 HB1 ALA A 71 16.137 10.807 -14.322 1.00 0.93 H new ATOM 0 HB2 ALA A 71 16.201 9.222 -15.129 1.00 0.93 H new ATOM 0 HB3 ALA A 71 14.908 10.376 -15.534 1.00 0.93 H new ATOM 746 N ASN A 72 12.510 10.575 -13.273 1.00 0.69 N ATOM 747 CA ASN A 72 11.523 11.457 -12.636 1.00 0.69 C ATOM 748 C ASN A 72 10.708 10.810 -11.489 1.00 0.65 C ATOM 749 O ASN A 72 9.897 11.487 -10.853 1.00 0.72 O ATOM 750 CB ASN A 72 10.649 12.100 -13.724 1.00 0.68 C ATOM 751 CG ASN A 72 9.868 11.143 -14.607 1.00 0.58 C ATOM 752 OD1 ASN A 72 9.872 9.931 -14.448 1.00 1.50 O ATOM 753 ND2 ASN A 72 9.189 11.655 -15.602 1.00 1.53 N ATOM 0 H ASN A 72 12.112 10.029 -14.037 1.00 0.69 H new ATOM 0 HA ASN A 72 12.074 12.239 -12.113 1.00 0.69 H new ATOM 0 HB2 ASN A 72 9.942 12.775 -13.242 1.00 0.68 H new ATOM 0 HB3 ASN A 72 11.289 12.710 -14.362 1.00 0.68 H new ATOM 0 HD21 ASN A 72 8.671 11.044 -16.234 1.00 1.53 H new ATOM 0 HD22 ASN A 72 9.178 12.665 -15.745 1.00 1.53 H new ATOM 760 N ALA A 73 10.930 9.526 -11.188 1.00 0.61 N ATOM 761 CA ALA A 73 10.396 8.862 -9.992 1.00 0.62 C ATOM 762 C ALA A 73 11.332 8.971 -8.768 1.00 0.69 C ATOM 763 O ALA A 73 12.559 9.020 -8.922 1.00 0.80 O ATOM 764 CB ALA A 73 10.142 7.390 -10.335 1.00 0.61 C ATOM 0 H ALA A 73 11.493 8.910 -11.775 1.00 0.61 H new ATOM 0 HA ALA A 73 9.471 9.365 -9.709 1.00 0.62 H new ATOM 0 HB1 ALA A 73 9.744 6.876 -9.460 1.00 0.61 H new ATOM 0 HB2 ALA A 73 9.423 7.326 -11.152 1.00 0.61 H new ATOM 0 HB3 ALA A 73 11.078 6.920 -10.638 1.00 0.61 H new ATOM 770 N LYS A 74 10.751 8.931 -7.559 1.00 0.65 N ATOM 771 CA LYS A 74 11.457 8.774 -6.271 1.00 0.80 C ATOM 772 C LYS A 74 10.623 7.977 -5.258 1.00 0.68 C ATOM 773 O LYS A 74 9.421 7.789 -5.441 1.00 0.57 O ATOM 774 CB LYS A 74 11.876 10.146 -5.708 1.00 1.05 C ATOM 775 CG LYS A 74 10.829 10.781 -4.777 1.00 0.94 C ATOM 776 CD LYS A 74 11.126 12.271 -4.585 1.00 1.18 C ATOM 777 CE LYS A 74 10.280 12.898 -3.474 1.00 1.50 C ATOM 778 NZ LYS A 74 10.711 14.292 -3.249 1.00 1.95 N ATOM 0 H LYS A 74 9.741 9.010 -7.444 1.00 0.65 H new ATOM 0 HA LYS A 74 12.363 8.197 -6.456 1.00 0.80 H new ATOM 0 HB2 LYS A 74 12.813 10.034 -5.163 1.00 1.05 H new ATOM 0 HB3 LYS A 74 12.070 10.825 -6.538 1.00 1.05 H new ATOM 0 HG2 LYS A 74 9.832 10.653 -5.198 1.00 0.94 H new ATOM 0 HG3 LYS A 74 10.835 10.274 -3.812 1.00 0.94 H new ATOM 0 HD2 LYS A 74 12.182 12.400 -4.350 1.00 1.18 H new ATOM 0 HD3 LYS A 74 10.941 12.799 -5.520 1.00 1.18 H new ATOM 0 HE2 LYS A 74 9.225 12.873 -3.748 1.00 1.50 H new ATOM 0 HE3 LYS A 74 10.384 12.322 -2.555 1.00 1.50 H new ATOM 0 HZ1 LYS A 74 10.135 14.716 -2.494 1.00 1.95 H new ATOM 0 HZ2 LYS A 74 11.713 14.305 -2.969 1.00 1.95 H new ATOM 0 HZ3 LYS A 74 10.590 14.839 -4.125 1.00 1.95 H new ATOM 792 N GLU A 75 11.256 7.563 -4.166 1.00 0.73 N ATOM 793 CA GLU A 75 10.666 6.769 -3.076 1.00 0.68 C ATOM 794 C GLU A 75 10.726 7.565 -1.752 1.00 0.64 C ATOM 795 O GLU A 75 11.724 8.257 -1.528 1.00 0.73 O ATOM 796 CB GLU A 75 11.449 5.443 -2.954 1.00 0.82 C ATOM 797 CG GLU A 75 11.579 4.642 -4.267 1.00 0.86 C ATOM 798 CD GLU A 75 12.717 3.616 -4.179 1.00 1.18 C ATOM 799 OE1 GLU A 75 13.900 4.012 -4.292 1.00 1.68 O ATOM 800 OE2 GLU A 75 12.474 2.407 -3.938 1.00 2.40 O ATOM 0 H GLU A 75 12.240 7.778 -4.002 1.00 0.73 H new ATOM 0 HA GLU A 75 9.620 6.552 -3.291 1.00 0.68 H new ATOM 0 HB2 GLU A 75 12.449 5.661 -2.578 1.00 0.82 H new ATOM 0 HB3 GLU A 75 10.959 4.816 -2.210 1.00 0.82 H new ATOM 0 HG2 GLU A 75 10.640 4.131 -4.479 1.00 0.86 H new ATOM 0 HG3 GLU A 75 11.764 5.325 -5.096 1.00 0.86 H new ATOM 807 N ILE A 76 9.711 7.466 -0.874 1.00 0.59 N ATOM 808 CA ILE A 76 9.721 8.095 0.471 1.00 0.57 C ATOM 809 C ILE A 76 9.420 7.127 1.630 1.00 0.54 C ATOM 810 O ILE A 76 8.539 6.263 1.560 1.00 0.63 O ATOM 811 CB ILE A 76 8.810 9.347 0.601 1.00 0.57 C ATOM 812 CG1 ILE A 76 7.362 9.130 0.109 1.00 0.57 C ATOM 813 CG2 ILE A 76 9.440 10.609 -0.014 1.00 0.62 C ATOM 814 CD1 ILE A 76 6.459 10.343 0.384 1.00 0.72 C ATOM 0 H ILE A 76 8.856 6.947 -1.073 1.00 0.59 H new ATOM 0 HA ILE A 76 10.758 8.419 0.562 1.00 0.57 H new ATOM 0 HB ILE A 76 8.732 9.516 1.675 1.00 0.57 H new ATOM 0 HG12 ILE A 76 7.372 8.924 -0.961 1.00 0.57 H new ATOM 0 HG13 ILE A 76 6.943 8.251 0.599 1.00 0.57 H new ATOM 0 HG21 ILE A 76 8.759 11.451 0.106 1.00 0.62 H new ATOM 0 HG22 ILE A 76 10.381 10.829 0.490 1.00 0.62 H new ATOM 0 HG23 ILE A 76 9.627 10.442 -1.075 1.00 0.62 H new ATOM 0 HD11 ILE A 76 5.453 10.138 0.019 1.00 0.72 H new ATOM 0 HD12 ILE A 76 6.424 10.535 1.456 1.00 0.72 H new ATOM 0 HD13 ILE A 76 6.859 11.218 -0.128 1.00 0.72 H new ATOM 826 N ALA A 77 10.115 7.351 2.749 1.00 0.53 N ATOM 827 CA ALA A 77 9.874 6.722 4.046 1.00 0.54 C ATOM 828 C ALA A 77 9.139 7.664 5.028 1.00 0.53 C ATOM 829 O ALA A 77 9.250 8.893 4.940 1.00 0.63 O ATOM 830 CB ALA A 77 11.199 6.182 4.590 1.00 0.67 C ATOM 0 H ALA A 77 10.896 8.006 2.774 1.00 0.53 H new ATOM 0 HA ALA A 77 9.193 5.880 3.920 1.00 0.54 H new ATOM 0 HB1 ALA A 77 11.030 5.711 5.558 1.00 0.67 H new ATOM 0 HB2 ALA A 77 11.605 5.447 3.895 1.00 0.67 H new ATOM 0 HB3 ALA A 77 11.907 7.003 4.705 1.00 0.67 H new ATOM 836 N GLY A 78 8.398 7.085 5.977 1.00 0.55 N ATOM 837 CA GLY A 78 7.638 7.783 7.026 1.00 0.59 C ATOM 838 C GLY A 78 6.164 8.066 6.691 1.00 0.59 C ATOM 839 O GLY A 78 5.482 8.755 7.448 1.00 0.65 O ATOM 0 H GLY A 78 8.305 6.071 6.041 1.00 0.55 H new ATOM 0 HA2 GLY A 78 7.678 7.188 7.938 1.00 0.59 H new ATOM 0 HA3 GLY A 78 8.133 8.730 7.241 1.00 0.59 H new ATOM 843 N VAL A 79 5.653 7.547 5.572 1.00 0.62 N ATOM 844 CA VAL A 79 4.217 7.550 5.225 1.00 0.60 C ATOM 845 C VAL A 79 3.546 6.282 5.753 1.00 0.56 C ATOM 846 O VAL A 79 4.165 5.220 5.778 1.00 0.55 O ATOM 847 CB VAL A 79 4.010 7.754 3.712 1.00 0.66 C ATOM 848 CG1 VAL A 79 4.827 6.806 2.834 1.00 0.80 C ATOM 849 CG2 VAL A 79 2.538 7.710 3.294 1.00 0.65 C ATOM 0 H VAL A 79 6.233 7.101 4.861 1.00 0.62 H new ATOM 0 HA VAL A 79 3.734 8.397 5.712 1.00 0.60 H new ATOM 0 HB VAL A 79 4.388 8.762 3.538 1.00 0.66 H new ATOM 0 HG11 VAL A 79 4.623 7.016 1.784 1.00 0.80 H new ATOM 0 HG12 VAL A 79 5.889 6.950 3.033 1.00 0.80 H new ATOM 0 HG13 VAL A 79 4.552 5.775 3.058 1.00 0.80 H new ATOM 0 HG21 VAL A 79 2.461 7.860 2.217 1.00 0.65 H new ATOM 0 HG22 VAL A 79 2.114 6.741 3.556 1.00 0.65 H new ATOM 0 HG23 VAL A 79 1.989 8.498 3.810 1.00 0.65 H new ATOM 859 N MET A 80 2.297 6.421 6.201 1.00 0.57 N ATOM 860 CA MET A 80 1.508 5.397 6.888 1.00 0.50 C ATOM 861 C MET A 80 0.330 4.907 6.032 1.00 0.43 C ATOM 862 O MET A 80 -0.439 5.705 5.492 1.00 0.45 O ATOM 863 CB MET A 80 1.042 5.991 8.228 1.00 0.54 C ATOM 864 CG MET A 80 0.011 5.137 8.974 1.00 0.56 C ATOM 865 SD MET A 80 0.460 3.397 9.186 1.00 0.62 S ATOM 866 CE MET A 80 0.527 3.306 10.980 1.00 0.56 C ATOM 0 H MET A 80 1.783 7.295 6.089 1.00 0.57 H new ATOM 0 HA MET A 80 2.120 4.513 7.067 1.00 0.50 H new ATOM 0 HB2 MET A 80 1.911 6.133 8.870 1.00 0.54 H new ATOM 0 HB3 MET A 80 0.615 6.977 8.046 1.00 0.54 H new ATOM 0 HG2 MET A 80 -0.156 5.575 9.958 1.00 0.56 H new ATOM 0 HG3 MET A 80 -0.936 5.188 8.437 1.00 0.56 H new ATOM 0 HE1 MET A 80 1.010 2.376 11.279 1.00 0.56 H new ATOM 0 HE2 MET A 80 1.096 4.151 11.366 1.00 0.56 H new ATOM 0 HE3 MET A 80 -0.485 3.335 11.384 1.00 0.56 H new ATOM 876 N PHE A 81 0.161 3.589 5.949 1.00 0.43 N ATOM 877 CA PHE A 81 -0.908 2.915 5.205 1.00 0.42 C ATOM 878 C PHE A 81 -1.480 1.728 5.992 1.00 0.40 C ATOM 879 O PHE A 81 -0.808 1.100 6.815 1.00 0.41 O ATOM 880 CB PHE A 81 -0.426 2.501 3.796 1.00 0.42 C ATOM 881 CG PHE A 81 1.059 2.221 3.749 1.00 0.41 C ATOM 882 CD1 PHE A 81 1.505 1.027 4.332 1.00 1.41 C ATOM 883 CD2 PHE A 81 1.995 3.198 3.336 1.00 1.72 C ATOM 884 CE1 PHE A 81 2.868 0.821 4.549 1.00 1.44 C ATOM 885 CE2 PHE A 81 3.366 2.947 3.497 1.00 1.73 C ATOM 886 CZ PHE A 81 3.805 1.767 4.118 1.00 0.60 C ATOM 0 H PHE A 81 0.788 2.933 6.415 1.00 0.43 H new ATOM 0 HA PHE A 81 -1.724 3.625 5.072 1.00 0.42 H new ATOM 0 HB2 PHE A 81 -0.970 1.612 3.476 1.00 0.42 H new ATOM 0 HB3 PHE A 81 -0.665 3.293 3.087 1.00 0.42 H new ATOM 0 HD1 PHE A 81 0.793 0.265 4.614 1.00 1.41 H new ATOM 0 HD2 PHE A 81 1.658 4.127 2.901 1.00 1.72 H new ATOM 0 HE1 PHE A 81 3.202 -0.074 5.053 1.00 1.44 H new ATOM 0 HE2 PHE A 81 4.088 3.666 3.141 1.00 1.73 H new ATOM 0 HZ PHE A 81 4.861 1.590 4.262 1.00 0.60 H new ATOM 896 N VAL A 82 -2.744 1.419 5.708 1.00 0.38 N ATOM 897 CA VAL A 82 -3.559 0.394 6.371 1.00 0.35 C ATOM 898 C VAL A 82 -4.127 -0.572 5.317 1.00 0.31 C ATOM 899 O VAL A 82 -4.500 -0.146 4.220 1.00 0.31 O ATOM 900 CB VAL A 82 -4.679 1.034 7.229 1.00 0.36 C ATOM 901 CG1 VAL A 82 -4.177 2.201 8.098 1.00 0.42 C ATOM 902 CG2 VAL A 82 -5.849 1.588 6.409 1.00 0.34 C ATOM 0 H VAL A 82 -3.258 1.901 4.970 1.00 0.38 H new ATOM 0 HA VAL A 82 -2.929 -0.174 7.055 1.00 0.35 H new ATOM 0 HB VAL A 82 -5.015 0.201 7.847 1.00 0.36 H new ATOM 0 HG11 VAL A 82 -5.007 2.608 8.676 1.00 0.42 H new ATOM 0 HG12 VAL A 82 -3.404 1.842 8.777 1.00 0.42 H new ATOM 0 HG13 VAL A 82 -3.764 2.980 7.457 1.00 0.42 H new ATOM 0 HG21 VAL A 82 -6.592 2.019 7.080 1.00 0.34 H new ATOM 0 HG22 VAL A 82 -5.484 2.358 5.729 1.00 0.34 H new ATOM 0 HG23 VAL A 82 -6.304 0.782 5.834 1.00 0.34 H new ATOM 912 N TRP A 83 -4.221 -1.864 5.634 1.00 0.31 N ATOM 913 CA TRP A 83 -4.941 -2.849 4.823 1.00 0.26 C ATOM 914 C TRP A 83 -6.438 -2.863 5.164 1.00 0.28 C ATOM 915 O TRP A 83 -6.865 -2.682 6.307 1.00 0.33 O ATOM 916 CB TRP A 83 -4.327 -4.253 4.949 1.00 0.25 C ATOM 917 CG TRP A 83 -3.147 -4.558 4.068 1.00 0.25 C ATOM 918 CD1 TRP A 83 -1.941 -3.941 4.076 1.00 0.28 C ATOM 919 CD2 TRP A 83 -3.043 -5.616 3.061 1.00 0.26 C ATOM 920 NE1 TRP A 83 -1.133 -4.493 3.095 1.00 0.30 N ATOM 921 CE2 TRP A 83 -1.761 -5.533 2.438 1.00 0.30 C ATOM 922 CE3 TRP A 83 -3.898 -6.656 2.631 1.00 0.26 C ATOM 923 CZ2 TRP A 83 -1.367 -6.409 1.412 1.00 0.34 C ATOM 924 CZ3 TRP A 83 -3.501 -7.568 1.634 1.00 0.31 C ATOM 925 CH2 TRP A 83 -2.241 -7.438 1.015 1.00 0.35 C ATOM 0 H TRP A 83 -3.794 -2.261 6.471 1.00 0.31 H new ATOM 0 HA TRP A 83 -4.839 -2.545 3.781 1.00 0.26 H new ATOM 0 HB2 TRP A 83 -4.024 -4.400 5.986 1.00 0.25 H new ATOM 0 HB3 TRP A 83 -5.107 -4.985 4.738 1.00 0.25 H new ATOM 0 HD1 TRP A 83 -1.654 -3.142 4.744 1.00 0.28 H new ATOM 0 HE1 TRP A 83 -0.189 -4.170 2.884 1.00 0.30 H new ATOM 0 HE3 TRP A 83 -4.877 -6.753 3.077 1.00 0.26 H new ATOM 0 HZ2 TRP A 83 -0.405 -6.294 0.934 1.00 0.34 H new ATOM 0 HZ3 TRP A 83 -4.164 -8.369 1.343 1.00 0.31 H new ATOM 0 HH2 TRP A 83 -1.947 -8.127 0.237 1.00 0.35 H new ATOM 936 N THR A 84 -7.239 -3.116 4.136 1.00 0.28 N ATOM 937 CA THR A 84 -8.700 -3.215 4.179 1.00 0.30 C ATOM 938 C THR A 84 -9.211 -4.346 3.291 1.00 0.31 C ATOM 939 O THR A 84 -8.475 -4.922 2.490 1.00 0.29 O ATOM 940 CB THR A 84 -9.382 -1.919 3.700 1.00 0.30 C ATOM 941 OG1 THR A 84 -8.922 -1.581 2.419 1.00 0.29 O ATOM 942 CG2 THR A 84 -9.185 -0.706 4.594 1.00 0.33 C ATOM 0 H THR A 84 -6.870 -3.266 3.197 1.00 0.28 H new ATOM 0 HA THR A 84 -8.949 -3.405 5.223 1.00 0.30 H new ATOM 0 HB THR A 84 -10.446 -2.153 3.717 1.00 0.30 H new ATOM 0 HG1 THR A 84 -8.044 -1.990 2.268 1.00 0.29 H new ATOM 0 HG21 THR A 84 -9.705 0.150 4.165 1.00 0.33 H new ATOM 0 HG22 THR A 84 -9.587 -0.916 5.585 1.00 0.33 H new ATOM 0 HG23 THR A 84 -8.121 -0.482 4.673 1.00 0.33 H new ATOM 950 N ASN A 85 -10.499 -4.651 3.399 1.00 0.37 N ATOM 951 CA ASN A 85 -11.195 -5.540 2.479 1.00 0.41 C ATOM 952 C ASN A 85 -11.745 -4.809 1.238 1.00 0.40 C ATOM 953 O ASN A 85 -11.769 -3.579 1.193 1.00 0.43 O ATOM 954 CB ASN A 85 -12.293 -6.273 3.267 1.00 0.59 C ATOM 955 CG ASN A 85 -12.329 -7.699 2.791 1.00 0.87 C ATOM 956 OD1 ASN A 85 -13.188 -8.094 2.018 1.00 2.01 O ATOM 957 ND2 ASN A 85 -11.299 -8.436 3.133 1.00 0.82 N ATOM 0 H ASN A 85 -11.097 -4.282 4.139 1.00 0.37 H new ATOM 0 HA ASN A 85 -10.488 -6.264 2.075 1.00 0.41 H new ATOM 0 HB2 ASN A 85 -12.087 -6.233 4.337 1.00 0.59 H new ATOM 0 HB3 ASN A 85 -13.259 -5.794 3.111 1.00 0.59 H new ATOM 0 HD21 ASN A 85 -11.194 -9.376 2.750 1.00 0.82 H new ATOM 0 HD22 ASN A 85 -10.603 -8.069 3.782 1.00 0.82 H new ATOM 964 N THR A 86 -12.283 -5.540 0.255 1.00 0.46 N ATOM 965 CA THR A 86 -13.024 -4.936 -0.880 1.00 0.56 C ATOM 966 C THR A 86 -14.305 -4.220 -0.459 1.00 0.62 C ATOM 967 O THR A 86 -14.831 -3.386 -1.191 1.00 0.85 O ATOM 968 CB THR A 86 -13.397 -5.981 -1.933 1.00 0.74 C ATOM 969 OG1 THR A 86 -14.078 -7.038 -1.305 1.00 1.42 O ATOM 970 CG2 THR A 86 -12.145 -6.544 -2.586 1.00 1.17 C ATOM 0 H THR A 86 -12.223 -6.557 0.215 1.00 0.46 H new ATOM 0 HA THR A 86 -12.334 -4.202 -1.296 1.00 0.56 H new ATOM 0 HB THR A 86 -14.023 -5.509 -2.691 1.00 0.74 H new ATOM 0 HG1 THR A 86 -14.323 -7.712 -1.973 1.00 1.42 H new ATOM 0 HG21 THR A 86 -12.427 -7.286 -3.333 1.00 1.17 H new ATOM 0 HG22 THR A 86 -11.591 -5.738 -3.067 1.00 1.17 H new ATOM 0 HG23 THR A 86 -11.518 -7.013 -1.827 1.00 1.17 H new ATOM 978 N ASN A 87 -14.783 -4.504 0.750 1.00 0.64 N ATOM 979 CA ASN A 87 -15.854 -3.772 1.434 1.00 0.79 C ATOM 980 C ASN A 87 -15.357 -2.471 2.122 1.00 0.62 C ATOM 981 O ASN A 87 -16.095 -1.861 2.895 1.00 0.65 O ATOM 982 CB ASN A 87 -16.537 -4.725 2.428 1.00 1.10 C ATOM 983 CG ASN A 87 -16.968 -6.047 1.816 1.00 1.79 C ATOM 984 OD1 ASN A 87 -17.620 -6.109 0.783 1.00 1.97 O ATOM 985 ND2 ASN A 87 -16.605 -7.141 2.431 1.00 2.73 N ATOM 0 H ASN A 87 -14.423 -5.281 1.305 1.00 0.64 H new ATOM 0 HA ASN A 87 -16.577 -3.436 0.691 1.00 0.79 H new ATOM 0 HB2 ASN A 87 -15.854 -4.924 3.254 1.00 1.10 H new ATOM 0 HB3 ASN A 87 -17.411 -4.229 2.850 1.00 1.10 H new ATOM 0 HD21 ASN A 87 -16.865 -8.051 2.050 1.00 2.73 H new ATOM 0 HD22 ASN A 87 -16.061 -7.085 3.292 1.00 2.73 H new ATOM 992 N ASN A 88 -14.098 -2.068 1.894 1.00 0.51 N ATOM 993 CA ASN A 88 -13.416 -0.907 2.487 1.00 0.46 C ATOM 994 C ASN A 88 -13.401 -0.931 4.032 1.00 0.44 C ATOM 995 O ASN A 88 -13.358 0.109 4.687 1.00 0.46 O ATOM 996 CB ASN A 88 -13.916 0.421 1.865 1.00 0.49 C ATOM 997 CG ASN A 88 -14.465 0.281 0.455 1.00 0.55 C ATOM 998 OD1 ASN A 88 -15.647 0.042 0.248 1.00 0.72 O ATOM 999 ND2 ASN A 88 -13.633 0.384 -0.548 1.00 0.50 N ATOM 0 H ASN A 88 -13.491 -2.576 1.251 1.00 0.51 H new ATOM 0 HA ASN A 88 -12.361 -0.978 2.222 1.00 0.46 H new ATOM 0 HB2 ASN A 88 -14.693 0.839 2.505 1.00 0.49 H new ATOM 0 HB3 ASN A 88 -13.093 1.136 1.853 1.00 0.49 H new ATOM 0 HD21 ASN A 88 -13.969 0.265 -1.504 1.00 0.50 H new ATOM 0 HD22 ASN A 88 -12.648 0.583 -0.375 1.00 0.50 H new ATOM 1006 N GLU A 89 -13.488 -2.124 4.627 1.00 0.46 N ATOM 1007 CA GLU A 89 -13.422 -2.365 6.073 1.00 0.47 C ATOM 1008 C GLU A 89 -11.984 -2.583 6.514 1.00 0.40 C ATOM 1009 O GLU A 89 -11.238 -3.273 5.821 1.00 0.36 O ATOM 1010 CB GLU A 89 -14.232 -3.610 6.469 1.00 0.54 C ATOM 1011 CG GLU A 89 -15.713 -3.252 6.659 1.00 0.59 C ATOM 1012 CD GLU A 89 -16.542 -4.406 7.241 1.00 1.00 C ATOM 1013 OE1 GLU A 89 -16.936 -5.331 6.487 1.00 1.66 O ATOM 1014 OE2 GLU A 89 -16.866 -4.341 8.455 1.00 2.52 O ATOM 0 H GLU A 89 -13.611 -2.984 4.093 1.00 0.46 H new ATOM 0 HA GLU A 89 -13.840 -1.484 6.561 1.00 0.47 H new ATOM 0 HB2 GLU A 89 -14.133 -4.375 5.699 1.00 0.54 H new ATOM 0 HB3 GLU A 89 -13.833 -4.032 7.391 1.00 0.54 H new ATOM 0 HG2 GLU A 89 -15.790 -2.388 7.319 1.00 0.59 H new ATOM 0 HG3 GLU A 89 -16.136 -2.957 5.698 1.00 0.59 H new ATOM 1021 N ILE A 90 -11.614 -2.060 7.682 1.00 0.42 N ATOM 1022 CA ILE A 90 -10.272 -2.251 8.235 1.00 0.38 C ATOM 1023 C ILE A 90 -10.158 -3.667 8.822 1.00 0.38 C ATOM 1024 O ILE A 90 -10.984 -4.063 9.648 1.00 0.43 O ATOM 1025 CB ILE A 90 -9.907 -1.168 9.269 1.00 0.43 C ATOM 1026 CG1 ILE A 90 -10.289 0.243 8.773 1.00 0.44 C ATOM 1027 CG2 ILE A 90 -8.396 -1.269 9.564 1.00 0.44 C ATOM 1028 CD1 ILE A 90 -9.855 1.351 9.729 1.00 0.50 C ATOM 0 H ILE A 90 -12.229 -1.496 8.268 1.00 0.42 H new ATOM 0 HA ILE A 90 -9.547 -2.146 7.427 1.00 0.38 H new ATOM 0 HB ILE A 90 -10.473 -1.335 10.185 1.00 0.43 H new ATOM 0 HG12 ILE A 90 -9.834 0.414 7.797 1.00 0.44 H new ATOM 0 HG13 ILE A 90 -11.369 0.293 8.634 1.00 0.44 H new ATOM 0 HG21 ILE A 90 -8.116 -0.510 10.295 1.00 0.44 H new ATOM 0 HG22 ILE A 90 -8.168 -2.258 9.963 1.00 0.44 H new ATOM 0 HG23 ILE A 90 -7.834 -1.111 8.643 1.00 0.44 H new ATOM 0 HD11 ILE A 90 -10.152 2.318 9.324 1.00 0.50 H new ATOM 0 HD12 ILE A 90 -10.330 1.202 10.698 1.00 0.50 H new ATOM 0 HD13 ILE A 90 -8.772 1.325 9.848 1.00 0.50 H new ATOM 1040 N ILE A 91 -9.136 -4.417 8.403 1.00 0.33 N ATOM 1041 CA ILE A 91 -8.862 -5.799 8.846 1.00 0.32 C ATOM 1042 C ILE A 91 -7.467 -6.007 9.488 1.00 0.34 C ATOM 1043 O ILE A 91 -6.528 -5.254 9.237 1.00 0.35 O ATOM 1044 CB ILE A 91 -9.150 -6.812 7.711 1.00 0.29 C ATOM 1045 CG1 ILE A 91 -8.196 -6.703 6.500 1.00 0.26 C ATOM 1046 CG2 ILE A 91 -10.579 -6.658 7.184 1.00 0.34 C ATOM 1047 CD1 ILE A 91 -7.846 -8.073 5.921 1.00 0.50 C ATOM 0 H ILE A 91 -8.453 -4.076 7.727 1.00 0.33 H new ATOM 0 HA ILE A 91 -9.559 -5.993 9.661 1.00 0.32 H new ATOM 0 HB ILE A 91 -8.996 -7.786 8.177 1.00 0.29 H new ATOM 0 HG12 ILE A 91 -8.660 -6.091 5.727 1.00 0.26 H new ATOM 0 HG13 ILE A 91 -7.282 -6.194 6.804 1.00 0.26 H new ATOM 0 HG21 ILE A 91 -10.753 -7.382 6.388 1.00 0.34 H new ATOM 0 HG22 ILE A 91 -11.287 -6.833 7.995 1.00 0.34 H new ATOM 0 HG23 ILE A 91 -10.716 -5.650 6.794 1.00 0.34 H new ATOM 0 HD11 ILE A 91 -7.174 -7.948 5.072 1.00 0.50 H new ATOM 0 HD12 ILE A 91 -7.357 -8.677 6.685 1.00 0.50 H new ATOM 0 HD13 ILE A 91 -8.757 -8.572 5.592 1.00 0.50 H new ATOM 1059 N ASP A 92 -7.346 -7.019 10.352 1.00 0.39 N ATOM 1060 CA ASP A 92 -6.092 -7.583 10.898 1.00 0.46 C ATOM 1061 C ASP A 92 -5.427 -8.555 9.893 1.00 0.47 C ATOM 1062 O ASP A 92 -6.085 -9.069 8.988 1.00 0.43 O ATOM 1063 CB ASP A 92 -6.418 -8.293 12.232 1.00 0.55 C ATOM 1064 CG ASP A 92 -5.299 -9.206 12.765 1.00 0.85 C ATOM 1065 OD1 ASP A 92 -4.170 -8.728 13.030 1.00 1.52 O ATOM 1066 OD2 ASP A 92 -5.529 -10.436 12.847 1.00 1.74 O ATOM 0 H ASP A 92 -8.168 -7.501 10.716 1.00 0.39 H new ATOM 0 HA ASP A 92 -5.376 -6.780 11.075 1.00 0.46 H new ATOM 0 HB2 ASP A 92 -6.641 -7.537 12.985 1.00 0.55 H new ATOM 0 HB3 ASP A 92 -7.322 -8.888 12.100 1.00 0.55 H new ATOM 1071 N GLU A 93 -4.143 -8.883 10.078 1.00 0.54 N ATOM 1072 CA GLU A 93 -3.361 -9.763 9.183 1.00 0.54 C ATOM 1073 C GLU A 93 -3.809 -11.238 9.145 1.00 0.54 C ATOM 1074 O GLU A 93 -3.245 -12.028 8.389 1.00 0.62 O ATOM 1075 CB GLU A 93 -1.851 -9.614 9.462 1.00 0.74 C ATOM 1076 CG GLU A 93 -1.416 -10.154 10.832 1.00 0.91 C ATOM 1077 CD GLU A 93 0.076 -9.913 11.106 1.00 1.29 C ATOM 1078 OE1 GLU A 93 0.520 -8.740 11.071 1.00 2.33 O ATOM 1079 OE2 GLU A 93 0.813 -10.885 11.414 1.00 1.93 O ATOM 0 H GLU A 93 -3.601 -8.539 10.871 1.00 0.54 H new ATOM 0 HA GLU A 93 -3.572 -9.412 8.173 1.00 0.54 H new ATOM 0 HB2 GLU A 93 -1.294 -10.135 8.683 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -1.581 -8.560 9.395 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -2.008 -9.677 11.613 1.00 0.91 H new ATOM 0 HG3 GLU A 93 -1.624 -11.223 10.882 1.00 0.91 H new ATOM 1086 N ASN A 94 -4.832 -11.614 9.923 1.00 0.55 N ATOM 1087 CA ASN A 94 -5.527 -12.899 9.864 1.00 0.56 C ATOM 1088 C ASN A 94 -6.928 -12.807 9.203 1.00 0.51 C ATOM 1089 O ASN A 94 -7.613 -13.828 9.088 1.00 0.59 O ATOM 1090 CB ASN A 94 -5.597 -13.465 11.290 1.00 0.65 C ATOM 1091 CG ASN A 94 -4.241 -13.615 11.956 1.00 2.21 C ATOM 1092 OD1 ASN A 94 -3.525 -14.584 11.764 1.00 3.96 O ATOM 1093 ND2 ASN A 94 -3.851 -12.667 12.777 1.00 2.00 N ATOM 0 H ASN A 94 -5.213 -11.000 10.643 1.00 0.55 H new ATOM 0 HA ASN A 94 -4.965 -13.575 9.219 1.00 0.56 H new ATOM 0 HB2 ASN A 94 -6.221 -12.812 11.900 1.00 0.65 H new ATOM 0 HB3 ASN A 94 -6.087 -14.438 11.261 1.00 0.65 H new ATOM 0 HD21 ASN A 94 -2.952 -12.742 13.252 1.00 2.00 H new ATOM 0 HD22 ASN A 94 -4.448 -11.856 12.939 1.00 2.00 H new ATOM 1100 N GLY A 95 -7.371 -11.610 8.794 1.00 0.43 N ATOM 1101 CA GLY A 95 -8.656 -11.333 8.132 1.00 0.42 C ATOM 1102 C GLY A 95 -9.800 -10.885 9.052 1.00 0.50 C ATOM 1103 O GLY A 95 -10.892 -10.602 8.561 1.00 0.66 O ATOM 0 H GLY A 95 -6.815 -10.765 8.922 1.00 0.43 H new ATOM 0 HA2 GLY A 95 -8.496 -10.560 7.380 1.00 0.42 H new ATOM 0 HA3 GLY A 95 -8.972 -12.232 7.603 1.00 0.42 H new ATOM 1107 N GLN A 96 -9.579 -10.787 10.366 1.00 0.48 N ATOM 1108 CA GLN A 96 -10.591 -10.320 11.316 1.00 0.50 C ATOM 1109 C GLN A 96 -10.865 -8.824 11.131 1.00 0.51 C ATOM 1110 O GLN A 96 -9.934 -8.045 10.934 1.00 0.49 O ATOM 1111 CB GLN A 96 -10.159 -10.654 12.750 1.00 0.53 C ATOM 1112 CG GLN A 96 -11.191 -10.158 13.778 1.00 0.60 C ATOM 1113 CD GLN A 96 -11.095 -10.855 15.126 1.00 1.46 C ATOM 1114 OE1 GLN A 96 -10.144 -11.558 15.447 1.00 2.32 O ATOM 1115 NE2 GLN A 96 -12.076 -10.684 15.973 1.00 1.78 N ATOM 0 H GLN A 96 -8.689 -11.030 10.802 1.00 0.48 H new ATOM 0 HA GLN A 96 -11.529 -10.840 11.121 1.00 0.50 H new ATOM 0 HB2 GLN A 96 -10.032 -11.732 12.851 1.00 0.53 H new ATOM 0 HB3 GLN A 96 -9.191 -10.198 12.955 1.00 0.53 H new ATOM 0 HG2 GLN A 96 -11.060 -9.086 13.923 1.00 0.60 H new ATOM 0 HG3 GLN A 96 -12.193 -10.304 13.374 1.00 0.60 H new ATOM 0 HE21 GLN A 96 -12.874 -10.101 15.719 1.00 1.78 H new ATOM 0 HE22 GLN A 96 -12.044 -11.133 16.888 1.00 1.78 H new ATOM 1124 N THR A 97 -12.130 -8.416 11.208 1.00 0.57 N ATOM 1125 CA THR A 97 -12.567 -7.050 10.892 1.00 0.53 C ATOM 1126 C THR A 97 -12.753 -6.193 12.145 1.00 0.56 C ATOM 1127 O THR A 97 -13.225 -6.665 13.182 1.00 0.65 O ATOM 1128 CB THR A 97 -13.798 -7.027 9.981 1.00 0.59 C ATOM 1129 OG1 THR A 97 -15.001 -7.243 10.681 1.00 0.77 O ATOM 1130 CG2 THR A 97 -13.722 -8.028 8.828 1.00 0.59 C ATOM 0 H THR A 97 -12.893 -9.029 11.495 1.00 0.57 H new ATOM 0 HA THR A 97 -11.757 -6.592 10.325 1.00 0.53 H new ATOM 0 HB THR A 97 -13.797 -6.019 9.567 1.00 0.59 H new ATOM 0 HG1 THR A 97 -15.754 -7.217 10.054 1.00 0.77 H new ATOM 0 HG21 THR A 97 -14.627 -7.957 8.224 1.00 0.59 H new ATOM 0 HG22 THR A 97 -12.854 -7.804 8.208 1.00 0.59 H new ATOM 0 HG23 THR A 97 -13.631 -9.038 9.228 1.00 0.59 H new ATOM 1138 N LEU A 98 -12.368 -4.919 12.067 1.00 0.52 N ATOM 1139 CA LEU A 98 -12.239 -4.033 13.230 1.00 0.58 C ATOM 1140 C LEU A 98 -13.504 -3.212 13.551 1.00 0.65 C ATOM 1141 O LEU A 98 -13.549 -2.554 14.590 1.00 0.76 O ATOM 1142 CB LEU A 98 -11.003 -3.136 13.013 1.00 0.54 C ATOM 1143 CG LEU A 98 -9.618 -3.773 13.258 1.00 0.57 C ATOM 1144 CD1 LEU A 98 -9.347 -4.018 14.736 1.00 0.80 C ATOM 1145 CD2 LEU A 98 -9.337 -5.096 12.549 1.00 0.44 C ATOM 0 H LEU A 98 -12.133 -4.465 11.184 1.00 0.52 H new ATOM 0 HA LEU A 98 -12.108 -4.656 14.115 1.00 0.58 H new ATOM 0 HB2 LEU A 98 -11.029 -2.767 11.988 1.00 0.54 H new ATOM 0 HB3 LEU A 98 -11.096 -2.268 13.666 1.00 0.54 H new ATOM 0 HG LEU A 98 -8.960 -3.017 12.830 1.00 0.57 H new ATOM 0 HD11 LEU A 98 -8.361 -4.467 14.856 1.00 0.80 H new ATOM 0 HD12 LEU A 98 -9.382 -3.071 15.274 1.00 0.80 H new ATOM 0 HD13 LEU A 98 -10.104 -4.692 15.138 1.00 0.80 H new ATOM 0 HD21 LEU A 98 -8.334 -5.438 12.802 1.00 0.44 H new ATOM 0 HD22 LEU A 98 -10.066 -5.841 12.867 1.00 0.44 H new ATOM 0 HD23 LEU A 98 -9.411 -4.954 11.471 1.00 0.44 H new ATOM 1157 N GLY A 99 -14.527 -3.234 12.692 1.00 0.63 N ATOM 1158 CA GLY A 99 -15.757 -2.451 12.868 1.00 0.71 C ATOM 1159 C GLY A 99 -15.628 -0.992 12.414 1.00 0.73 C ATOM 1160 O GLY A 99 -16.362 -0.133 12.903 1.00 0.82 O ATOM 0 H GLY A 99 -14.526 -3.802 11.845 1.00 0.63 H new ATOM 0 HA2 GLY A 99 -16.563 -2.926 12.309 1.00 0.71 H new ATOM 0 HA3 GLY A 99 -16.043 -2.471 13.920 1.00 0.71 H new ATOM 1164 N VAL A 100 -14.689 -0.700 11.504 1.00 0.67 N ATOM 1165 CA VAL A 100 -14.441 0.638 10.938 1.00 0.66 C ATOM 1166 C VAL A 100 -14.318 0.529 9.416 1.00 0.60 C ATOM 1167 O VAL A 100 -13.829 -0.481 8.899 1.00 0.55 O ATOM 1168 CB VAL A 100 -13.184 1.292 11.557 1.00 0.66 C ATOM 1169 CG1 VAL A 100 -12.949 2.716 11.026 1.00 1.10 C ATOM 1170 CG2 VAL A 100 -13.284 1.390 13.086 1.00 1.17 C ATOM 0 H VAL A 100 -14.060 -1.409 11.128 1.00 0.67 H new ATOM 0 HA VAL A 100 -15.284 1.285 11.182 1.00 0.66 H new ATOM 0 HB VAL A 100 -12.355 0.644 11.271 1.00 0.66 H new ATOM 0 HG11 VAL A 100 -12.055 3.134 11.489 1.00 1.10 H new ATOM 0 HG12 VAL A 100 -12.816 2.684 9.945 1.00 1.10 H new ATOM 0 HG13 VAL A 100 -13.809 3.341 11.267 1.00 1.10 H new ATOM 0 HG21 VAL A 100 -12.381 1.855 13.481 1.00 1.17 H new ATOM 0 HG22 VAL A 100 -14.151 1.993 13.356 1.00 1.17 H new ATOM 0 HG23 VAL A 100 -13.392 0.391 13.508 1.00 1.17 H new ATOM 1180 N ASN A 101 -14.755 1.562 8.694 1.00 0.61 N ATOM 1181 CA ASN A 101 -14.798 1.628 7.249 1.00 0.55 C ATOM 1182 C ASN A 101 -14.237 2.963 6.724 1.00 0.49 C ATOM 1183 O ASN A 101 -14.179 3.942 7.469 1.00 0.53 O ATOM 1184 CB ASN A 101 -16.285 1.431 6.938 1.00 0.66 C ATOM 1185 CG ASN A 101 -16.673 1.675 5.513 1.00 0.83 C ATOM 1186 OD1 ASN A 101 -17.426 2.581 5.190 1.00 1.29 O ATOM 1187 ND2 ASN A 101 -16.160 0.909 4.601 1.00 0.86 N ATOM 0 H ASN A 101 -15.104 2.414 9.133 1.00 0.61 H new ATOM 0 HA ASN A 101 -14.175 0.880 6.758 1.00 0.55 H new ATOM 0 HB2 ASN A 101 -16.564 0.412 7.205 1.00 0.66 H new ATOM 0 HB3 ASN A 101 -16.865 2.098 7.576 1.00 0.66 H new ATOM 0 HD21 ASN A 101 -16.386 1.064 3.618 1.00 0.86 H new ATOM 0 HD22 ASN A 101 -15.531 0.151 4.866 1.00 0.86 H new ATOM 1194 N ILE A 102 -13.805 2.994 5.460 1.00 0.45 N ATOM 1195 CA ILE A 102 -13.069 4.115 4.847 1.00 0.43 C ATOM 1196 C ILE A 102 -13.663 4.467 3.465 1.00 0.48 C ATOM 1197 O ILE A 102 -14.058 3.577 2.706 1.00 0.62 O ATOM 1198 CB ILE A 102 -11.547 3.789 4.793 1.00 0.39 C ATOM 1199 CG1 ILE A 102 -10.979 3.396 6.186 1.00 0.37 C ATOM 1200 CG2 ILE A 102 -10.780 5.003 4.243 1.00 0.42 C ATOM 1201 CD1 ILE A 102 -9.526 2.898 6.201 1.00 0.36 C ATOM 0 H ILE A 102 -13.959 2.221 4.813 1.00 0.45 H new ATOM 0 HA ILE A 102 -13.181 5.006 5.464 1.00 0.43 H new ATOM 0 HB ILE A 102 -11.417 2.931 4.134 1.00 0.39 H new ATOM 0 HG12 ILE A 102 -11.053 4.261 6.845 1.00 0.37 H new ATOM 0 HG13 ILE A 102 -11.614 2.618 6.610 1.00 0.37 H new ATOM 0 HG21 ILE A 102 -9.715 4.774 4.206 1.00 0.42 H new ATOM 0 HG22 ILE A 102 -11.137 5.235 3.239 1.00 0.42 H new ATOM 0 HG23 ILE A 102 -10.944 5.862 4.894 1.00 0.42 H new ATOM 0 HD11 ILE A 102 -9.236 2.653 7.223 1.00 0.36 H new ATOM 0 HD12 ILE A 102 -9.440 2.009 5.576 1.00 0.36 H new ATOM 0 HD13 ILE A 102 -8.870 3.678 5.815 1.00 0.36 H new ATOM 1213 N ASP A 103 -13.751 5.756 3.116 1.00 0.47 N ATOM 1214 CA ASP A 103 -14.190 6.217 1.783 1.00 0.50 C ATOM 1215 C ASP A 103 -13.054 6.183 0.738 1.00 0.50 C ATOM 1216 O ASP A 103 -11.928 6.517 1.104 1.00 0.48 O ATOM 1217 CB ASP A 103 -14.691 7.657 1.878 1.00 0.58 C ATOM 1218 CG ASP A 103 -15.720 7.932 0.796 1.00 0.78 C ATOM 1219 OD1 ASP A 103 -16.883 7.496 0.950 1.00 1.81 O ATOM 1220 OD2 ASP A 103 -15.321 8.516 -0.235 1.00 1.63 O ATOM 0 H ASP A 103 -13.519 6.519 3.752 1.00 0.47 H new ATOM 0 HA ASP A 103 -14.978 5.537 1.461 1.00 0.50 H new ATOM 0 HB2 ASP A 103 -15.131 7.832 2.860 1.00 0.58 H new ATOM 0 HB3 ASP A 103 -13.854 8.347 1.776 1.00 0.58 H new ATOM 1225 N PRO A 104 -13.282 5.895 -0.563 1.00 0.60 N ATOM 1226 CA PRO A 104 -12.210 5.965 -1.560 1.00 0.67 C ATOM 1227 C PRO A 104 -11.880 7.405 -1.998 1.00 0.75 C ATOM 1228 O PRO A 104 -10.790 7.650 -2.512 1.00 0.85 O ATOM 1229 CB PRO A 104 -12.682 5.067 -2.701 1.00 0.73 C ATOM 1230 CG PRO A 104 -14.205 5.193 -2.666 1.00 0.86 C ATOM 1231 CD PRO A 104 -14.540 5.521 -1.208 1.00 0.70 C ATOM 0 HA PRO A 104 -11.258 5.621 -1.155 1.00 0.67 H new ATOM 0 HB2 PRO A 104 -12.277 5.393 -3.659 1.00 0.73 H new ATOM 0 HB3 PRO A 104 -12.364 4.035 -2.554 1.00 0.73 H new ATOM 0 HG2 PRO A 104 -14.552 5.978 -3.337 1.00 0.86 H new ATOM 0 HG3 PRO A 104 -14.685 4.267 -2.983 1.00 0.86 H new ATOM 0 HD2 PRO A 104 -15.262 6.336 -1.150 1.00 0.70 H new ATOM 0 HD3 PRO A 104 -14.989 4.661 -0.711 1.00 0.70 H new ATOM 1239 N GLN A 105 -12.789 8.361 -1.779 1.00 0.75 N ATOM 1240 CA GLN A 105 -12.656 9.773 -2.151 1.00 0.84 C ATOM 1241 C GLN A 105 -12.193 10.646 -0.980 1.00 0.84 C ATOM 1242 O GLN A 105 -11.254 11.440 -1.108 1.00 0.91 O ATOM 1243 CB GLN A 105 -14.016 10.255 -2.681 1.00 0.92 C ATOM 1244 CG GLN A 105 -14.553 9.367 -3.803 1.00 0.92 C ATOM 1245 CD GLN A 105 -13.573 9.279 -4.964 1.00 0.99 C ATOM 1246 OE1 GLN A 105 -13.266 10.270 -5.619 1.00 1.42 O ATOM 1247 NE2 GLN A 105 -12.975 8.130 -5.189 1.00 0.92 N ATOM 0 H GLN A 105 -13.677 8.163 -1.317 1.00 0.75 H new ATOM 0 HA GLN A 105 -11.888 9.864 -2.919 1.00 0.84 H new ATOM 0 HB2 GLN A 105 -14.735 10.276 -1.862 1.00 0.92 H new ATOM 0 HB3 GLN A 105 -13.919 11.278 -3.046 1.00 0.92 H new ATOM 0 HG2 GLN A 105 -14.749 8.368 -3.415 1.00 0.92 H new ATOM 0 HG3 GLN A 105 -15.504 9.763 -4.158 1.00 0.92 H new ATOM 0 HE21 GLN A 105 -13.231 7.307 -4.644 1.00 0.92 H new ATOM 0 HE22 GLN A 105 -12.255 8.062 -5.909 1.00 0.92 H new ATOM 1256 N THR A 106 -12.830 10.482 0.182 1.00 0.81 N ATOM 1257 CA THR A 106 -12.507 11.253 1.399 1.00 0.78 C ATOM 1258 C THR A 106 -11.284 10.688 2.124 1.00 0.68 C ATOM 1259 O THR A 106 -10.544 11.449 2.751 1.00 0.71 O ATOM 1260 CB THR A 106 -13.709 11.359 2.358 1.00 0.80 C ATOM 1261 OG1 THR A 106 -13.814 10.220 3.170 1.00 0.69 O ATOM 1262 CG2 THR A 106 -15.022 11.563 1.604 1.00 0.92 C ATOM 0 H THR A 106 -13.587 9.811 0.312 1.00 0.81 H new ATOM 0 HA THR A 106 -12.263 12.262 1.066 1.00 0.78 H new ATOM 0 HB THR A 106 -13.529 12.232 2.985 1.00 0.80 H new ATOM 0 HG1 THR A 106 -14.666 10.240 3.653 1.00 0.69 H new ATOM 0 HG21 THR A 106 -15.844 11.633 2.317 1.00 0.92 H new ATOM 0 HG22 THR A 106 -14.968 12.483 1.021 1.00 0.92 H new ATOM 0 HG23 THR A 106 -15.192 10.719 0.935 1.00 0.92 H new ATOM 1270 N PHE A 107 -11.046 9.371 2.003 1.00 0.63 N ATOM 1271 CA PHE A 107 -10.048 8.607 2.772 1.00 0.62 C ATOM 1272 C PHE A 107 -10.251 8.692 4.305 1.00 0.61 C ATOM 1273 O PHE A 107 -9.355 8.335 5.074 1.00 0.73 O ATOM 1274 CB PHE A 107 -8.616 8.930 2.272 1.00 0.79 C ATOM 1275 CG PHE A 107 -7.973 7.960 1.287 1.00 0.67 C ATOM 1276 CD1 PHE A 107 -8.716 7.195 0.364 1.00 1.88 C ATOM 1277 CD2 PHE A 107 -6.569 7.832 1.289 1.00 1.37 C ATOM 1278 CE1 PHE A 107 -8.074 6.272 -0.468 1.00 1.93 C ATOM 1279 CE2 PHE A 107 -5.926 6.923 0.433 1.00 1.32 C ATOM 1280 CZ PHE A 107 -6.680 6.120 -0.432 1.00 0.73 C ATOM 0 H PHE A 107 -11.561 8.788 1.344 1.00 0.63 H new ATOM 0 HA PHE A 107 -10.204 7.546 2.575 1.00 0.62 H new ATOM 0 HB2 PHE A 107 -8.638 9.915 1.806 1.00 0.79 H new ATOM 0 HB3 PHE A 107 -7.965 9.004 3.143 1.00 0.79 H new ATOM 0 HD1 PHE A 107 -9.786 7.323 0.299 1.00 1.88 H new ATOM 0 HD2 PHE A 107 -5.980 8.441 1.958 1.00 1.37 H new ATOM 0 HE1 PHE A 107 -8.659 5.669 -1.147 1.00 1.93 H new ATOM 0 HE2 PHE A 107 -4.849 6.843 0.442 1.00 1.32 H new ATOM 0 HZ PHE A 107 -6.194 5.392 -1.064 1.00 0.73 H new ATOM 1290 N LYS A 108 -11.435 9.128 4.768 1.00 0.57 N ATOM 1291 CA LYS A 108 -11.746 9.362 6.188 1.00 0.66 C ATOM 1292 C LYS A 108 -12.400 8.134 6.836 1.00 0.60 C ATOM 1293 O LYS A 108 -13.122 7.373 6.179 1.00 0.54 O ATOM 1294 CB LYS A 108 -12.531 10.687 6.334 1.00 0.83 C ATOM 1295 CG LYS A 108 -14.063 10.554 6.380 1.00 0.93 C ATOM 1296 CD LYS A 108 -14.594 10.590 7.822 1.00 1.36 C ATOM 1297 CE LYS A 108 -16.020 10.037 7.895 1.00 1.50 C ATOM 1298 NZ LYS A 108 -16.489 9.912 9.295 1.00 2.65 N ATOM 0 H LYS A 108 -12.221 9.332 4.150 1.00 0.57 H new ATOM 0 HA LYS A 108 -10.826 9.493 6.758 1.00 0.66 H new ATOM 0 HB2 LYS A 108 -12.201 11.185 7.246 1.00 0.83 H new ATOM 0 HB3 LYS A 108 -12.266 11.338 5.501 1.00 0.83 H new ATOM 0 HG2 LYS A 108 -14.516 11.362 5.805 1.00 0.93 H new ATOM 0 HG3 LYS A 108 -14.361 9.619 5.906 1.00 0.93 H new ATOM 0 HD2 LYS A 108 -13.940 10.006 8.469 1.00 1.36 H new ATOM 0 HD3 LYS A 108 -14.578 11.614 8.194 1.00 1.36 H new ATOM 0 HE2 LYS A 108 -16.693 10.693 7.343 1.00 1.50 H new ATOM 0 HE3 LYS A 108 -16.057 9.061 7.410 1.00 1.50 H new ATOM 0 HZ1 LYS A 108 -17.475 9.583 9.303 1.00 2.65 H new ATOM 0 HZ2 LYS A 108 -15.892 9.228 9.801 1.00 2.65 H new ATOM 0 HZ3 LYS A 108 -16.429 10.838 9.765 1.00 2.65 H new ATOM 1312 N LEU A 109 -12.164 7.946 8.132 1.00 0.72 N ATOM 1313 CA LEU A 109 -12.621 6.789 8.910 1.00 0.71 C ATOM 1314 C LEU A 109 -14.058 6.968 9.413 1.00 0.79 C ATOM 1315 O LEU A 109 -14.412 8.025 9.939 1.00 0.94 O ATOM 1316 CB LEU A 109 -11.679 6.566 10.105 1.00 0.75 C ATOM 1317 CG LEU A 109 -10.227 6.243 9.699 1.00 0.72 C ATOM 1318 CD1 LEU A 109 -9.218 6.745 10.723 1.00 0.80 C ATOM 1319 CD2 LEU A 109 -10.031 4.740 9.606 1.00 0.71 C ATOM 0 H LEU A 109 -11.633 8.614 8.691 1.00 0.72 H new ATOM 0 HA LEU A 109 -12.606 5.920 8.253 1.00 0.71 H new ATOM 0 HB2 LEU A 109 -11.682 7.459 10.730 1.00 0.75 H new ATOM 0 HB3 LEU A 109 -12.067 5.749 10.714 1.00 0.75 H new ATOM 0 HG LEU A 109 -10.063 6.737 8.741 1.00 0.72 H new ATOM 0 HD11 LEU A 109 -8.210 6.494 10.393 1.00 0.80 H new ATOM 0 HD12 LEU A 109 -9.309 7.827 10.823 1.00 0.80 H new ATOM 0 HD13 LEU A 109 -9.412 6.274 11.687 1.00 0.80 H new ATOM 0 HD21 LEU A 109 -9.002 4.524 9.319 1.00 0.71 H new ATOM 0 HD22 LEU A 109 -10.240 4.285 10.574 1.00 0.71 H new ATOM 0 HD23 LEU A 109 -10.710 4.330 8.858 1.00 0.71 H new ATOM 1331 N SER A 110 -14.871 5.912 9.353 1.00 0.75 N ATOM 1332 CA SER A 110 -16.220 5.879 9.942 1.00 0.86 C ATOM 1333 C SER A 110 -16.239 5.449 11.425 1.00 0.90 C ATOM 1334 O SER A 110 -17.274 5.014 11.938 1.00 1.16 O ATOM 1335 CB SER A 110 -17.172 5.081 9.047 1.00 1.07 C ATOM 1336 OG SER A 110 -18.515 5.340 9.422 1.00 2.84 O ATOM 0 H SER A 110 -14.612 5.042 8.889 1.00 0.75 H new ATOM 0 HA SER A 110 -16.592 6.903 9.974 1.00 0.86 H new ATOM 0 HB2 SER A 110 -17.018 5.353 8.003 1.00 1.07 H new ATOM 0 HB3 SER A 110 -16.960 4.015 9.134 1.00 1.07 H new ATOM 0 HG SER A 110 -18.584 5.356 10.399 1.00 2.84 H new ATOM 1342 N GLY A 111 -15.095 5.564 12.106 1.00 0.87 N ATOM 1343 CA GLY A 111 -14.880 5.256 13.521 1.00 1.05 C ATOM 1344 C GLY A 111 -13.447 5.573 13.964 1.00 1.05 C ATOM 1345 O GLY A 111 -12.613 5.944 13.139 1.00 1.21 O ATOM 0 H GLY A 111 -14.242 5.895 11.655 1.00 0.87 H new ATOM 0 HA2 GLY A 111 -15.582 5.828 14.128 1.00 1.05 H new ATOM 0 HA3 GLY A 111 -15.090 4.201 13.699 1.00 1.05 H new ATOM 1349 N ALA A 112 -13.162 5.449 15.261 1.00 0.96 N ATOM 1350 CA ALA A 112 -11.850 5.771 15.836 1.00 0.93 C ATOM 1351 C ALA A 112 -10.762 4.726 15.500 1.00 0.95 C ATOM 1352 O ALA A 112 -11.064 3.587 15.128 1.00 1.01 O ATOM 1353 CB ALA A 112 -12.020 5.967 17.348 1.00 1.00 C ATOM 0 H ALA A 112 -13.839 5.120 15.950 1.00 0.96 H new ATOM 0 HA ALA A 112 -11.489 6.694 15.383 1.00 0.93 H new ATOM 0 HB1 ALA A 112 -11.055 6.207 17.794 1.00 1.00 H new ATOM 0 HB2 ALA A 112 -12.719 6.783 17.533 1.00 1.00 H new ATOM 0 HB3 ALA A 112 -12.407 5.050 17.792 1.00 1.00 H new ATOM 1359 N MET A 113 -9.488 5.103 15.670 1.00 0.96 N ATOM 1360 CA MET A 113 -8.317 4.288 15.307 1.00 0.96 C ATOM 1361 C MET A 113 -8.368 2.857 15.895 1.00 0.94 C ATOM 1362 O MET A 113 -8.645 2.691 17.090 1.00 1.05 O ATOM 1363 CB MET A 113 -7.022 5.010 15.741 1.00 1.09 C ATOM 1364 CG MET A 113 -6.355 5.749 14.575 1.00 1.14 C ATOM 1365 SD MET A 113 -5.337 4.680 13.512 1.00 1.63 S ATOM 1366 CE MET A 113 -5.625 5.447 11.899 1.00 1.29 C ATOM 0 H MET A 113 -9.235 6.005 16.074 1.00 0.96 H new ATOM 0 HA MET A 113 -8.329 4.173 14.223 1.00 0.96 H new ATOM 0 HB2 MET A 113 -7.252 5.720 16.535 1.00 1.09 H new ATOM 0 HB3 MET A 113 -6.324 4.283 16.156 1.00 1.09 H new ATOM 0 HG2 MET A 113 -7.127 6.220 13.967 1.00 1.14 H new ATOM 0 HG3 MET A 113 -5.731 6.549 14.974 1.00 1.14 H new ATOM 0 HE1 MET A 113 -4.925 5.037 11.171 1.00 1.29 H new ATOM 0 HE2 MET A 113 -6.646 5.243 11.576 1.00 1.29 H new ATOM 0 HE3 MET A 113 -5.478 6.524 11.977 1.00 1.29 H new ATOM 1376 N PRO A 114 -8.104 1.813 15.085 1.00 0.85 N ATOM 1377 CA PRO A 114 -8.213 0.408 15.486 1.00 0.84 C ATOM 1378 C PRO A 114 -7.020 -0.091 16.321 1.00 0.93 C ATOM 1379 O PRO A 114 -5.902 0.406 16.196 1.00 1.07 O ATOM 1380 CB PRO A 114 -8.296 -0.364 14.171 1.00 0.74 C ATOM 1381 CG PRO A 114 -7.417 0.482 13.254 1.00 0.77 C ATOM 1382 CD PRO A 114 -7.768 1.894 13.670 1.00 0.82 C ATOM 0 HA PRO A 114 -9.080 0.267 16.132 1.00 0.84 H new ATOM 0 HB2 PRO A 114 -7.921 -1.383 14.271 1.00 0.74 H new ATOM 0 HB3 PRO A 114 -9.320 -0.436 13.803 1.00 0.74 H new ATOM 0 HG2 PRO A 114 -6.358 0.269 13.398 1.00 0.77 H new ATOM 0 HG3 PRO A 114 -7.638 0.303 12.202 1.00 0.77 H new ATOM 0 HD2 PRO A 114 -6.930 2.571 13.504 1.00 0.82 H new ATOM 0 HD3 PRO A 114 -8.607 2.277 13.089 1.00 0.82 H new ATOM 1390 N ALA A 115 -7.253 -1.132 17.120 1.00 0.94 N ATOM 1391 CA ALA A 115 -6.287 -1.723 18.053 1.00 1.01 C ATOM 1392 C ALA A 115 -5.314 -2.757 17.450 1.00 0.99 C ATOM 1393 O ALA A 115 -4.176 -2.887 17.902 1.00 1.58 O ATOM 1394 CB ALA A 115 -7.135 -2.446 19.096 1.00 1.05 C ATOM 0 H ALA A 115 -8.155 -1.607 17.138 1.00 0.94 H new ATOM 0 HA ALA A 115 -5.654 -0.918 18.426 1.00 1.01 H new ATOM 0 HB1 ALA A 115 -6.483 -2.916 19.832 1.00 1.05 H new ATOM 0 HB2 ALA A 115 -7.788 -1.729 19.594 1.00 1.05 H new ATOM 0 HB3 ALA A 115 -7.740 -3.210 18.607 1.00 1.05 H new ATOM 1400 N THR A 116 -5.806 -3.550 16.496 1.00 0.79 N ATOM 1401 CA THR A 116 -5.149 -4.760 15.950 1.00 0.60 C ATOM 1402 C THR A 116 -5.131 -4.793 14.416 1.00 0.49 C ATOM 1403 O THR A 116 -4.775 -5.797 13.803 1.00 0.49 O ATOM 1404 CB THR A 116 -5.831 -6.024 16.519 1.00 0.57 C ATOM 1405 OG1 THR A 116 -7.232 -5.897 16.424 1.00 0.90 O ATOM 1406 CG2 THR A 116 -5.532 -6.215 18.004 1.00 0.75 C ATOM 0 H THR A 116 -6.709 -3.367 16.059 1.00 0.79 H new ATOM 0 HA THR A 116 -4.106 -4.733 16.264 1.00 0.60 H new ATOM 0 HB THR A 116 -5.448 -6.866 15.942 1.00 0.57 H new ATOM 0 HG1 THR A 116 -7.659 -6.702 16.785 1.00 0.90 H new ATOM 0 HG21 THR A 116 -6.031 -7.115 18.363 1.00 0.75 H new ATOM 0 HG22 THR A 116 -4.456 -6.314 18.149 1.00 0.75 H new ATOM 0 HG23 THR A 116 -5.895 -5.352 18.562 1.00 0.75 H new ATOM 1414 N ALA A 117 -5.495 -3.682 13.773 1.00 0.51 N ATOM 1415 CA ALA A 117 -5.472 -3.534 12.308 1.00 0.47 C ATOM 1416 C ALA A 117 -4.090 -3.769 11.657 1.00 0.44 C ATOM 1417 O ALA A 117 -3.046 -3.477 12.242 1.00 0.53 O ATOM 1418 CB ALA A 117 -5.965 -2.134 11.936 1.00 0.54 C ATOM 0 H ALA A 117 -5.819 -2.845 14.258 1.00 0.51 H new ATOM 0 HA ALA A 117 -6.127 -4.314 11.919 1.00 0.47 H new ATOM 0 HB1 ALA A 117 -5.950 -2.019 10.852 1.00 0.54 H new ATOM 0 HB2 ALA A 117 -6.983 -1.998 12.301 1.00 0.54 H new ATOM 0 HB3 ALA A 117 -5.314 -1.387 12.389 1.00 0.54 H new ATOM 1424 N MET A 118 -4.098 -4.208 10.398 1.00 0.38 N ATOM 1425 CA MET A 118 -2.916 -4.425 9.556 1.00 0.39 C ATOM 1426 C MET A 118 -2.399 -3.107 8.949 1.00 0.39 C ATOM 1427 O MET A 118 -2.760 -2.732 7.836 1.00 0.48 O ATOM 1428 CB MET A 118 -3.310 -5.474 8.505 1.00 0.35 C ATOM 1429 CG MET A 118 -2.222 -5.827 7.490 1.00 0.38 C ATOM 1430 SD MET A 118 -2.552 -7.422 6.687 1.00 1.89 S ATOM 1431 CE MET A 118 -0.923 -7.898 6.061 1.00 0.96 C ATOM 0 H MET A 118 -4.967 -4.433 9.913 1.00 0.38 H new ATOM 0 HA MET A 118 -2.074 -4.797 10.140 1.00 0.39 H new ATOM 0 HB2 MET A 118 -3.611 -6.386 9.021 1.00 0.35 H new ATOM 0 HB3 MET A 118 -4.184 -5.111 7.964 1.00 0.35 H new ATOM 0 HG2 MET A 118 -2.160 -5.044 6.734 1.00 0.38 H new ATOM 0 HG3 MET A 118 -1.254 -5.864 7.990 1.00 0.38 H new ATOM 0 HE1 MET A 118 -0.803 -8.978 6.143 1.00 0.96 H new ATOM 0 HE2 MET A 118 -0.834 -7.601 5.016 1.00 0.96 H new ATOM 0 HE3 MET A 118 -0.149 -7.402 6.647 1.00 0.96 H new ATOM 1441 N LYS A 119 -1.565 -2.371 9.688 1.00 0.40 N ATOM 1442 CA LYS A 119 -0.957 -1.082 9.290 1.00 0.44 C ATOM 1443 C LYS A 119 0.535 -1.009 9.630 1.00 0.51 C ATOM 1444 O LYS A 119 0.978 -1.692 10.555 1.00 0.67 O ATOM 1445 CB LYS A 119 -1.738 0.054 9.957 1.00 0.50 C ATOM 1446 CG LYS A 119 -1.806 0.002 11.494 1.00 0.54 C ATOM 1447 CD LYS A 119 -2.910 0.964 11.950 1.00 0.92 C ATOM 1448 CE LYS A 119 -3.180 1.002 13.463 1.00 1.11 C ATOM 1449 NZ LYS A 119 -1.945 0.995 14.290 1.00 1.23 N ATOM 0 H LYS A 119 -1.277 -2.663 10.622 1.00 0.40 H new ATOM 0 HA LYS A 119 -1.019 -0.986 8.206 1.00 0.44 H new ATOM 0 HB2 LYS A 119 -1.287 1.002 9.663 1.00 0.50 H new ATOM 0 HB3 LYS A 119 -2.755 0.050 9.566 1.00 0.50 H new ATOM 0 HG2 LYS A 119 -2.020 -1.012 11.832 1.00 0.54 H new ATOM 0 HG3 LYS A 119 -0.848 0.288 11.928 1.00 0.54 H new ATOM 0 HD2 LYS A 119 -2.648 1.970 11.621 1.00 0.92 H new ATOM 0 HD3 LYS A 119 -3.835 0.693 11.441 1.00 0.92 H new ATOM 0 HE2 LYS A 119 -3.759 1.895 13.698 1.00 1.11 H new ATOM 0 HE3 LYS A 119 -3.794 0.144 13.735 1.00 1.11 H new ATOM 0 HZ1 LYS A 119 -2.198 1.107 15.293 1.00 1.23 H new ATOM 0 HZ2 LYS A 119 -1.444 0.093 14.158 1.00 1.23 H new ATOM 0 HZ3 LYS A 119 -1.328 1.780 13.999 1.00 1.23 H new ATOM 1463 N LYS A 120 1.295 -0.195 8.888 1.00 0.47 N ATOM 1464 CA LYS A 120 2.747 0.038 9.057 1.00 0.53 C ATOM 1465 C LYS A 120 3.186 1.302 8.305 1.00 0.51 C ATOM 1466 O LYS A 120 2.516 1.720 7.364 1.00 0.62 O ATOM 1467 CB LYS A 120 3.516 -1.208 8.571 1.00 0.76 C ATOM 1468 CG LYS A 120 5.006 -1.175 8.928 1.00 0.90 C ATOM 1469 CD LYS A 120 5.620 -2.573 8.875 1.00 0.72 C ATOM 1470 CE LYS A 120 7.149 -2.546 8.935 1.00 0.99 C ATOM 1471 NZ LYS A 120 7.662 -1.982 10.202 1.00 1.87 N ATOM 0 H LYS A 120 0.904 0.347 8.117 1.00 0.47 H new ATOM 0 HA LYS A 120 2.972 0.200 10.111 1.00 0.53 H new ATOM 0 HB2 LYS A 120 3.064 -2.099 9.007 1.00 0.76 H new ATOM 0 HB3 LYS A 120 3.410 -1.294 7.490 1.00 0.76 H new ATOM 0 HG2 LYS A 120 5.533 -0.517 8.237 1.00 0.90 H new ATOM 0 HG3 LYS A 120 5.134 -0.757 9.926 1.00 0.90 H new ATOM 0 HD2 LYS A 120 5.238 -3.166 9.706 1.00 0.72 H new ATOM 0 HD3 LYS A 120 5.305 -3.070 7.958 1.00 0.72 H new ATOM 0 HE2 LYS A 120 7.531 -3.560 8.813 1.00 0.99 H new ATOM 0 HE3 LYS A 120 7.531 -1.958 8.100 1.00 0.99 H new ATOM 0 HZ1 LYS A 120 8.702 -1.988 10.189 1.00 1.87 H new ATOM 0 HZ2 LYS A 120 7.322 -1.005 10.310 1.00 1.87 H new ATOM 0 HZ3 LYS A 120 7.323 -2.556 11.000 1.00 1.87 H new ATOM 1485 N LEU A 121 4.317 1.889 8.700 1.00 0.51 N ATOM 1486 CA LEU A 121 4.984 2.981 7.971 1.00 0.52 C ATOM 1487 C LEU A 121 6.145 2.478 7.089 1.00 0.56 C ATOM 1488 O LEU A 121 6.842 1.549 7.496 1.00 0.58 O ATOM 1489 CB LEU A 121 5.482 4.051 8.956 1.00 0.50 C ATOM 1490 CG LEU A 121 4.342 4.732 9.736 1.00 0.44 C ATOM 1491 CD1 LEU A 121 4.165 4.156 11.140 1.00 0.50 C ATOM 1492 CD2 LEU A 121 4.593 6.233 9.857 1.00 0.50 C ATOM 0 H LEU A 121 4.808 1.617 9.551 1.00 0.51 H new ATOM 0 HA LEU A 121 4.244 3.422 7.302 1.00 0.52 H new ATOM 0 HB2 LEU A 121 6.174 3.592 9.662 1.00 0.50 H new ATOM 0 HB3 LEU A 121 6.042 4.808 8.408 1.00 0.50 H new ATOM 0 HG LEU A 121 3.431 4.543 9.168 1.00 0.44 H new ATOM 0 HD11 LEU A 121 3.349 4.672 11.645 1.00 0.50 H new ATOM 0 HD12 LEU A 121 3.934 3.093 11.071 1.00 0.50 H new ATOM 0 HD13 LEU A 121 5.086 4.291 11.707 1.00 0.50 H new ATOM 0 HD21 LEU A 121 3.776 6.695 10.411 1.00 0.50 H new ATOM 0 HD22 LEU A 121 5.532 6.404 10.384 1.00 0.50 H new ATOM 0 HD23 LEU A 121 4.651 6.674 8.862 1.00 0.50 H new ATOM 1504 N THR A 122 6.433 3.094 5.931 1.00 0.56 N ATOM 1505 CA THR A 122 7.679 2.778 5.187 1.00 0.55 C ATOM 1506 C THR A 122 8.903 3.206 6.014 1.00 0.54 C ATOM 1507 O THR A 122 8.985 4.358 6.441 1.00 0.64 O ATOM 1508 CB THR A 122 7.751 3.373 3.760 1.00 0.56 C ATOM 1509 OG1 THR A 122 7.198 4.671 3.695 1.00 0.61 O ATOM 1510 CG2 THR A 122 7.043 2.538 2.686 1.00 0.60 C ATOM 0 H THR A 122 5.840 3.799 5.492 1.00 0.56 H new ATOM 0 HA THR A 122 7.675 1.698 5.043 1.00 0.55 H new ATOM 0 HB THR A 122 8.821 3.385 3.551 1.00 0.56 H new ATOM 0 HG1 THR A 122 7.531 5.129 2.895 1.00 0.61 H new ATOM 0 HG21 THR A 122 7.144 3.029 1.718 1.00 0.60 H new ATOM 0 HG22 THR A 122 7.495 1.547 2.639 1.00 0.60 H new ATOM 0 HG23 THR A 122 5.986 2.443 2.937 1.00 0.60 H new ATOM 1518 N GLU A 123 9.853 2.297 6.269 1.00 0.48 N ATOM 1519 CA GLU A 123 10.949 2.548 7.234 1.00 0.56 C ATOM 1520 C GLU A 123 12.140 3.346 6.684 1.00 0.65 C ATOM 1521 O GLU A 123 12.603 4.322 7.284 1.00 0.77 O ATOM 1522 CB GLU A 123 11.483 1.256 7.871 1.00 0.62 C ATOM 1523 CG GLU A 123 11.622 -0.003 7.020 1.00 0.65 C ATOM 1524 CD GLU A 123 12.722 -0.904 7.612 1.00 1.08 C ATOM 1525 OE1 GLU A 123 12.451 -1.755 8.493 1.00 1.99 O ATOM 1526 OE2 GLU A 123 13.909 -0.720 7.232 1.00 2.02 O ATOM 0 H GLU A 123 9.891 1.380 5.825 1.00 0.48 H new ATOM 0 HA GLU A 123 10.464 3.169 7.987 1.00 0.56 H new ATOM 0 HB2 GLU A 123 12.466 1.479 8.286 1.00 0.62 H new ATOM 0 HB3 GLU A 123 10.831 1.012 8.710 1.00 0.62 H new ATOM 0 HG2 GLU A 123 10.674 -0.540 6.989 1.00 0.65 H new ATOM 0 HG3 GLU A 123 11.870 0.265 5.993 1.00 0.65 H new ATOM 1533 N ALA A 124 12.666 2.880 5.559 1.00 0.70 N ATOM 1534 CA ALA A 124 13.782 3.472 4.830 1.00 0.87 C ATOM 1535 C ALA A 124 13.660 3.109 3.347 1.00 1.04 C ATOM 1536 O ALA A 124 13.735 3.985 2.487 1.00 1.37 O ATOM 1537 CB ALA A 124 15.105 2.964 5.422 1.00 0.84 C ATOM 0 H ALA A 124 12.309 2.038 5.107 1.00 0.70 H new ATOM 0 HA ALA A 124 13.763 4.558 4.923 1.00 0.87 H new ATOM 0 HB1 ALA A 124 15.940 3.405 4.878 1.00 0.84 H new ATOM 0 HB2 ALA A 124 15.166 3.247 6.473 1.00 0.84 H new ATOM 0 HB3 ALA A 124 15.149 1.878 5.336 1.00 0.84 H new ATOM 1543 N GLU A 125 13.384 1.834 3.053 1.00 1.01 N ATOM 1544 CA GLU A 125 13.226 1.350 1.682 1.00 1.39 C ATOM 1545 C GLU A 125 11.820 0.828 1.348 1.00 1.35 C ATOM 1546 O GLU A 125 11.479 0.737 0.167 1.00 2.17 O ATOM 1547 CB GLU A 125 14.303 0.293 1.399 1.00 1.68 C ATOM 1548 CG GLU A 125 15.739 0.840 1.484 1.00 1.94 C ATOM 1549 CD GLU A 125 16.711 0.060 0.588 1.00 2.88 C ATOM 1550 OE1 GLU A 125 16.894 -1.169 0.777 1.00 3.28 O ATOM 1551 OE2 GLU A 125 17.285 0.682 -0.341 1.00 4.09 O ATOM 0 H GLU A 125 13.264 1.110 3.761 1.00 1.01 H new ATOM 0 HA GLU A 125 13.356 2.208 1.023 1.00 1.39 H new ATOM 0 HB2 GLU A 125 14.192 -0.526 2.110 1.00 1.68 H new ATOM 0 HB3 GLU A 125 14.140 -0.123 0.405 1.00 1.68 H new ATOM 0 HG2 GLU A 125 15.743 1.891 1.194 1.00 1.94 H new ATOM 0 HG3 GLU A 125 16.083 0.793 2.517 1.00 1.94 H new ATOM 1558 N GLY A 126 10.996 0.531 2.358 1.00 0.65 N ATOM 1559 CA GLY A 126 9.687 -0.111 2.216 1.00 0.49 C ATOM 1560 C GLY A 126 9.061 -0.484 3.572 1.00 0.49 C ATOM 1561 O GLY A 126 9.535 -0.028 4.612 1.00 0.64 O ATOM 0 H GLY A 126 11.231 0.738 3.329 1.00 0.65 H new ATOM 0 HA2 GLY A 126 9.014 0.559 1.681 1.00 0.49 H new ATOM 0 HA3 GLY A 126 9.791 -1.010 1.608 1.00 0.49 H new ATOM 1565 N ALA A 127 7.976 -1.262 3.558 1.00 0.42 N ATOM 1566 CA ALA A 127 7.336 -1.887 4.729 1.00 0.41 C ATOM 1567 C ALA A 127 6.826 -3.311 4.430 1.00 0.40 C ATOM 1568 O ALA A 127 6.039 -3.479 3.494 1.00 0.39 O ATOM 1569 CB ALA A 127 6.171 -0.995 5.177 1.00 0.45 C ATOM 0 H ALA A 127 7.492 -1.487 2.689 1.00 0.42 H new ATOM 0 HA ALA A 127 8.080 -1.980 5.520 1.00 0.41 H new ATOM 0 HB1 ALA A 127 5.684 -1.441 6.044 1.00 0.45 H new ATOM 0 HB2 ALA A 127 6.550 -0.008 5.442 1.00 0.45 H new ATOM 0 HB3 ALA A 127 5.451 -0.902 4.364 1.00 0.45 H new ATOM 1575 N LYS A 128 7.210 -4.317 5.235 1.00 0.41 N ATOM 1576 CA LYS A 128 6.748 -5.717 5.118 1.00 0.40 C ATOM 1577 C LYS A 128 5.362 -5.929 5.741 1.00 0.44 C ATOM 1578 O LYS A 128 5.102 -5.503 6.867 1.00 0.50 O ATOM 1579 CB LYS A 128 7.767 -6.678 5.768 1.00 0.45 C ATOM 1580 CG LYS A 128 7.460 -8.163 5.477 1.00 0.86 C ATOM 1581 CD LYS A 128 8.249 -9.127 6.375 1.00 0.82 C ATOM 1582 CE LYS A 128 7.815 -10.571 6.080 1.00 1.00 C ATOM 1583 NZ LYS A 128 8.383 -11.535 7.051 1.00 1.25 N ATOM 0 H LYS A 128 7.866 -4.179 6.004 1.00 0.41 H new ATOM 0 HA LYS A 128 6.667 -5.936 4.053 1.00 0.40 H new ATOM 0 HB2 LYS A 128 8.767 -6.440 5.404 1.00 0.45 H new ATOM 0 HB3 LYS A 128 7.774 -6.518 6.846 1.00 0.45 H new ATOM 0 HG2 LYS A 128 6.393 -8.341 5.612 1.00 0.86 H new ATOM 0 HG3 LYS A 128 7.689 -8.378 4.433 1.00 0.86 H new ATOM 0 HD2 LYS A 128 9.318 -9.014 6.197 1.00 0.82 H new ATOM 0 HD3 LYS A 128 8.073 -8.890 7.424 1.00 0.82 H new ATOM 0 HE2 LYS A 128 6.727 -10.633 6.103 1.00 1.00 H new ATOM 0 HE3 LYS A 128 8.129 -10.845 5.073 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 8.064 -12.496 6.813 1.00 1.25 H new ATOM 0 HZ2 LYS A 128 9.422 -11.496 7.012 1.00 1.25 H new ATOM 0 HZ3 LYS A 128 8.063 -11.291 8.010 1.00 1.25 H new ATOM 1597 N PHE A 129 4.521 -6.675 5.033 1.00 0.46 N ATOM 1598 CA PHE A 129 3.215 -7.195 5.432 1.00 0.49 C ATOM 1599 C PHE A 129 3.191 -8.709 5.180 1.00 0.53 C ATOM 1600 O PHE A 129 3.751 -9.197 4.194 1.00 0.61 O ATOM 1601 CB PHE A 129 2.152 -6.465 4.612 1.00 0.52 C ATOM 1602 CG PHE A 129 1.926 -5.035 5.048 1.00 0.49 C ATOM 1603 CD1 PHE A 129 2.849 -4.045 4.680 1.00 2.07 C ATOM 1604 CD2 PHE A 129 0.831 -4.693 5.861 1.00 1.75 C ATOM 1605 CE1 PHE A 129 2.679 -2.733 5.130 1.00 2.06 C ATOM 1606 CE2 PHE A 129 0.644 -3.368 6.288 1.00 1.77 C ATOM 1607 CZ PHE A 129 1.567 -2.380 5.913 1.00 0.50 C ATOM 0 H PHE A 129 4.755 -6.957 4.081 1.00 0.46 H new ATOM 0 HA PHE A 129 3.017 -7.029 6.491 1.00 0.49 H new ATOM 0 HB2 PHE A 129 2.446 -6.474 3.562 1.00 0.52 H new ATOM 0 HB3 PHE A 129 1.211 -7.011 4.684 1.00 0.52 H new ATOM 0 HD1 PHE A 129 3.689 -4.296 4.050 1.00 2.07 H new ATOM 0 HD2 PHE A 129 0.127 -5.456 6.160 1.00 1.75 H new ATOM 0 HE1 PHE A 129 3.411 -1.982 4.873 1.00 2.06 H new ATOM 0 HE2 PHE A 129 -0.206 -3.111 6.902 1.00 1.77 H new ATOM 0 HZ PHE A 129 1.424 -1.356 6.224 1.00 0.50 H new ATOM 1617 N ASN A 130 2.555 -9.472 6.064 1.00 0.78 N ATOM 1618 CA ASN A 130 2.535 -10.934 6.016 1.00 0.75 C ATOM 1619 C ASN A 130 1.168 -11.440 5.540 1.00 0.71 C ATOM 1620 O ASN A 130 0.173 -11.336 6.253 1.00 0.79 O ATOM 1621 CB ASN A 130 2.892 -11.418 7.428 1.00 0.81 C ATOM 1622 CG ASN A 130 2.704 -12.901 7.673 1.00 0.92 C ATOM 1623 OD1 ASN A 130 2.381 -13.314 8.780 1.00 2.14 O ATOM 1624 ND2 ASN A 130 2.931 -13.746 6.698 1.00 2.04 N ATOM 0 H ASN A 130 2.029 -9.087 6.848 1.00 0.78 H new ATOM 0 HA ASN A 130 3.255 -11.329 5.299 1.00 0.75 H new ATOM 0 HB2 ASN A 130 3.932 -11.163 7.629 1.00 0.81 H new ATOM 0 HB3 ASN A 130 2.284 -10.868 8.147 1.00 0.81 H new ATOM 0 HD21 ASN A 130 2.839 -14.749 6.860 1.00 2.04 H new ATOM 0 HD22 ASN A 130 3.200 -13.401 5.776 1.00 2.04 H new ATOM 1631 N THR A 131 1.127 -12.029 4.345 1.00 0.75 N ATOM 1632 CA THR A 131 -0.105 -12.534 3.726 1.00 0.72 C ATOM 1633 C THR A 131 -0.376 -14.015 3.982 1.00 0.70 C ATOM 1634 O THR A 131 -1.487 -14.464 3.712 1.00 0.65 O ATOM 1635 CB THR A 131 -0.132 -12.236 2.222 1.00 0.74 C ATOM 1636 OG1 THR A 131 1.054 -12.678 1.605 1.00 0.77 O ATOM 1637 CG2 THR A 131 -0.271 -10.739 1.960 1.00 0.80 C ATOM 0 H THR A 131 1.957 -12.172 3.770 1.00 0.75 H new ATOM 0 HA THR A 131 -0.913 -11.992 4.217 1.00 0.72 H new ATOM 0 HB THR A 131 -0.991 -12.764 1.808 1.00 0.74 H new ATOM 0 HG1 THR A 131 1.017 -12.480 0.646 1.00 0.77 H new ATOM 0 HG21 THR A 131 -0.287 -10.558 0.885 1.00 0.80 H new ATOM 0 HG22 THR A 131 -1.199 -10.377 2.403 1.00 0.80 H new ATOM 0 HG23 THR A 131 0.573 -10.212 2.404 1.00 0.80 H new ATOM 1645 N ALA A 132 0.574 -14.753 4.574 1.00 0.78 N ATOM 1646 CA ALA A 132 0.505 -16.201 4.835 1.00 0.84 C ATOM 1647 C ALA A 132 -0.738 -16.673 5.622 1.00 0.83 C ATOM 1648 O ALA A 132 -1.008 -17.876 5.673 1.00 0.94 O ATOM 1649 CB ALA A 132 1.760 -16.604 5.617 1.00 0.97 C ATOM 0 H ALA A 132 1.449 -14.341 4.898 1.00 0.78 H new ATOM 0 HA ALA A 132 0.434 -16.681 3.859 1.00 0.84 H new ATOM 0 HB1 ALA A 132 1.732 -17.674 5.823 1.00 0.97 H new ATOM 0 HB2 ALA A 132 2.647 -16.371 5.027 1.00 0.97 H new ATOM 0 HB3 ALA A 132 1.795 -16.054 6.558 1.00 0.97 H new ATOM 1655 N ASN A 133 -1.469 -15.750 6.253 1.00 0.87 N ATOM 1656 CA ASN A 133 -2.633 -16.018 7.097 1.00 0.94 C ATOM 1657 C ASN A 133 -3.968 -15.644 6.415 1.00 0.89 C ATOM 1658 O ASN A 133 -5.009 -16.199 6.781 1.00 1.11 O ATOM 1659 CB ASN A 133 -2.461 -15.319 8.465 1.00 1.05 C ATOM 1660 CG ASN A 133 -1.037 -14.904 8.801 1.00 1.30 C ATOM 1661 OD1 ASN A 133 -0.187 -15.718 9.123 1.00 1.70 O ATOM 1662 ND2 ASN A 133 -0.711 -13.642 8.647 1.00 2.62 N ATOM 0 H ASN A 133 -1.256 -14.755 6.186 1.00 0.87 H new ATOM 0 HA ASN A 133 -2.686 -17.094 7.261 1.00 0.94 H new ATOM 0 HB2 ASN A 133 -3.096 -14.433 8.486 1.00 1.05 H new ATOM 0 HB3 ASN A 133 -2.822 -15.988 9.246 1.00 1.05 H new ATOM 0 HD21 ASN A 133 0.252 -13.342 8.796 1.00 2.62 H new ATOM 0 HD22 ASN A 133 -1.421 -12.961 8.378 1.00 2.62 H new ATOM 1669 N LEU A 134 -3.976 -14.759 5.405 1.00 0.68 N ATOM 1670 CA LEU A 134 -5.205 -14.367 4.708 1.00 0.60 C ATOM 1671 C LEU A 134 -5.749 -15.484 3.798 1.00 0.67 C ATOM 1672 O LEU A 134 -4.966 -16.209 3.179 1.00 0.77 O ATOM 1673 CB LEU A 134 -4.987 -13.093 3.873 1.00 0.52 C ATOM 1674 CG LEU A 134 -4.928 -11.740 4.605 1.00 0.45 C ATOM 1675 CD1 LEU A 134 -5.807 -11.654 5.853 1.00 0.50 C ATOM 1676 CD2 LEU A 134 -3.496 -11.364 4.951 1.00 0.47 C ATOM 0 H LEU A 134 -3.136 -14.300 5.053 1.00 0.68 H new ATOM 0 HA LEU A 134 -5.945 -14.173 5.485 1.00 0.60 H new ATOM 0 HB2 LEU A 134 -4.055 -13.213 3.321 1.00 0.52 H new ATOM 0 HB3 LEU A 134 -5.788 -13.037 3.136 1.00 0.52 H new ATOM 0 HG LEU A 134 -5.338 -11.022 3.895 1.00 0.45 H new ATOM 0 HD11 LEU A 134 -5.703 -10.667 6.304 1.00 0.50 H new ATOM 0 HD12 LEU A 134 -6.848 -11.819 5.577 1.00 0.50 H new ATOM 0 HD13 LEU A 134 -5.497 -12.415 6.569 1.00 0.50 H new ATOM 0 HD21 LEU A 134 -3.486 -10.404 5.467 1.00 0.47 H new ATOM 0 HD22 LEU A 134 -3.065 -12.128 5.598 1.00 0.47 H new ATOM 0 HD23 LEU A 134 -2.908 -11.290 4.036 1.00 0.47 H new ATOM 1688 N PRO A 135 -7.079 -15.629 3.676 1.00 0.67 N ATOM 1689 CA PRO A 135 -7.690 -16.543 2.719 1.00 0.72 C ATOM 1690 C PRO A 135 -7.618 -16.004 1.282 1.00 0.74 C ATOM 1691 O PRO A 135 -7.333 -14.827 1.045 1.00 0.70 O ATOM 1692 CB PRO A 135 -9.132 -16.708 3.187 1.00 0.74 C ATOM 1693 CG PRO A 135 -9.449 -15.357 3.835 1.00 0.70 C ATOM 1694 CD PRO A 135 -8.106 -14.918 4.429 1.00 0.65 C ATOM 0 HA PRO A 135 -7.164 -17.497 2.688 1.00 0.72 H new ATOM 0 HB2 PRO A 135 -9.803 -16.922 2.355 1.00 0.74 H new ATOM 0 HB3 PRO A 135 -9.233 -17.528 3.897 1.00 0.74 H new ATOM 0 HG2 PRO A 135 -9.818 -14.638 3.103 1.00 0.70 H new ATOM 0 HG3 PRO A 135 -10.216 -15.451 4.604 1.00 0.70 H new ATOM 0 HD2 PRO A 135 -7.976 -13.839 4.343 1.00 0.65 H new ATOM 0 HD3 PRO A 135 -8.051 -15.162 5.490 1.00 0.65 H new ATOM 1702 N ALA A 136 -7.927 -16.873 0.320 1.00 0.81 N ATOM 1703 CA ALA A 136 -7.870 -16.636 -1.117 1.00 0.88 C ATOM 1704 C ALA A 136 -8.997 -15.705 -1.587 1.00 0.88 C ATOM 1705 O ALA A 136 -10.016 -16.148 -2.128 1.00 1.07 O ATOM 1706 CB ALA A 136 -7.949 -18.006 -1.789 1.00 0.99 C ATOM 0 H ALA A 136 -8.243 -17.818 0.540 1.00 0.81 H new ATOM 0 HA ALA A 136 -6.944 -16.128 -1.386 1.00 0.88 H new ATOM 0 HB1 ALA A 136 -7.910 -17.883 -2.871 1.00 0.99 H new ATOM 0 HB2 ALA A 136 -7.109 -18.620 -1.463 1.00 0.99 H new ATOM 0 HB3 ALA A 136 -8.884 -18.493 -1.513 1.00 0.99 H new ATOM 1712 N ALA A 137 -8.825 -14.416 -1.318 1.00 0.75 N ATOM 1713 CA ALA A 137 -9.767 -13.360 -1.649 1.00 0.70 C ATOM 1714 C ALA A 137 -9.034 -12.073 -2.098 1.00 0.59 C ATOM 1715 O ALA A 137 -7.806 -12.065 -2.244 1.00 0.61 O ATOM 1716 CB ALA A 137 -10.667 -13.158 -0.423 1.00 0.78 C ATOM 0 H ALA A 137 -7.992 -14.067 -0.845 1.00 0.75 H new ATOM 0 HA ALA A 137 -10.387 -13.634 -2.503 1.00 0.70 H new ATOM 0 HB1 ALA A 137 -11.392 -12.371 -0.630 1.00 0.78 H new ATOM 0 HB2 ALA A 137 -11.193 -14.086 -0.201 1.00 0.78 H new ATOM 0 HB3 ALA A 137 -10.056 -12.873 0.434 1.00 0.78 H new ATOM 1722 N LYS A 138 -9.780 -10.980 -2.305 1.00 0.55 N ATOM 1723 CA LYS A 138 -9.256 -9.643 -2.629 1.00 0.50 C ATOM 1724 C LYS A 138 -9.319 -8.690 -1.430 1.00 0.45 C ATOM 1725 O LYS A 138 -10.146 -8.836 -0.524 1.00 0.51 O ATOM 1726 CB LYS A 138 -9.996 -9.078 -3.852 1.00 0.54 C ATOM 1727 CG LYS A 138 -9.593 -9.789 -5.155 1.00 0.61 C ATOM 1728 CD LYS A 138 -10.635 -9.585 -6.261 1.00 0.82 C ATOM 1729 CE LYS A 138 -11.813 -10.540 -6.044 1.00 2.59 C ATOM 1730 NZ LYS A 138 -12.889 -10.334 -7.033 1.00 3.01 N ATOM 0 H LYS A 138 -10.798 -11.001 -2.250 1.00 0.55 H new ATOM 0 HA LYS A 138 -8.199 -9.741 -2.878 1.00 0.50 H new ATOM 0 HB2 LYS A 138 -11.071 -9.179 -3.703 1.00 0.54 H new ATOM 0 HB3 LYS A 138 -9.785 -8.012 -3.942 1.00 0.54 H new ATOM 0 HG2 LYS A 138 -8.627 -9.411 -5.491 1.00 0.61 H new ATOM 0 HG3 LYS A 138 -9.470 -10.855 -4.964 1.00 0.61 H new ATOM 0 HD2 LYS A 138 -10.986 -8.553 -6.257 1.00 0.82 H new ATOM 0 HD3 LYS A 138 -10.184 -9.765 -7.237 1.00 0.82 H new ATOM 0 HE2 LYS A 138 -11.459 -11.569 -6.104 1.00 2.59 H new ATOM 0 HE3 LYS A 138 -12.213 -10.398 -5.040 1.00 2.59 H new ATOM 0 HZ1 LYS A 138 -13.664 -11.002 -6.847 1.00 3.01 H new ATOM 0 HZ2 LYS A 138 -13.246 -9.360 -6.960 1.00 3.01 H new ATOM 0 HZ3 LYS A 138 -12.516 -10.495 -7.990 1.00 3.01 H new ATOM 1744 N TYR A 139 -8.431 -7.700 -1.459 1.00 0.40 N ATOM 1745 CA TYR A 139 -8.157 -6.715 -0.405 1.00 0.36 C ATOM 1746 C TYR A 139 -7.799 -5.361 -1.027 1.00 0.32 C ATOM 1747 O TYR A 139 -7.572 -5.257 -2.236 1.00 0.36 O ATOM 1748 CB TYR A 139 -6.997 -7.215 0.477 1.00 0.40 C ATOM 1749 CG TYR A 139 -7.225 -8.598 1.047 1.00 0.39 C ATOM 1750 CD1 TYR A 139 -6.851 -9.717 0.280 1.00 0.38 C ATOM 1751 CD2 TYR A 139 -7.890 -8.769 2.279 1.00 0.49 C ATOM 1752 CE1 TYR A 139 -7.186 -11.001 0.723 1.00 0.45 C ATOM 1753 CE2 TYR A 139 -8.188 -10.071 2.731 1.00 0.55 C ATOM 1754 CZ TYR A 139 -7.842 -11.183 1.947 1.00 0.51 C ATOM 1755 OH TYR A 139 -8.127 -12.432 2.378 1.00 0.59 O ATOM 0 H TYR A 139 -7.839 -7.550 -2.276 1.00 0.40 H new ATOM 0 HA TYR A 139 -9.049 -6.590 0.209 1.00 0.36 H new ATOM 0 HB2 TYR A 139 -6.080 -7.220 -0.112 1.00 0.40 H new ATOM 0 HB3 TYR A 139 -6.846 -6.513 1.297 1.00 0.40 H new ATOM 0 HD1 TYR A 139 -6.309 -9.585 -0.645 1.00 0.38 H new ATOM 0 HD2 TYR A 139 -8.169 -7.910 2.871 1.00 0.49 H new ATOM 0 HE1 TYR A 139 -6.937 -11.859 0.116 1.00 0.45 H new ATOM 0 HE2 TYR A 139 -8.683 -10.213 3.681 1.00 0.55 H new ATOM 0 HH TYR A 139 -7.737 -13.087 1.763 1.00 0.59 H new ATOM 1765 N LYS A 140 -7.731 -4.321 -0.194 1.00 0.33 N ATOM 1766 CA LYS A 140 -7.313 -2.963 -0.610 1.00 0.32 C ATOM 1767 C LYS A 140 -6.378 -2.270 0.386 1.00 0.33 C ATOM 1768 O LYS A 140 -6.443 -2.551 1.579 1.00 0.38 O ATOM 1769 CB LYS A 140 -8.537 -2.075 -0.913 1.00 0.36 C ATOM 1770 CG LYS A 140 -9.348 -2.554 -2.115 1.00 0.48 C ATOM 1771 CD LYS A 140 -10.391 -1.513 -2.531 1.00 0.48 C ATOM 1772 CE LYS A 140 -11.247 -2.190 -3.607 1.00 0.62 C ATOM 1773 NZ LYS A 140 -12.127 -1.247 -4.334 1.00 1.67 N ATOM 0 H LYS A 140 -7.964 -4.388 0.797 1.00 0.33 H new ATOM 0 HA LYS A 140 -6.734 -3.101 -1.523 1.00 0.32 H new ATOM 0 HB2 LYS A 140 -9.183 -2.047 -0.035 1.00 0.36 H new ATOM 0 HB3 LYS A 140 -8.201 -1.054 -1.094 1.00 0.36 H new ATOM 0 HG2 LYS A 140 -8.679 -2.756 -2.951 1.00 0.48 H new ATOM 0 HG3 LYS A 140 -9.845 -3.493 -1.871 1.00 0.48 H new ATOM 0 HD2 LYS A 140 -11.001 -1.208 -1.680 1.00 0.48 H new ATOM 0 HD3 LYS A 140 -9.913 -0.614 -2.919 1.00 0.48 H new ATOM 0 HE2 LYS A 140 -10.592 -2.689 -4.321 1.00 0.62 H new ATOM 0 HE3 LYS A 140 -11.859 -2.962 -3.142 1.00 0.62 H new ATOM 0 HZ1 LYS A 140 -12.679 -1.766 -5.047 1.00 1.67 H new ATOM 0 HZ2 LYS A 140 -12.774 -0.788 -3.662 1.00 1.67 H new ATOM 0 HZ3 LYS A 140 -11.547 -0.524 -4.805 1.00 1.67 H new ATOM 1787 N ILE A 141 -5.555 -1.327 -0.078 1.00 0.35 N ATOM 1788 CA ILE A 141 -4.682 -0.485 0.768 1.00 0.36 C ATOM 1789 C ILE A 141 -5.126 0.983 0.716 1.00 0.38 C ATOM 1790 O ILE A 141 -5.420 1.513 -0.359 1.00 0.41 O ATOM 1791 CB ILE A 141 -3.181 -0.656 0.419 1.00 0.40 C ATOM 1792 CG1 ILE A 141 -2.695 -2.109 0.635 1.00 0.37 C ATOM 1793 CG2 ILE A 141 -2.261 0.246 1.260 1.00 0.45 C ATOM 1794 CD1 ILE A 141 -2.725 -2.907 -0.663 1.00 0.38 C ATOM 0 H ILE A 141 -5.469 -1.117 -1.072 1.00 0.35 H new ATOM 0 HA ILE A 141 -4.791 -0.828 1.797 1.00 0.36 H new ATOM 0 HB ILE A 141 -3.116 -0.376 -0.632 1.00 0.40 H new ATOM 0 HG12 ILE A 141 -1.681 -2.099 1.034 1.00 0.37 H new ATOM 0 HG13 ILE A 141 -3.325 -2.598 1.378 1.00 0.37 H new ATOM 0 HG21 ILE A 141 -1.224 0.080 0.969 1.00 0.45 H new ATOM 0 HG22 ILE A 141 -2.523 1.291 1.091 1.00 0.45 H new ATOM 0 HG23 ILE A 141 -2.384 0.007 2.316 1.00 0.45 H new ATOM 0 HD11 ILE A 141 -2.377 -3.923 -0.474 1.00 0.38 H new ATOM 0 HD12 ILE A 141 -3.744 -2.938 -1.047 1.00 0.38 H new ATOM 0 HD13 ILE A 141 -2.075 -2.432 -1.397 1.00 0.38 H new ATOM 1806 N TYR A 142 -5.140 1.624 1.888 1.00 0.38 N ATOM 1807 CA TYR A 142 -5.504 3.027 2.117 1.00 0.38 C ATOM 1808 C TYR A 142 -4.380 3.761 2.869 1.00 0.38 C ATOM 1809 O TYR A 142 -3.665 3.149 3.658 1.00 0.46 O ATOM 1810 CB TYR A 142 -6.837 3.084 2.881 1.00 0.40 C ATOM 1811 CG TYR A 142 -8.055 2.812 2.017 1.00 0.38 C ATOM 1812 CD1 TYR A 142 -8.401 1.508 1.605 1.00 1.73 C ATOM 1813 CD2 TYR A 142 -8.845 3.898 1.608 1.00 1.84 C ATOM 1814 CE1 TYR A 142 -9.534 1.292 0.799 1.00 1.76 C ATOM 1815 CE2 TYR A 142 -9.971 3.691 0.797 1.00 1.82 C ATOM 1816 CZ TYR A 142 -10.321 2.387 0.392 1.00 0.42 C ATOM 1817 OH TYR A 142 -11.410 2.192 -0.391 1.00 0.47 O ATOM 0 H TYR A 142 -4.883 1.150 2.754 1.00 0.38 H new ATOM 0 HA TYR A 142 -5.632 3.536 1.162 1.00 0.38 H new ATOM 0 HB2 TYR A 142 -6.810 2.357 3.693 1.00 0.40 H new ATOM 0 HB3 TYR A 142 -6.941 4.068 3.338 1.00 0.40 H new ATOM 0 HD1 TYR A 142 -7.792 0.670 1.910 1.00 1.73 H new ATOM 0 HD2 TYR A 142 -8.584 4.899 1.919 1.00 1.84 H new ATOM 0 HE1 TYR A 142 -9.799 0.291 0.494 1.00 1.76 H new ATOM 0 HE2 TYR A 142 -10.571 4.532 0.482 1.00 1.82 H new ATOM 0 HH TYR A 142 -11.838 3.054 -0.577 1.00 0.47 H new ATOM 1827 N GLU A 143 -4.214 5.068 2.644 1.00 0.53 N ATOM 1828 CA GLU A 143 -3.107 5.879 3.191 1.00 0.55 C ATOM 1829 C GLU A 143 -3.632 6.892 4.219 1.00 0.58 C ATOM 1830 O GLU A 143 -4.479 7.723 3.889 1.00 0.83 O ATOM 1831 CB GLU A 143 -2.359 6.548 2.025 1.00 0.63 C ATOM 1832 CG GLU A 143 -1.060 7.240 2.444 1.00 0.74 C ATOM 1833 CD GLU A 143 -0.305 7.740 1.209 1.00 0.79 C ATOM 1834 OE1 GLU A 143 -0.568 8.871 0.732 1.00 1.89 O ATOM 1835 OE2 GLU A 143 0.560 6.998 0.691 1.00 1.77 O ATOM 0 H GLU A 143 -4.856 5.609 2.065 1.00 0.53 H new ATOM 0 HA GLU A 143 -2.402 5.243 3.726 1.00 0.55 H new ATOM 0 HB2 GLU A 143 -2.132 5.795 1.271 1.00 0.63 H new ATOM 0 HB3 GLU A 143 -3.016 7.281 1.556 1.00 0.63 H new ATOM 0 HG2 GLU A 143 -1.282 8.076 3.107 1.00 0.74 H new ATOM 0 HG3 GLU A 143 -0.434 6.546 3.005 1.00 0.74 H new ATOM 1842 N ILE A 144 -3.155 6.814 5.467 1.00 0.57 N ATOM 1843 CA ILE A 144 -3.702 7.559 6.614 1.00 0.55 C ATOM 1844 C ILE A 144 -2.563 8.286 7.340 1.00 0.59 C ATOM 1845 O ILE A 144 -1.721 7.653 7.968 1.00 0.59 O ATOM 1846 CB ILE A 144 -4.445 6.598 7.580 1.00 0.52 C ATOM 1847 CG1 ILE A 144 -5.446 5.621 6.911 1.00 0.51 C ATOM 1848 CG2 ILE A 144 -5.126 7.404 8.703 1.00 0.56 C ATOM 1849 CD1 ILE A 144 -6.667 6.229 6.208 1.00 0.53 C ATOM 0 H ILE A 144 -2.363 6.221 5.716 1.00 0.57 H new ATOM 0 HA ILE A 144 -4.421 8.296 6.255 1.00 0.55 H new ATOM 0 HB ILE A 144 -3.673 5.948 7.992 1.00 0.52 H new ATOM 0 HG12 ILE A 144 -4.898 5.027 6.180 1.00 0.51 H new ATOM 0 HG13 ILE A 144 -5.806 4.933 7.676 1.00 0.51 H new ATOM 0 HG21 ILE A 144 -5.645 6.722 9.377 1.00 0.56 H new ATOM 0 HG22 ILE A 144 -4.372 7.960 9.260 1.00 0.56 H new ATOM 0 HG23 ILE A 144 -5.843 8.100 8.268 1.00 0.56 H new ATOM 0 HD11 ILE A 144 -7.279 5.431 5.787 1.00 0.53 H new ATOM 0 HD12 ILE A 144 -7.256 6.796 6.928 1.00 0.53 H new ATOM 0 HD13 ILE A 144 -6.334 6.892 5.409 1.00 0.53 H new ATOM 1861 N HIS A 145 -2.558 9.618 7.323 1.00 0.83 N ATOM 1862 CA HIS A 145 -1.478 10.458 7.863 1.00 0.95 C ATOM 1863 C HIS A 145 -1.772 11.008 9.274 1.00 1.00 C ATOM 1864 O HIS A 145 -1.128 11.961 9.715 1.00 1.32 O ATOM 1865 CB HIS A 145 -1.143 11.568 6.852 1.00 1.13 C ATOM 1866 CG HIS A 145 -2.295 12.482 6.518 1.00 2.38 C ATOM 1867 ND1 HIS A 145 -2.893 13.403 7.354 1.00 3.77 N ATOM 1868 CD2 HIS A 145 -2.942 12.547 5.315 1.00 3.53 C ATOM 1869 CE1 HIS A 145 -3.883 14.002 6.674 1.00 5.32 C ATOM 1870 NE2 HIS A 145 -3.946 13.519 5.421 1.00 5.27 N ATOM 0 H HIS A 145 -3.323 10.162 6.924 1.00 0.83 H new ATOM 0 HA HIS A 145 -0.599 9.828 7.999 1.00 0.95 H new ATOM 0 HB2 HIS A 145 -0.324 12.168 7.249 1.00 1.13 H new ATOM 0 HB3 HIS A 145 -0.784 11.107 5.932 1.00 1.13 H new ATOM 0 HD2 HIS A 145 -2.719 11.955 4.440 1.00 3.53 H new ATOM 0 HE1 HIS A 145 -4.536 14.763 7.076 1.00 5.32 H new ATOM 0 HE2 HIS A 145 -4.598 13.804 4.690 1.00 5.27 H new ATOM 1878 N SER A 146 -2.763 10.459 9.989 1.00 0.92 N ATOM 1879 CA SER A 146 -3.176 10.956 11.314 1.00 1.03 C ATOM 1880 C SER A 146 -2.243 10.541 12.463 1.00 1.15 C ATOM 1881 O SER A 146 -2.196 11.223 13.494 1.00 1.38 O ATOM 1882 CB SER A 146 -4.624 10.568 11.600 1.00 1.11 C ATOM 1883 OG SER A 146 -4.773 9.177 11.803 1.00 2.11 O ATOM 0 H SER A 146 -3.304 9.656 9.667 1.00 0.92 H new ATOM 0 HA SER A 146 -3.098 12.042 11.269 1.00 1.03 H new ATOM 0 HB2 SER A 146 -4.974 11.102 12.483 1.00 1.11 H new ATOM 0 HB3 SER A 146 -5.254 10.882 10.768 1.00 1.11 H new ATOM 0 HG SER A 146 -5.714 8.972 11.985 1.00 2.11 H new ATOM 2086 N LYS A 162 -1.886 13.104 -1.411 1.00 1.85 N ATOM 2087 CA LYS A 162 -2.298 11.804 -0.847 1.00 2.08 C ATOM 2088 C LYS A 162 -2.446 10.720 -1.922 1.00 1.51 C ATOM 2089 O LYS A 162 -2.720 11.032 -3.084 1.00 1.37 O ATOM 2090 CB LYS A 162 -3.569 11.975 0.016 1.00 2.92 C ATOM 2091 CG LYS A 162 -4.773 12.710 -0.610 1.00 2.44 C ATOM 2092 CD LYS A 162 -5.596 11.905 -1.637 1.00 2.06 C ATOM 2093 CE LYS A 162 -5.538 12.407 -3.090 1.00 2.10 C ATOM 2094 NZ LYS A 162 -6.023 13.802 -3.224 1.00 3.37 N ATOM 0 HA LYS A 162 -1.501 11.449 -0.193 1.00 2.08 H new ATOM 0 HB2 LYS A 162 -3.904 10.983 0.319 1.00 2.92 H new ATOM 0 HB3 LYS A 162 -3.287 12.508 0.924 1.00 2.92 H new ATOM 0 HG2 LYS A 162 -5.439 13.025 0.193 1.00 2.44 H new ATOM 0 HG3 LYS A 162 -4.409 13.615 -1.095 1.00 2.44 H new ATOM 0 HD2 LYS A 162 -5.253 10.871 -1.617 1.00 2.06 H new ATOM 0 HD3 LYS A 162 -6.638 11.902 -1.316 1.00 2.06 H new ATOM 0 HE2 LYS A 162 -4.512 12.345 -3.453 1.00 2.10 H new ATOM 0 HE3 LYS A 162 -6.139 11.753 -3.722 1.00 2.10 H new ATOM 0 HZ1 LYS A 162 -6.223 14.006 -4.224 1.00 3.37 H new ATOM 0 HZ2 LYS A 162 -6.892 13.922 -2.666 1.00 3.37 H new ATOM 0 HZ3 LYS A 162 -5.295 14.458 -2.876 1.00 3.37 H new ATOM 2108 N ALA A 163 -2.258 9.456 -1.550 1.00 1.45 N ATOM 2109 CA ALA A 163 -2.425 8.323 -2.462 1.00 1.07 C ATOM 2110 C ALA A 163 -3.893 8.041 -2.809 1.00 0.80 C ATOM 2111 O ALA A 163 -4.800 8.354 -2.038 1.00 0.91 O ATOM 2112 CB ALA A 163 -1.757 7.078 -1.867 1.00 1.48 C ATOM 0 H ALA A 163 -1.985 9.186 -0.605 1.00 1.45 H new ATOM 0 HA ALA A 163 -1.939 8.588 -3.401 1.00 1.07 H new ATOM 0 HB1 ALA A 163 -1.883 6.237 -2.548 1.00 1.48 H new ATOM 0 HB2 ALA A 163 -0.694 7.270 -1.721 1.00 1.48 H new ATOM 0 HB3 ALA A 163 -2.218 6.841 -0.908 1.00 1.48 H new ATOM 2118 N VAL A 164 -4.125 7.411 -3.961 1.00 0.60 N ATOM 2119 CA VAL A 164 -5.423 6.818 -4.343 1.00 0.52 C ATOM 2120 C VAL A 164 -5.428 5.314 -4.026 1.00 0.55 C ATOM 2121 O VAL A 164 -4.356 4.700 -4.004 1.00 0.61 O ATOM 2122 CB VAL A 164 -5.841 7.124 -5.799 1.00 0.52 C ATOM 2123 CG1 VAL A 164 -6.735 8.366 -5.821 1.00 0.59 C ATOM 2124 CG2 VAL A 164 -4.662 7.364 -6.745 1.00 0.56 C ATOM 0 H VAL A 164 -3.406 7.292 -4.675 1.00 0.60 H new ATOM 0 HA VAL A 164 -6.191 7.299 -3.737 1.00 0.52 H new ATOM 0 HB VAL A 164 -6.366 6.238 -6.155 1.00 0.52 H new ATOM 0 HG11 VAL A 164 -7.031 8.583 -6.847 1.00 0.59 H new ATOM 0 HG12 VAL A 164 -7.625 8.185 -5.218 1.00 0.59 H new ATOM 0 HG13 VAL A 164 -6.187 9.216 -5.414 1.00 0.59 H new ATOM 0 HG21 VAL A 164 -5.036 7.572 -7.747 1.00 0.56 H new ATOM 0 HG22 VAL A 164 -4.079 8.214 -6.391 1.00 0.56 H new ATOM 0 HG23 VAL A 164 -4.030 6.476 -6.771 1.00 0.56 H new ATOM 2134 N PRO A 165 -6.595 4.713 -3.726 1.00 0.58 N ATOM 2135 CA PRO A 165 -6.673 3.363 -3.170 1.00 0.67 C ATOM 2136 C PRO A 165 -6.342 2.266 -4.193 1.00 0.69 C ATOM 2137 O PRO A 165 -6.732 2.340 -5.365 1.00 0.80 O ATOM 2138 CB PRO A 165 -8.078 3.258 -2.563 1.00 0.72 C ATOM 2139 CG PRO A 165 -8.912 4.218 -3.413 1.00 0.69 C ATOM 2140 CD PRO A 165 -7.922 5.314 -3.803 1.00 0.59 C ATOM 0 HA PRO A 165 -5.913 3.198 -2.406 1.00 0.67 H new ATOM 0 HB2 PRO A 165 -8.462 2.239 -2.616 1.00 0.72 H new ATOM 0 HB3 PRO A 165 -8.083 3.546 -1.512 1.00 0.72 H new ATOM 0 HG2 PRO A 165 -9.324 3.720 -4.291 1.00 0.69 H new ATOM 0 HG3 PRO A 165 -9.754 4.621 -2.851 1.00 0.69 H new ATOM 0 HD2 PRO A 165 -8.125 5.681 -4.809 1.00 0.59 H new ATOM 0 HD3 PRO A 165 -8.002 6.168 -3.130 1.00 0.59 H new ATOM 2148 N ILE A 166 -5.617 1.244 -3.723 1.00 0.65 N ATOM 2149 CA ILE A 166 -5.048 0.143 -4.520 1.00 0.65 C ATOM 2150 C ILE A 166 -5.767 -1.167 -4.186 1.00 0.52 C ATOM 2151 O ILE A 166 -5.998 -1.429 -3.006 1.00 0.55 O ATOM 2152 CB ILE A 166 -3.526 -0.021 -4.252 1.00 0.70 C ATOM 2153 CG1 ILE A 166 -2.742 1.314 -4.252 1.00 0.99 C ATOM 2154 CG2 ILE A 166 -2.889 -0.978 -5.273 1.00 0.69 C ATOM 2155 CD1 ILE A 166 -2.495 1.836 -2.829 1.00 1.39 C ATOM 0 H ILE A 166 -5.399 1.155 -2.731 1.00 0.65 H new ATOM 0 HA ILE A 166 -5.188 0.385 -5.574 1.00 0.65 H new ATOM 0 HB ILE A 166 -3.456 -0.436 -3.247 1.00 0.70 H new ATOM 0 HG12 ILE A 166 -1.787 1.173 -4.758 1.00 0.99 H new ATOM 0 HG13 ILE A 166 -3.297 2.060 -4.821 1.00 0.99 H new ATOM 0 HG21 ILE A 166 -1.824 -1.076 -5.064 1.00 0.69 H new ATOM 0 HG22 ILE A 166 -3.365 -1.956 -5.201 1.00 0.69 H new ATOM 0 HG23 ILE A 166 -3.027 -0.581 -6.279 1.00 0.69 H new ATOM 0 HD11 ILE A 166 -1.942 2.774 -2.876 1.00 1.39 H new ATOM 0 HD12 ILE A 166 -3.450 2.003 -2.332 1.00 1.39 H new ATOM 0 HD13 ILE A 166 -1.917 1.102 -2.267 1.00 1.39 H new ATOM 2167 N GLU A 167 -6.064 -2.013 -5.179 1.00 0.57 N ATOM 2168 CA GLU A 167 -6.619 -3.361 -4.972 1.00 0.57 C ATOM 2169 C GLU A 167 -5.616 -4.498 -5.245 1.00 0.59 C ATOM 2170 O GLU A 167 -4.809 -4.437 -6.176 1.00 0.69 O ATOM 2171 CB GLU A 167 -7.942 -3.527 -5.734 1.00 0.81 C ATOM 2172 CG GLU A 167 -7.846 -3.433 -7.264 1.00 1.36 C ATOM 2173 CD GLU A 167 -9.222 -3.653 -7.903 1.00 1.81 C ATOM 2174 OE1 GLU A 167 -10.210 -3.002 -7.479 1.00 2.59 O ATOM 2175 OE2 GLU A 167 -9.351 -4.525 -8.797 1.00 2.76 O ATOM 0 H GLU A 167 -5.925 -1.780 -6.162 1.00 0.57 H new ATOM 0 HA GLU A 167 -6.837 -3.452 -3.908 1.00 0.57 H new ATOM 0 HB2 GLU A 167 -8.371 -4.495 -5.474 1.00 0.81 H new ATOM 0 HB3 GLU A 167 -8.639 -2.765 -5.385 1.00 0.81 H new ATOM 0 HG2 GLU A 167 -7.458 -2.456 -7.550 1.00 1.36 H new ATOM 0 HG3 GLU A 167 -7.142 -4.177 -7.637 1.00 1.36 H new ATOM 2182 N ILE A 168 -5.662 -5.550 -4.420 1.00 0.54 N ATOM 2183 CA ILE A 168 -4.679 -6.641 -4.379 1.00 0.53 C ATOM 2184 C ILE A 168 -5.339 -7.993 -4.046 1.00 0.57 C ATOM 2185 O ILE A 168 -6.396 -8.054 -3.420 1.00 0.54 O ATOM 2186 CB ILE A 168 -3.545 -6.248 -3.397 1.00 0.43 C ATOM 2187 CG1 ILE A 168 -2.315 -7.161 -3.564 1.00 0.45 C ATOM 2188 CG2 ILE A 168 -4.028 -6.225 -1.936 1.00 0.36 C ATOM 2189 CD1 ILE A 168 -1.043 -6.627 -2.891 1.00 0.37 C ATOM 0 H ILE A 168 -6.411 -5.670 -3.738 1.00 0.54 H new ATOM 0 HA ILE A 168 -4.239 -6.784 -5.366 1.00 0.53 H new ATOM 0 HB ILE A 168 -3.243 -5.232 -3.651 1.00 0.43 H new ATOM 0 HG12 ILE A 168 -2.546 -8.143 -3.152 1.00 0.45 H new ATOM 0 HG13 ILE A 168 -2.120 -7.299 -4.627 1.00 0.45 H new ATOM 0 HG21 ILE A 168 -3.201 -5.945 -1.284 1.00 0.36 H new ATOM 0 HG22 ILE A 168 -4.835 -5.500 -1.831 1.00 0.36 H new ATOM 0 HG23 ILE A 168 -4.391 -7.214 -1.657 1.00 0.36 H new ATOM 0 HD11 ILE A 168 -0.224 -7.327 -3.055 1.00 0.37 H new ATOM 0 HD12 ILE A 168 -0.784 -5.659 -3.319 1.00 0.37 H new ATOM 0 HD13 ILE A 168 -1.217 -6.516 -1.821 1.00 0.37 H new ATOM 2201 N GLU A 169 -4.707 -9.089 -4.459 1.00 0.69 N ATOM 2202 CA GLU A 169 -5.149 -10.480 -4.275 1.00 0.66 C ATOM 2203 C GLU A 169 -3.971 -11.361 -3.808 1.00 0.73 C ATOM 2204 O GLU A 169 -2.808 -11.000 -4.015 1.00 0.82 O ATOM 2205 CB GLU A 169 -5.722 -10.978 -5.615 1.00 0.62 C ATOM 2206 CG GLU A 169 -6.596 -12.228 -5.489 1.00 0.73 C ATOM 2207 CD GLU A 169 -7.033 -12.764 -6.856 1.00 0.86 C ATOM 2208 OE1 GLU A 169 -7.517 -11.982 -7.712 1.00 1.61 O ATOM 2209 OE2 GLU A 169 -6.943 -13.998 -7.070 1.00 1.99 O ATOM 0 H GLU A 169 -3.821 -9.033 -4.961 1.00 0.69 H new ATOM 0 HA GLU A 169 -5.918 -10.537 -3.505 1.00 0.66 H new ATOM 0 HB2 GLU A 169 -6.310 -10.179 -6.067 1.00 0.62 H new ATOM 0 HB3 GLU A 169 -4.897 -11.190 -6.295 1.00 0.62 H new ATOM 0 HG2 GLU A 169 -6.046 -13.003 -4.955 1.00 0.73 H new ATOM 0 HG3 GLU A 169 -7.478 -11.995 -4.892 1.00 0.73 H new ATOM 2216 N LEU A 170 -4.242 -12.528 -3.212 1.00 0.75 N ATOM 2217 CA LEU A 170 -3.202 -13.452 -2.733 1.00 0.86 C ATOM 2218 C LEU A 170 -2.255 -13.918 -3.864 1.00 0.68 C ATOM 2219 O LEU A 170 -2.707 -14.136 -4.998 1.00 0.65 O ATOM 2220 CB LEU A 170 -3.844 -14.667 -2.034 1.00 1.07 C ATOM 2221 CG LEU A 170 -4.107 -14.537 -0.519 1.00 1.38 C ATOM 2222 CD1 LEU A 170 -2.855 -14.415 0.347 1.00 1.17 C ATOM 2223 CD2 LEU A 170 -4.962 -13.319 -0.232 1.00 2.06 C ATOM 0 H LEU A 170 -5.192 -12.861 -3.047 1.00 0.75 H new ATOM 0 HA LEU A 170 -2.593 -12.903 -2.015 1.00 0.86 H new ATOM 0 HB2 LEU A 170 -4.792 -14.881 -2.527 1.00 1.07 H new ATOM 0 HB3 LEU A 170 -3.200 -15.531 -2.194 1.00 1.07 H new ATOM 0 HG LEU A 170 -4.605 -15.470 -0.256 1.00 1.38 H new ATOM 0 HD11 LEU A 170 -3.144 -14.329 1.394 1.00 1.17 H new ATOM 0 HD12 LEU A 170 -2.233 -15.300 0.214 1.00 1.17 H new ATOM 0 HD13 LEU A 170 -2.293 -13.529 0.052 1.00 1.17 H new ATOM 0 HD21 LEU A 170 -5.138 -13.243 0.841 1.00 2.06 H new ATOM 0 HD22 LEU A 170 -4.448 -12.423 -0.580 1.00 2.06 H new ATOM 0 HD23 LEU A 170 -5.916 -13.414 -0.750 1.00 2.06 H new ATOM 2235 N PRO A 171 -0.953 -14.114 -3.572 1.00 0.66 N ATOM 2236 CA PRO A 171 0.067 -14.338 -4.589 1.00 0.55 C ATOM 2237 C PRO A 171 -0.040 -15.697 -5.281 1.00 0.55 C ATOM 2238 O PRO A 171 0.211 -16.743 -4.683 1.00 0.71 O ATOM 2239 CB PRO A 171 1.415 -14.206 -3.877 1.00 0.64 C ATOM 2240 CG PRO A 171 1.097 -14.520 -2.417 1.00 0.79 C ATOM 2241 CD PRO A 171 -0.331 -14.012 -2.256 1.00 0.83 C ATOM 0 HA PRO A 171 -0.058 -13.608 -5.388 1.00 0.55 H new ATOM 0 HB2 PRO A 171 2.150 -14.901 -4.283 1.00 0.64 H new ATOM 0 HB3 PRO A 171 1.828 -13.204 -3.988 1.00 0.64 H new ATOM 0 HG2 PRO A 171 1.171 -15.587 -2.209 1.00 0.79 H new ATOM 0 HG3 PRO A 171 1.783 -14.015 -1.737 1.00 0.79 H new ATOM 0 HD2 PRO A 171 -0.875 -14.607 -1.522 1.00 0.83 H new ATOM 0 HD3 PRO A 171 -0.339 -12.982 -1.901 1.00 0.83 H new ATOM 2249 N LEU A 172 -0.361 -15.646 -6.572 1.00 0.68 N ATOM 2250 CA LEU A 172 -0.256 -16.749 -7.520 1.00 0.90 C ATOM 2251 C LEU A 172 0.586 -16.206 -8.686 1.00 1.13 C ATOM 2252 O LEU A 172 0.073 -15.717 -9.697 1.00 1.73 O ATOM 2253 CB LEU A 172 -1.664 -17.267 -7.870 1.00 1.20 C ATOM 2254 CG LEU A 172 -1.673 -18.708 -8.412 1.00 1.76 C ATOM 2255 CD1 LEU A 172 -3.120 -19.180 -8.550 1.00 2.17 C ATOM 2256 CD2 LEU A 172 -0.982 -18.842 -9.768 1.00 3.51 C ATOM 0 H LEU A 172 -0.718 -14.794 -7.004 1.00 0.68 H new ATOM 0 HA LEU A 172 0.247 -17.636 -7.135 1.00 0.90 H new ATOM 0 HB2 LEU A 172 -2.292 -17.218 -6.980 1.00 1.20 H new ATOM 0 HB3 LEU A 172 -2.111 -16.606 -8.612 1.00 1.20 H new ATOM 0 HG LEU A 172 -1.118 -19.321 -7.701 1.00 1.76 H new ATOM 0 HD11 LEU A 172 -3.135 -20.200 -8.934 1.00 2.17 H new ATOM 0 HD12 LEU A 172 -3.606 -19.152 -7.575 1.00 2.17 H new ATOM 0 HD13 LEU A 172 -3.652 -18.525 -9.240 1.00 2.17 H new ATOM 0 HD21 LEU A 172 -1.022 -19.881 -10.096 1.00 3.51 H new ATOM 0 HD22 LEU A 172 -1.489 -18.211 -10.499 1.00 3.51 H new ATOM 0 HD23 LEU A 172 0.058 -18.529 -9.679 1.00 3.51 H new ATOM 2268 N ASN A 173 1.898 -16.182 -8.450 1.00 1.14 N ATOM 2269 CA ASN A 173 2.930 -15.528 -9.260 1.00 1.48 C ATOM 2270 C ASN A 173 4.257 -16.303 -9.135 1.00 1.54 C ATOM 2271 O ASN A 173 4.507 -16.924 -8.102 1.00 2.11 O ATOM 2272 CB ASN A 173 3.138 -14.094 -8.731 1.00 1.80 C ATOM 2273 CG ASN A 173 1.933 -13.194 -8.781 1.00 1.81 C ATOM 2274 OD1 ASN A 173 1.289 -12.912 -7.778 1.00 3.49 O ATOM 2275 ND2 ASN A 173 1.619 -12.651 -9.919 1.00 1.24 N ATOM 0 H ASN A 173 2.296 -16.649 -7.635 1.00 1.14 H new ATOM 0 HA ASN A 173 2.618 -15.507 -10.304 1.00 1.48 H new ATOM 0 HB2 ASN A 173 3.480 -14.155 -7.698 1.00 1.80 H new ATOM 0 HB3 ASN A 173 3.939 -13.628 -9.305 1.00 1.80 H new ATOM 0 HD21 ASN A 173 0.840 -11.994 -9.973 1.00 1.24 H new ATOM 0 HD22 ASN A 173 2.151 -12.881 -10.758 1.00 1.24 H new ATOM 2282 N ASP A 174 5.164 -16.202 -10.107 1.00 1.68 N ATOM 2283 CA ASP A 174 6.442 -16.944 -10.111 1.00 1.75 C ATOM 2284 C ASP A 174 7.541 -16.306 -9.229 1.00 1.73 C ATOM 2285 O ASP A 174 8.728 -16.335 -9.565 1.00 1.91 O ATOM 2286 CB ASP A 174 6.913 -17.141 -11.557 1.00 2.05 C ATOM 2287 CG ASP A 174 8.053 -18.160 -11.697 1.00 2.99 C ATOM 2288 OD1 ASP A 174 8.057 -19.198 -10.983 1.00 3.64 O ATOM 2289 OD2 ASP A 174 8.977 -17.907 -12.506 1.00 4.08 O ATOM 0 H ASP A 174 5.040 -15.602 -10.922 1.00 1.68 H new ATOM 0 HA ASP A 174 6.253 -17.915 -9.654 1.00 1.75 H new ATOM 0 HB2 ASP A 174 6.069 -17.467 -12.164 1.00 2.05 H new ATOM 0 HB3 ASP A 174 7.242 -16.182 -11.957 1.00 2.05 H new ATOM 2294 N VAL A 175 7.159 -15.682 -8.116 1.00 1.63 N ATOM 2295 CA VAL A 175 8.041 -14.909 -7.234 1.00 1.64 C ATOM 2296 C VAL A 175 8.271 -15.598 -5.886 1.00 1.53 C ATOM 2297 O VAL A 175 7.617 -16.592 -5.565 1.00 1.48 O ATOM 2298 CB VAL A 175 7.562 -13.455 -7.083 1.00 1.59 C ATOM 2299 CG1 VAL A 175 7.521 -12.742 -8.436 1.00 2.07 C ATOM 2300 CG2 VAL A 175 6.188 -13.335 -6.436 1.00 1.01 C ATOM 0 H VAL A 175 6.193 -15.700 -7.789 1.00 1.63 H new ATOM 0 HA VAL A 175 9.017 -14.869 -7.717 1.00 1.64 H new ATOM 0 HB VAL A 175 8.291 -12.982 -6.424 1.00 1.59 H new ATOM 0 HG11 VAL A 175 7.179 -11.717 -8.297 1.00 2.07 H new ATOM 0 HG12 VAL A 175 8.519 -12.735 -8.874 1.00 2.07 H new ATOM 0 HG13 VAL A 175 6.836 -13.266 -9.103 1.00 2.07 H new ATOM 0 HG21 VAL A 175 5.912 -12.283 -6.360 1.00 1.01 H new ATOM 0 HG22 VAL A 175 5.452 -13.860 -7.045 1.00 1.01 H new ATOM 0 HG23 VAL A 175 6.215 -13.776 -5.439 1.00 1.01 H new ATOM 2310 N VAL A 176 9.227 -15.087 -5.111 1.00 1.69 N ATOM 2311 CA VAL A 176 9.474 -15.484 -3.710 1.00 1.78 C ATOM 2312 C VAL A 176 8.899 -14.437 -2.749 1.00 1.51 C ATOM 2313 O VAL A 176 8.466 -14.770 -1.645 1.00 1.59 O ATOM 2314 CB VAL A 176 10.985 -15.695 -3.473 1.00 2.28 C ATOM 2315 CG1 VAL A 176 11.289 -16.112 -2.029 1.00 2.77 C ATOM 2316 CG2 VAL A 176 11.535 -16.782 -4.409 1.00 2.51 C ATOM 0 H VAL A 176 9.871 -14.368 -5.440 1.00 1.69 H new ATOM 0 HA VAL A 176 8.968 -16.429 -3.515 1.00 1.78 H new ATOM 0 HB VAL A 176 11.465 -14.738 -3.676 1.00 2.28 H new ATOM 0 HG11 VAL A 176 12.364 -16.249 -1.908 1.00 2.77 H new ATOM 0 HG12 VAL A 176 10.943 -15.336 -1.346 1.00 2.77 H new ATOM 0 HG13 VAL A 176 10.776 -17.047 -1.805 1.00 2.77 H new ATOM 0 HG21 VAL A 176 12.601 -16.915 -4.225 1.00 2.51 H new ATOM 0 HG22 VAL A 176 11.015 -17.721 -4.221 1.00 2.51 H new ATOM 0 HG23 VAL A 176 11.380 -16.482 -5.445 1.00 2.51 H new ATOM 2326 N ASP A 177 8.846 -13.180 -3.190 1.00 1.28 N ATOM 2327 CA ASP A 177 8.216 -12.068 -2.489 1.00 1.03 C ATOM 2328 C ASP A 177 7.408 -11.182 -3.452 1.00 0.66 C ATOM 2329 O ASP A 177 7.839 -10.892 -4.575 1.00 0.74 O ATOM 2330 CB ASP A 177 9.283 -11.251 -1.747 1.00 1.32 C ATOM 2331 CG ASP A 177 9.264 -11.550 -0.252 1.00 2.16 C ATOM 2332 OD1 ASP A 177 8.293 -11.133 0.420 1.00 3.26 O ATOM 2333 OD2 ASP A 177 10.237 -12.145 0.266 1.00 2.75 O ATOM 0 H ASP A 177 9.258 -12.901 -4.080 1.00 1.28 H new ATOM 0 HA ASP A 177 7.513 -12.472 -1.760 1.00 1.03 H new ATOM 0 HB2 ASP A 177 10.268 -11.479 -2.154 1.00 1.32 H new ATOM 0 HB3 ASP A 177 9.109 -10.187 -1.910 1.00 1.32 H new ATOM 2338 N ALA A 178 6.245 -10.718 -2.989 1.00 0.45 N ATOM 2339 CA ALA A 178 5.406 -9.762 -3.708 1.00 0.31 C ATOM 2340 C ALA A 178 5.762 -8.323 -3.309 1.00 0.34 C ATOM 2341 O ALA A 178 6.215 -8.083 -2.184 1.00 0.36 O ATOM 2342 CB ALA A 178 3.933 -10.079 -3.424 1.00 0.48 C ATOM 0 H ALA A 178 5.856 -11.002 -2.090 1.00 0.45 H new ATOM 0 HA ALA A 178 5.583 -9.849 -4.780 1.00 0.31 H new ATOM 0 HB1 ALA A 178 3.299 -9.370 -3.957 1.00 0.48 H new ATOM 0 HB2 ALA A 178 3.707 -11.091 -3.760 1.00 0.48 H new ATOM 0 HB3 ALA A 178 3.744 -10.001 -2.353 1.00 0.48 H new ATOM 2348 N HIS A 179 5.533 -7.353 -4.200 1.00 0.43 N ATOM 2349 CA HIS A 179 5.777 -5.937 -3.894 1.00 0.49 C ATOM 2350 C HIS A 179 4.680 -4.999 -4.431 1.00 0.63 C ATOM 2351 O HIS A 179 4.019 -5.302 -5.429 1.00 0.97 O ATOM 2352 CB HIS A 179 7.184 -5.507 -4.357 1.00 0.57 C ATOM 2353 CG HIS A 179 8.320 -6.327 -3.793 1.00 0.56 C ATOM 2354 ND1 HIS A 179 9.182 -5.949 -2.792 1.00 0.61 N ATOM 2355 CD2 HIS A 179 8.703 -7.576 -4.200 1.00 0.59 C ATOM 2356 CE1 HIS A 179 10.059 -6.947 -2.591 1.00 0.71 C ATOM 2357 NE2 HIS A 179 9.820 -7.959 -3.445 1.00 0.67 N ATOM 0 H HIS A 179 5.178 -7.522 -5.141 1.00 0.43 H new ATOM 0 HA HIS A 179 5.734 -5.841 -2.809 1.00 0.49 H new ATOM 0 HB2 HIS A 179 7.224 -5.559 -5.445 1.00 0.57 H new ATOM 0 HB3 HIS A 179 7.337 -4.464 -4.082 1.00 0.57 H new ATOM 0 HD1 HIS A 179 9.160 -5.063 -2.288 1.00 0.61 H new ATOM 0 HD2 HIS A 179 8.227 -8.165 -4.970 1.00 0.59 H new ATOM 0 HE1 HIS A 179 10.844 -6.938 -1.849 1.00 0.71 H new ATOM 2365 N VAL A 180 4.505 -3.848 -3.770 1.00 0.43 N ATOM 2366 CA VAL A 180 3.558 -2.774 -4.129 1.00 0.53 C ATOM 2367 C VAL A 180 4.289 -1.457 -4.364 1.00 0.60 C ATOM 2368 O VAL A 180 5.140 -1.097 -3.552 1.00 0.54 O ATOM 2369 CB VAL A 180 2.510 -2.474 -3.028 1.00 0.58 C ATOM 2370 CG1 VAL A 180 1.188 -2.091 -3.682 1.00 0.73 C ATOM 2371 CG2 VAL A 180 2.255 -3.554 -1.980 1.00 0.53 C ATOM 0 H VAL A 180 5.042 -3.626 -2.932 1.00 0.43 H new ATOM 0 HA VAL A 180 3.060 -3.144 -5.025 1.00 0.53 H new ATOM 0 HB VAL A 180 2.959 -1.659 -2.460 1.00 0.58 H new ATOM 0 HG11 VAL A 180 0.448 -1.879 -2.910 1.00 0.73 H new ATOM 0 HG12 VAL A 180 1.331 -1.205 -4.300 1.00 0.73 H new ATOM 0 HG13 VAL A 180 0.838 -2.915 -4.304 1.00 0.73 H new ATOM 0 HG21 VAL A 180 1.500 -3.206 -1.275 1.00 0.53 H new ATOM 0 HG22 VAL A 180 1.903 -4.461 -2.471 1.00 0.53 H new ATOM 0 HG23 VAL A 180 3.180 -3.767 -1.444 1.00 0.53 H new ATOM 2381 N TYR A 181 3.870 -0.685 -5.370 1.00 0.74 N ATOM 2382 CA TYR A 181 4.385 0.665 -5.631 1.00 0.72 C ATOM 2383 C TYR A 181 3.262 1.718 -5.789 1.00 0.76 C ATOM 2384 O TYR A 181 2.952 2.129 -6.911 1.00 0.93 O ATOM 2385 CB TYR A 181 5.345 0.597 -6.823 1.00 0.83 C ATOM 2386 CG TYR A 181 6.669 -0.066 -6.481 1.00 0.89 C ATOM 2387 CD1 TYR A 181 6.812 -1.468 -6.521 1.00 1.57 C ATOM 2388 CD2 TYR A 181 7.741 0.729 -6.041 1.00 2.11 C ATOM 2389 CE1 TYR A 181 8.014 -2.073 -6.101 1.00 1.58 C ATOM 2390 CE2 TYR A 181 8.956 0.138 -5.651 1.00 2.24 C ATOM 2391 CZ TYR A 181 9.085 -1.267 -5.656 1.00 1.17 C ATOM 2392 OH TYR A 181 10.220 -1.842 -5.186 1.00 1.39 O ATOM 0 H TYR A 181 3.155 -0.982 -6.035 1.00 0.74 H new ATOM 0 HA TYR A 181 4.942 1.016 -4.762 1.00 0.72 H new ATOM 0 HB2 TYR A 181 4.869 0.048 -7.635 1.00 0.83 H new ATOM 0 HB3 TYR A 181 5.534 1.606 -7.189 1.00 0.83 H new ATOM 0 HD1 TYR A 181 5.997 -2.081 -6.875 1.00 1.57 H new ATOM 0 HD2 TYR A 181 7.631 1.803 -6.002 1.00 2.11 H new ATOM 0 HE1 TYR A 181 8.115 -3.148 -6.119 1.00 1.58 H new ATOM 0 HE2 TYR A 181 9.787 0.757 -5.349 1.00 2.24 H new ATOM 0 HH TYR A 181 10.856 -1.144 -4.923 1.00 1.39 H new ATOM 2402 N PRO A 182 2.597 2.138 -4.692 1.00 0.65 N ATOM 2403 CA PRO A 182 1.461 3.061 -4.723 1.00 0.68 C ATOM 2404 C PRO A 182 1.853 4.519 -5.019 1.00 0.48 C ATOM 2405 O PRO A 182 2.947 4.972 -4.667 1.00 0.49 O ATOM 2406 CB PRO A 182 0.787 2.907 -3.360 1.00 0.88 C ATOM 2407 CG PRO A 182 1.939 2.540 -2.433 1.00 0.65 C ATOM 2408 CD PRO A 182 2.794 1.654 -3.335 1.00 0.60 C ATOM 0 HA PRO A 182 0.789 2.814 -5.545 1.00 0.68 H new ATOM 0 HB2 PRO A 182 0.299 3.830 -3.047 1.00 0.88 H new ATOM 0 HB3 PRO A 182 0.022 2.131 -3.376 1.00 0.88 H new ATOM 0 HG2 PRO A 182 2.483 3.419 -2.089 1.00 0.65 H new ATOM 0 HG3 PRO A 182 1.596 2.009 -1.545 1.00 0.65 H new ATOM 0 HD2 PRO A 182 3.845 1.710 -3.051 1.00 0.60 H new ATOM 0 HD3 PRO A 182 2.496 0.609 -3.248 1.00 0.60 H new ATOM 2416 N LYS A 183 0.921 5.241 -5.657 1.00 0.50 N ATOM 2417 CA LYS A 183 1.080 6.578 -6.265 1.00 0.49 C ATOM 2418 C LYS A 183 -0.043 7.557 -5.870 1.00 0.59 C ATOM 2419 O LYS A 183 -1.102 7.148 -5.379 1.00 1.01 O ATOM 2420 CB LYS A 183 1.134 6.405 -7.797 1.00 0.55 C ATOM 2421 CG LYS A 183 2.367 5.610 -8.268 1.00 0.71 C ATOM 2422 CD LYS A 183 2.367 5.309 -9.775 1.00 1.43 C ATOM 2423 CE LYS A 183 1.695 3.977 -10.150 1.00 1.29 C ATOM 2424 NZ LYS A 183 0.224 3.990 -9.988 1.00 1.50 N ATOM 0 H LYS A 183 -0.029 4.887 -5.772 1.00 0.50 H new ATOM 0 HA LYS A 183 2.004 7.018 -5.890 1.00 0.49 H new ATOM 0 HB2 LYS A 183 0.230 5.896 -8.132 1.00 0.55 H new ATOM 0 HB3 LYS A 183 1.140 7.388 -8.268 1.00 0.55 H new ATOM 0 HG2 LYS A 183 3.268 6.171 -8.018 1.00 0.71 H new ATOM 0 HG3 LYS A 183 2.414 4.670 -7.718 1.00 0.71 H new ATOM 0 HD2 LYS A 183 1.858 6.120 -10.296 1.00 1.43 H new ATOM 0 HD3 LYS A 183 3.397 5.297 -10.132 1.00 1.43 H new ATOM 0 HE2 LYS A 183 1.936 3.737 -11.185 1.00 1.29 H new ATOM 0 HE3 LYS A 183 2.113 3.182 -9.533 1.00 1.29 H new ATOM 0 HZ1 LYS A 183 -0.187 3.175 -10.486 1.00 1.50 H new ATOM 0 HZ2 LYS A 183 -0.014 3.934 -8.977 1.00 1.50 H new ATOM 0 HZ3 LYS A 183 -0.161 4.870 -10.386 1.00 1.50 H new ATOM 2438 N ASN A 184 0.186 8.850 -6.117 0.49 0.43 N ATOM 2439 CA ASN A 184 -0.719 9.957 -5.772 0.49 0.52 C ATOM 2440 C ASN A 184 -1.404 10.593 -6.989 0.49 0.53 C ATOM 2441 O ASN A 184 -0.947 10.471 -8.125 0.49 0.66 O ATOM 2442 CB ASN A 184 0.057 11.038 -4.980 0.49 0.73 C ATOM 2443 CG ASN A 184 0.433 10.634 -3.575 0.49 1.98 C ATOM 2444 OD1 ASN A 184 0.411 9.475 -3.201 0.49 3.05 O ATOM 2445 ND2 ASN A 184 0.788 11.582 -2.744 0.49 2.47 N ATOM 0 H ASN A 184 1.037 9.169 -6.580 0.49 0.43 H new ATOM 0 HA ASN A 184 -1.514 9.530 -5.160 0.49 0.52 H new ATOM 0 HB2 ASN A 184 0.965 11.290 -5.528 0.49 0.73 H new ATOM 0 HB3 ASN A 184 -0.549 11.943 -4.935 0.49 0.73 H new ATOM 0 HD21 ASN A 184 1.046 11.349 -1.785 0.49 2.47 H new ATOM 0 HD22 ASN A 184 0.807 12.553 -3.056 0.49 2.47 H new ATOM 2452 N THR A 185 -2.497 11.303 -6.713 0.49 0.70 N ATOM 2453 CA THR A 185 -3.186 12.221 -7.629 0.49 0.91 C ATOM 2454 C THR A 185 -3.801 13.360 -6.809 0.49 1.56 C ATOM 2455 O THR A 185 -3.850 13.291 -5.578 0.49 3.15 O ATOM 2456 CB THR A 185 -4.256 11.523 -8.494 0.49 0.81 C ATOM 2457 OG1 THR A 185 -4.568 12.363 -9.583 0.49 1.32 O ATOM 2458 CG2 THR A 185 -5.564 11.247 -7.751 0.49 0.92 C ATOM 0 H THR A 185 -2.951 11.254 -5.801 0.49 0.70 H new ATOM 0 HA THR A 185 -2.451 12.614 -8.332 0.49 0.91 H new ATOM 0 HB THR A 185 -3.833 10.565 -8.797 0.49 0.81 H new ATOM 0 HG1 THR A 185 -5.246 11.933 -10.144 0.49 1.32 H new ATOM 0 HG21 THR A 185 -6.267 10.755 -8.423 0.49 0.92 H new ATOM 0 HG22 THR A 185 -5.367 10.601 -6.895 0.49 0.92 H new ATOM 0 HG23 THR A 185 -5.991 12.188 -7.404 0.49 0.92 H new